*HEADER    HYDROLASE, METAL BINDING PROTEIN        22-OCT-10   2L4Z              
*TITLE     NMR STRUCTURE OF FUSION OF CTIP (641-685) TO LMO4-LIM1 (18-82)        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DNA ENDONUCLEASE RBBP8, LIM DOMAIN TRANSCRIPTION FACTOR    
*COMPND   3 LMO4;                                                                
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 SYNONYM: CTBP-INTERACTING PROTEIN, CTIP, RETINOBLASTOMA-BINDING      
*COMPND   6 PROTEIN 8, RBBP-8, RIM, SAE2, LIM DOMAIN ONLY PROTEIN 4, LMO-4;      
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MUTATION: YES;                                                       
*COMPND   9 OTHER_DETAILS: THE FUSION PROTEIN OF CTIP (UNP 641-685), LINKER (901-
*COMPND  10 911) AND LMO4 (UNP 18-82)                                            
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS, UNDEFINED;                        
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606, 32644;                                         
*SOURCE   5 GENE: CTIP, LMO4, RBBP8;                                             
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PGEX-2T                                    
*KEYWDS    LIM DOMAIN, PROTEIN-PROTEIN INTERACTION, LIM-INTERACTION DOMAIN,      
*KEYWDS   2 LMO4, RBBP8/CTIP, LIM-ONLY PROTEIN, HYDROLASE, METAL BINDING PROTEIN 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.LIEW, P.H.STOKES, A.H.KWAN, J.M.MATTHEWS                            
*REVDAT   4   07-DEC-11 2L4Z    1       UPDATE CONSTRAINT DATA                            
*REVDAT   3   23-NOV-11 2L4Z    1       UPDATE CONSTRAINT DATA                            
*REVDAT   2   16-NOV-11 2L4Z    1       UPDATE CONSTRAINT DATA                            
*REVDAT   1   26-OCT-11 2L4Z    0                                                


 ASSI {   38}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 20   and name HZ3 ))
      6.000     4.700     0.000 peak    38 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.061 ppm2      6.939 CV     1
 OR {   38}
   (( segid "    " and resid 22   and name HD3 ))
   (( segid "    " and resid 20   and name HZ3 ))
 OR {   38}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 43   and name HZ3 ))
 ASSI {  210}
   (( segid "    " and resid 77   and name HD% ))
   (( segid "    " and resid 82   and name HN  ))
      6.000     4.700     0.000 peak   210 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.486 ppm2      7.789 CV     1
 OR {  210}
   (( segid "    " and resid 65   and name HD% ))
   (( segid "    " and resid 666  and name HN  ))
 ASSI {  989}
   (( segid "    " and resid 69   and name HA2 ))
   (( segid "    " and resid 39   and name HE% ))
      3.100     1.400     1.400 peak   989 spectrum    1 weight  0.10000E+01 volume  0.18360E-02 ppm1      3.611 ppm2      1.581 CV     1
 OR {  989}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 39   and name HE% ))
 OR {  989}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 74   and name HG2 ))
 OR {  989}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI {  998}
   (( segid "    " and resid 680  and name HE22))
   (( segid "    " and resid 680  and name HN  ))
      4.200     2.400     1.800 peak   998 spectrum    1 weight  0.10000E+01 volume  0.28616E-03 ppm1      6.827 ppm2      8.396 CV     1
 OR {  998}
   (( segid "    " and resid 666  and name HE% ))
   (( segid "    " and resid 663  and name HN  ))
 OR {  998}
   (( segid "    " and resid 680  and name HE22))
   (( segid "    " and resid 679  and name HN  ))
 OR {  998}
   (( segid "    " and resid 666  and name HE% ))
   (( segid "    " and resid 662  and name HN  ))
 ASSI {  999}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 22   and name HN  ))
      2.700     1.100     1.100 peak   999 spectrum    1 weight  0.10000E+01 volume  0.39146E-02 ppm1      1.274 ppm2      8.375 CV     1
 OR {  999}
   (( segid "    " and resid 22   and name HG3 ))
   (( segid "    " and resid 22   and name HN  ))
 ASSI { 1001}
   (( segid "    " and resid 648  and name HG2%))
   (( segid "    " and resid 649  and name HN  ))
      2.800     1.200     1.200 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.30218E-02 ppm1      0.859 ppm2      8.365 CV     1
 OR { 1001}
   (( segid "    " and resid 648  and name HG1%))
   (( segid "    " and resid 649  and name HN  ))
 OR { 1001}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 22   and name HN  ))
 ASSI { 1002}
   (( segid "    " and resid 649  and name HA  ))
   (( segid "    " and resid 650  and name HN  ))
      6.000     4.700     0.000 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.411 ppm2      8.302 CV     1
 OR { 1002}
   (( segid "    " and resid 681  and name HA  ))
   (( segid "    " and resid 681  and name HN  ))
 ASSI { 1003}
   (( segid "    " and resid 651  and name HB2 ))
   (( segid "    " and resid 651  and name HN  ))
      4.200     2.400     1.800 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.27242E-03 ppm1      2.087 ppm2      8.321 CV     1
 OR { 1003}
   (( segid "    " and resid 651  and name HB2 ))
   (( segid "    " and resid 652  and name HN  ))
 ASSI { 1004}
   (( segid "    " and resid 650  and name HD% ))
   (( segid "    " and resid 653  and name HN  ))
      4.400     2.600     1.600 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.20740E-03 ppm1      7.235 ppm2      7.968 CV     1
 OR { 1004}
   (( segid "    " and resid 655  and name HD1 ))
   (( segid "    " and resid 653  and name HN  ))
 OR { 1004}
   (( segid "    " and resid 54   and name HE21))
   (( segid "    " and resid 54   and name HN  ))
 ASSI { 1009}
   (( segid "    " and resid 650  and name HA  ))
   (( segid "    " and resid 650  and name HD% ))
      2.500     1.000     1.000 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.58605E-02 ppm1      4.574 ppm2      7.229 CV     1
 OR { 1009}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 42   and name HD% ))
 ASSI { 1010}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 42   and name HD% ))
      3.400     1.600     1.600 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.10256E-02 ppm1      4.182 ppm2      7.229 CV     1
 OR { 1010}
   (( segid "    " and resid 651  and name HA  ))
   (( segid "    " and resid 650  and name HD% ))
 OR { 1010}
   (( segid "    " and resid 664  and name HA  ))
   (( segid "    " and resid 666  and name HD% ))
 OR { 1010}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 666  and name HD% ))
 ASSI { 1016}
   (( segid "    " and resid 653  and name HG2%))
   (( segid "    " and resid 652  and name HD22))
      4.300     2.500     1.700 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.25182E-03 ppm1      0.624 ppm2      7.577 CV     1
 OR { 1016}
   (( segid "    " and resid 653  and name HG2%))
   (( segid "    " and resid 655  and name HE3 ))
 ASSI { 1022}
   (( segid "    " and resid 65   and name HD% ))
   (( segid "    " and resid 666  and name HD% ))
      3.400     1.600     1.600 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.10324E-02 ppm1      6.486 ppm2      7.255 CV     1
 OR { 1022}
   (( segid "    " and resid 77   and name HD% ))
   (( segid "    " and resid 666  and name HD% ))
 ASSI { 1026}
   (( segid "    " and resid 663  and name HB2 ))
   (( segid "    " and resid 666  and name HD% ))
      2.800     1.200     1.200 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.29074E-02 ppm1      1.615 ppm2      7.255 CV     1
 OR { 1026}
   (( segid "    " and resid 665  and name HB3 ))
   (( segid "    " and resid 666  and name HD% ))
 OR { 1026}
   (( segid "    " and resid 46   and name HG3 ))
   (( segid "    " and resid 44   and name HE1 ))
 ASSI { 1029}
   (( segid "    " and resid 25   and name HA1 ))
   (( segid "    " and resid 43   and name HH2 ))
      3.400     1.700     1.700 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.96836E-03 ppm1      4.311 ppm2      7.194 CV     1
 OR { 1029}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 667  and name HN  ))
 OR { 1029}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HD1 ))
 OR { 1029}
   (( segid "    " and resid 668  and name HA  ))
   (( segid "    " and resid 667  and name HN  ))
 ASSI { 1032}
   (( segid "    " and resid 31   and name HB% ))
   (( segid "    " and resid 20   and name HH2 ))
      6.000     4.700     0.000 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.274 ppm2      7.192 CV     1
 OR { 1032}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 20   and name HH2 ))
 ASSI { 1035}
   (( segid "    " and resid 670  and name HG2%))
   (( segid "    " and resid 669  and name HN  ))
      3.600     1.800     1.800 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.68219E-03 ppm1      0.647 ppm2      8.509 CV     1
 OR { 1035}
   (( segid "    " and resid 663  and name HD1%))
   (( segid "    " and resid 75   and name HN  ))
 ASSI { 1038}
   (( segid "    " and resid 673  and name HD1%))
   (( segid "    " and resid 672  and name HN  ))
      3.300     1.600     1.600 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.11744E-02 ppm1      0.845 ppm2      8.965 CV     1
 OR { 1038}
   (( segid "    " and resid 673  and name HD1%))
   (( segid "    " and resid 671  and name HN  ))
 OR { 1038}
   (( segid "    " and resid 78   and name HD1%))
   (( segid "    " and resid 77   and name HN  ))
 OR { 1038}
   (( segid "    " and resid 36   and name HD2%))
   (( segid "    " and resid 672  and name HN  ))
 OR { 1038}
   (( segid "    " and resid 36   and name HD2%))
   (( segid "    " and resid 671  and name HN  ))
 ASSI { 1040}
   (( segid "    " and resid 65   and name HE% ))
   (( segid "    " and resid 663  and name HN  ))
      3.500     1.800     1.800 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.80353E-03 ppm1      6.431 ppm2      8.376 CV     1
 OR { 1040}
   (( segid "    " and resid 65   and name HE% ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 1041}
   (( segid "    " and resid 65   and name HD% ))
   (( segid "    " and resid 64   and name HN  ))
      3.500     1.700     1.700 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.91571E-03 ppm1      6.488 ppm2      8.376 CV     1
 OR { 1041}
   (( segid "    " and resid 65   and name HD% ))
   (( segid "    " and resid 663  and name HN  ))
 ASSI { 1051}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      3.200     1.500     1.500 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.13895E-02 ppm1      8.606 ppm2      9.138 CV     1
 OR { 1051}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
 ASSI { 1052}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 28   and name HN  ))
      2.900     1.300     1.300 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.25868E-02 ppm1      3.351 ppm2      9.138 CV     1
 OR { 1052}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 28   and name HN  ))
 ASSI { 1053}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 28   and name HN  ))
      3.600     1.900     1.900 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.67532E-03 ppm1      2.264 ppm2      9.138 CV     1
 OR { 1053}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI { 1054}
   (( segid "    " and resid 35   and name HD2%))
   (( segid "    " and resid 30   and name HN  ))
      5.000     3.300     1.000 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.10324E-03 ppm1      0.762 ppm2      8.606 CV     1
 OR { 1054}
   (( segid "    " and resid 35   and name HD2%))
   (( segid "    " and resid 23   and name HN  ))
 OR { 1054}
   (( segid "    " and resid 18   and name HD2%))
   (( segid "    " and resid 30   and name HN  ))
 ASSI { 1055}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 49   and name HN  ))
      3.400     1.600     1.600 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.10119E-02 ppm1      0.436 ppm2      7.454 CV     1
 OR { 1055}
   (( segid "    " and resid 57   and name HD2%))
   (( segid "    " and resid 49   and name HN  ))
 ASSI { 1058}
   (( segid "    " and resid 71   and name HG2%))
   (( segid "    " and resid 50   and name HN  ))
      4.800     3.100     1.200 peak  1058 spectrum    1 weight  0.10000E+01 volume  0.12522E-03 ppm1      0.590 ppm2      8.667 CV     1
 OR { 1058}
   (( segid "    " and resid 71   and name HG2%))
   (( segid "    " and resid 668  and name HN  ))
 ASSI { 1060}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 51   and name HN  ))
      3.700     1.900     1.900 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.61123E-03 ppm1      1.913 ppm2     10.074 CV     1
 OR { 1060}
   (( segid "    " and resid 70   and name HB3 ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI { 1061}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 51   and name HN  ))
      3.400     1.600     1.600 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.10600E-02 ppm1      1.694 ppm2     10.074 CV     1
 OR { 1061}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI { 1072}
   (( segid "    " and resid 675  and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      4.300     2.500     1.700 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.24953E-03 ppm1      8.682 ppm2      9.096 CV     1
 OR { 1072}
   (( segid "    " and resid 674  and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
 ASSI { 1074}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      3.900     2.100     2.100 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.42580E-03 ppm1      4.548 ppm2      9.096 CV     1
 OR { 1074}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
 OR { 1074}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
 ASSI { 1075}
   (( segid "    " and resid 675  and name HG2%))
   (( segid "    " and resid 35   and name HN  ))
      3.200     1.500     1.500 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.14079E-02 ppm1      1.226 ppm2      9.095 CV     1
 OR { 1075}
   (( segid "    " and resid 673  and name HG13))
   (( segid "    " and resid 35   and name HN  ))
 ASSI { 1076}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 69   and name HN  ))
      4.100     2.300     1.900 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.34110E-03 ppm1      0.667 ppm2      8.785 CV     1
 OR { 1076}
   (( segid "    " and resid 670  and name HG2%))
   (( segid "    " and resid 36   and name HN  ))
 OR { 1076}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 69   and name HN  ))
 OR { 1076}
   (( segid "    " and resid 57   and name HD1%))
   (( segid "    " and resid 63   and name HN  ))
 ASSI { 1082}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 42   and name HE% ))
      3.500     1.700     1.700 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.90658E-03 ppm1      4.567 ppm2      6.705 CV     1
 OR { 1082}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 37   and name HD% ))
 OR { 1082}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 37   and name HD% ))
 ASSI { 1084}
   (( segid "    " and resid 671  and name HG2%))
   (( segid "    " and resid 37   and name HD% ))
      2.900     1.300     1.300 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.25182E-02 ppm1      1.262 ppm2      6.705 CV     1
 OR { 1084}
   (( segid "    " and resid 673  and name HG13))
   (( segid "    " and resid 37   and name HD% ))
 ASSI { 1086}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 42   and name HE% ))
      2.700     1.100     1.100 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.42351E-02 ppm1      0.944 ppm2      6.705 CV     1
 OR { 1086}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 42   and name HE% ))
 OR { 1086}
   (( segid "    " and resid 35   and name HD1%))
   (( segid "    " and resid 42   and name HE% ))
 ASSI { 1087}
   (( segid "    " and resid 35   and name HD1%))
   (( segid "    " and resid 37   and name HE% ))
      3.700     1.900     1.900 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.60436E-03 ppm1      0.943 ppm2      6.398 CV     1
 OR { 1087}
   (( segid "    " and resid 672  and name HG2%))
   (( segid "    " and resid 37   and name HE% ))
 OR { 1087}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 37   and name HE% ))
 ASSI { 1089}
   (( segid "    " and resid 30   and name HD1%))
   (( segid "    " and resid 42   and name HE% ))
      4.300     2.600     1.700 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.23350E-03 ppm1      0.424 ppm2      6.704 CV     1
 OR { 1089}
   (( segid "    " and resid 30   and name HD1%))
   (( segid "    " and resid 37   and name HD% ))
 OR { 1089}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 37   and name HD% ))
 ASSI { 1098}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 41   and name HN  ))
      3.700     1.900     1.900 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.57460E-03 ppm1      2.394 ppm2      9.561 CV     1
 OR { 1098}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI { 1099}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 41   and name HN  ))
      4.100     2.300     1.900 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.31134E-03 ppm1      2.491 ppm2      9.561 CV     1
 OR { 1099}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 41   and name HN  ))
 OR { 1099}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 43   and name HE1 ))
 OR { 1099}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI { 1100}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 41   and name HN  ))
      3.800     2.000     2.000 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.55858E-03 ppm1      2.123 ppm2      9.562 CV     1
 OR { 1100}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI { 1102}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 42   and name HD% ))
      4.000     2.200     2.000 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.36857E-03 ppm1      2.872 ppm2      7.232 CV     1
 OR { 1102}
   (( segid "    " and resid 662  and name HB2 ))
   (( segid "    " and resid 666  and name HD% ))
 OR { 1102}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 74   and name HE  ))
 OR { 1102}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 74   and name HE  ))
 OR { 1102}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 666  and name HD% ))
 ASSI { 1103}
   (( segid "    " and resid 35   and name HD1%))
   (( segid "    " and resid 42   and name HD% ))
      2.500     1.000     1.000 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.69136E-02 ppm1      0.945 ppm2      7.232 CV     1
 OR { 1103}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 42   and name HD% ))
 OR { 1103}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 42   and name HD% ))
 ASSI { 1105}
   (( segid "    " and resid 653  and name HG2%))
   (( segid "    " and resid 655  and name HD1 ))
      6.000     4.700     0.000 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.634 ppm2      7.232 CV     1
 OR { 1105}
   (( segid "    " and resid 663  and name HD1%))
   (( segid "    " and resid 666  and name HD% ))
 ASSI { 1106}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 655  and name HD1 ))
      4.100     2.300     1.900 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.32507E-03 ppm1      4.249 ppm2      7.232 CV     1
 OR { 1106}
   (( segid "    " and resid 27   and name HA1 ))
   (( segid "    " and resid 22   and name HE  ))
 OR { 1106}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 650  and name HD% ))
 ASSI { 1109}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 54   and name HE22))
      6.000     4.700     0.000 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.128 ppm2      6.705 CV     1
 OR { 1109}
   (( segid "    " and resid 46   and name HD3 ))
   (( segid "    " and resid 54   and name HE22))
 OR { 1109}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 42   and name HE% ))
 ASSI { 1117}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      6.000     4.700     0.000 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.431 ppm2      9.263 CV     1
 OR { 1117}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI { 1123}
   (( segid "    " and resid 36   and name HD1%))
   (( segid "    " and resid 45   and name HN  ))
      3.200     1.500     1.500 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.13438E-02 ppm1      0.892 ppm2     10.031 CV     1
 OR { 1123}
   (( segid "    " and resid 30   and name HG2%))
   (( segid "    " and resid 45   and name HN  ))
 ASSI { 1125}
   (( segid "    " and resid 36   and name HD1%))
   (( segid "    " and resid 48   and name HN  ))
      3.400     1.600     1.600 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.10119E-02 ppm1      0.887 ppm2      7.030 CV     1
 OR { 1125}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 81   and name HZ  ))
 OR { 1125}
   (( segid "    " and resid 36   and name HD2%))
   (( segid "    " and resid 48   and name HN  ))
 ASSI { 1126}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 81   and name HZ  ))
      6.000     4.700     0.000 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.043 ppm2      7.033 CV     1
 OR { 1126}
   (( segid "    " and resid 49   and name HG3 ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI { 1139}
   (( segid "    " and resid 48   and name HD2%))
   (( segid "    " and resid 48   and name HN  ))
      2.900     1.200     1.200 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.27013E-02 ppm1     -0.815 ppm2      7.059 CV     1
 OR { 1139}
   (( segid "    " and resid 48   and name HD2%))
   (( segid "    " and resid 43   and name HZ2 ))
 ASSI { 1141}
   (( segid "    " and resid 80   and name HD2%))
   (( segid "    " and resid 81   and name HE% ))
      6.000     4.700     0.000 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.581 ppm2      7.060 CV     1
 OR { 1141}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI { 1146}
   (( segid "    " and resid 42   and name HD% ))
   (( segid "    " and resid 22   and name HN  ))
      6.000     4.700     0.000 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.234 ppm2      8.373 CV     1
 OR { 1146}
   (( segid "    " and resid 650  and name HD% ))
   (( segid "    " and resid 649  and name HN  ))
 OR { 1146}
   (( segid "    " and resid 666  and name HD% ))
   (( segid "    " and resid 663  and name HN  ))
 ASSI { 1148}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      4.500     2.700     1.500 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.19252E-03 ppm1      4.160 ppm2      9.245 CV     1
 OR { 1148}
   (( segid "    " and resid 69   and name HA1 ))
   (( segid "    " and resid 68   and name HN  ))
 ASSI { 1152}
   (( segid "    " and resid 77   and name HD% ))
   (( segid "    " and resid 72   and name HN  ))
      3.700     1.900     1.900 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.65701E-03 ppm1      6.478 ppm2      9.479 CV     1
 OR { 1152}
   (( segid "    " and resid 65   and name HD% ))
   (( segid "    " and resid 72   and name HN  ))
 ASSI { 1162}
   (( segid "    " and resid 18   and name HD1%))
   (( segid "    " and resid 910  and name HN  ))
      4.300     2.500     1.700 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.25411E-03 ppm1      0.803 ppm2      8.517 CV     1
 OR { 1162}
   (( segid "    " and resid 683  and name HD1%))
   (( segid "    " and resid 678  and name HN  ))
 OR { 1162}
   (( segid "    " and resid 683  and name HD2%))
   (( segid "    " and resid 678  and name HN  ))
 OR { 1162}
   (( segid "    " and resid 673  and name HG2%))
   (( segid "    " and resid 33   and name HN  ))
 OR { 1162}
   (( segid "    " and resid 673  and name HG2%))
   (( segid "    " and resid 678  and name HN  ))
 OR { 1162}
   (( segid "    " and resid 673  and name HD1%))
   (( segid "    " and resid 33   and name HN  ))
 ASSI { 1166}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.700     0.000 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.691 ppm2      8.960 CV     1
 OR { 1166}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 77   and name HN  ))
 ASSI { 1167}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 77   and name HN  ))
      6.000     4.700     0.000 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.353 ppm2      8.961 CV     1
 OR { 1167}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 672  and name HN  ))
 OR { 1167}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI { 1168}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.700     0.000 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.570 ppm2      8.988 CV     1
 OR { 1168}
   (( segid "    " and resid 57   and name HG  ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI { 1169}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 77   and name HE% ))
      3.400     1.600     1.600 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.10072E-02 ppm1      4.331 ppm2      6.198 CV     1
 OR { 1169}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 77   and name HE% ))
 ASSI { 1170}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 77   and name HD% ))
      6.000     4.700     0.000 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.341 ppm2      6.466 CV     1
 OR { 1170}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 77   and name HD% ))
 OR { 1170}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 77   and name HD% ))
 ASSI { 1180}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 77   and name HD% ))
      6.000     4.700     0.000 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.902 ppm2      6.466 CV     1
 OR { 1180}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 77   and name HD% ))
 ASSI { 1184}
   (( segid "    " and resid 81   and name HB3 ))
   (( segid "    " and resid 77   and name HE% ))
      3.500     1.800     1.800 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.81497E-03 ppm1      1.754 ppm2      6.199 CV     1
 OR { 1184}
   (( segid "    " and resid 78   and name HG12))
   (( segid "    " and resid 77   and name HE% ))
 ASSI { 1187}
   (( segid "    " and resid 72   and name HD2%))
   (( segid "    " and resid 77   and name HE% ))
      3.100     1.400     1.400 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.18864E-02 ppm1      1.113 ppm2      6.199 CV     1
 OR { 1187}
   (( segid "    " and resid 66   and name HG2%))
   (( segid "    " and resid 77   and name HE% ))
 ASSI { 1199}
   (( segid "    " and resid 665  and name HE22))
   (( segid "    " and resid 665  and name HN  ))
      3.900     2.100     2.100 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.44640E-03 ppm1      6.834 ppm2      8.280 CV     1
 OR { 1199}
   (( segid "    " and resid 666  and name HE% ))
   (( segid "    " and resid 665  and name HN  ))
 OR { 1199}
   (( segid "    " and resid 81   and name HD% ))
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 1200}
   (( segid "    " and resid 663  and name HD1%))
   (( segid "    " and resid 78   and name HN  ))
      4.300     2.500     1.700 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.24495E-03 ppm1      0.636 ppm2      8.279 CV     1
 OR { 1200}
   (( segid "    " and resid 663  and name HD1%))
   (( segid "    " and resid 665  and name HN  ))
 OR { 1200}
   (( segid "    " and resid 80   and name HD1%))
   (( segid "    " and resid 78   and name HN  ))
 OR { 1200}
   (( segid "    " and resid 670  and name HG2%))
   (( segid "    " and resid 60   and name HN  ))
 ASSI { 1201}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 666  and name HN  ))
      6.000     4.700     0.000 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.751 ppm2      7.816 CV     1
 OR { 1201}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
 ASSI { 1202}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 79   and name HN  ))
      3.800     2.000     2.000 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.51508E-03 ppm1      0.109 ppm2      7.816 CV     1
 OR { 1202}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 82   and name HN  ))
 ASSI { 1203}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 47   and name HN  ))
      5.900     4.500     0.100 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.38002E-04 ppm1      0.560 ppm2      7.816 CV     1
 OR { 1203}
   (( segid "    " and resid 80   and name HD2%))
   (( segid "    " and resid 79   and name HN  ))
 OR { 1203}
   (( segid "    " and resid 80   and name HD2%))
   (( segid "    " and resid 82   and name HN  ))
 ASSI { 1206}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 81   and name HN  ))
      6.000     4.700     0.000 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.985 ppm2      8.107 CV     1
 OR { 1206}
   (( segid "    " and resid 25   and name HA2 ))
   (( segid "    " and resid 27   and name HN  ))
 ASSI { 1210}
   (( segid "    " and resid 81   and name HD% ))
   (( segid "    " and resid 82   and name HN  ))
      3.400     1.700     1.700 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.93633E-03 ppm1      6.849 ppm2      7.809 CV     1
 OR { 1210}
   (( segid "    " and resid 666  and name HE% ))
   (( segid "    " and resid 666  and name HN  ))
 ASSI { 1212}
   (( segid "    " and resid 60   and name HG12))
   (( segid "    " and resid 59   and name HN  ))
      3.500     1.800     1.800 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.78979E-03 ppm1      1.532 ppm2      7.717 CV     1
 OR { 1212}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 80   and name HN  ))
 ASSI { 1214}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 65   and name HE% ))
      6.000     4.700     0.000 peak  1214 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.340 ppm2      6.427 CV     1
 OR { 1214}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 65   and name HE% ))
 ASSI { 1215}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 65   and name HD% ))
      6.000     4.700     0.000 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.341 ppm2      6.488 CV     1
 OR { 1215}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 77   and name HD% ))
 OR { 1215}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 77   and name HD% ))
 OR { 1215}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 77   and name HD% ))
 ASSI { 1246}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 43   and name HD1 ))
      6.000     4.700     0.000 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.697 ppm2      6.958 CV     1
 OR { 1246}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 43   and name HD1 ))
 ASSI { 1249}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 43   and name HD1 ))
      3.900     2.100     2.100 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.43953E-03 ppm1      1.857 ppm2      6.960 CV     1
 OR { 1249}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 43   and name HD1 ))
 ASSI { 1250}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 43   and name HZ3 ))
      6.000     4.700     0.000 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.593 ppm2      6.959 CV     1
 OR { 1250}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 43   and name HD1 ))
 OR { 1250}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 43   and name HD1 ))
 ASSI { 1251}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 43   and name HD1 ))
      2.900     1.300     1.300 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.26097E-02 ppm1      1.157 ppm2      6.958 CV     1
 OR { 1251}
   (( segid "    " and resid 29   and name HD3 ))
   (( segid "    " and resid 20   and name HZ3 ))
 ASSI { 1252}
   (( segid "    " and resid 30   and name HG2%))
   (( segid "    " and resid 20   and name HZ3 ))
      3.700     1.900     1.900 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.58833E-03 ppm1      0.894 ppm2      6.958 CV     1
 OR { 1252}
   (( segid "    " and resid 36   and name HD1%))
   (( segid "    " and resid 43   and name HD1 ))
 ASSI { 1253}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 43   and name HD1 ))
      3.800     2.000     2.000 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.55171E-03 ppm1      0.429 ppm2      6.959 CV     1
 OR { 1253}
   (( segid "    " and resid 30   and name HD1%))
   (( segid "    " and resid 43   and name HD1 ))
 OR { 1253}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 43   and name HZ3 ))
 ASSI { 1260}
   (( segid "    " and resid 25   and name HA1 ))
   (( segid "    " and resid 43   and name HZ3 ))
      2.600     1.000     1.000 peak  1260 spectrum    1 weight  0.10000E+01 volume  0.51050E-02 ppm1      4.326 ppm2      6.939 CV     1
 OR { 1260}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 20   and name HZ3 ))
 ASSI { 1261}
   (( segid "    " and resid 35   and name HD2%))
   (( segid "    " and resid 42   and name HE% ))
      6.000     4.700     0.000 peak  1261 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.770 ppm2      6.706 CV     1
 OR { 1261}
   (( segid "    " and resid 35   and name HD2%))
   (( segid "    " and resid 37   and name HD% ))
 OR { 1261}
   (( segid "    " and resid 673  and name HG2%))
   (( segid "    " and resid 37   and name HD% ))
 ASSI { 1266}
   (( segid "    " and resid 46   and name HD3 ))
   (( segid "    " and resid 44   and name HE1 ))
      3.400     1.600     1.600 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.10348E-02 ppm1      3.116 ppm2      7.285 CV     1
 OR { 1266}
   (( segid "    " and resid 674  and name HB2 ))
   (( segid "    " and resid 34   and name HD% ))
 OR { 1266}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 44   and name HE1 ))
 ASSI { 1268}
   (( segid "    " and resid 674  and name HB3 ))
   (( segid "    " and resid 34   and name HE% ))
      2.500     1.000     1.000 peak  1268 spectrum    1 weight  0.10000E+01 volume  0.57460E-02 ppm1      2.676 ppm2      7.340 CV     1
 OR { 1268}
   (( segid "    " and resid 33   and name HD3 ))
   (( segid "    " and resid 34   and name HE% ))
 ASSI { 1283}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 20   and name HE3 ))
      3.400     1.600     1.600 peak  1283 spectrum    1 weight  0.10000E+01 volume  0.10508E-02 ppm1      4.305 ppm2      7.382 CV     1
 OR { 1283}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HE3 ))
 ASSI { 1284}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 20   and name HE3 ))
      3.800     2.000     2.000 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.48532E-03 ppm1      4.185 ppm2      7.382 CV     1
 OR { 1284}
   (( segid "    " and resid 664  and name HA  ))
   (( segid "    " and resid 665  and name HE21))
 ASSI { 1288}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 20   and name HE3 ))
      3.000     1.300     1.300 peak  1288 spectrum    1 weight  0.10000E+01 volume  0.21107E-02 ppm1      1.259 ppm2      7.382 CV     1
 OR { 1288}
   (( segid "    " and resid 31   and name HB% ))
   (( segid "    " and resid 20   and name HE3 ))
 ASSI { 1290}
   (( segid "    " and resid 18   and name HD2%))
   (( segid "    " and resid 20   and name HE3 ))
      4.400     2.600     1.600 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.22893E-03 ppm1      0.756 ppm2      7.381 CV     1
 OR { 1290}
   (( segid "    " and resid 35   and name HD2%))
   (( segid "    " and resid 20   and name HE3 ))
 ASSI { 1297}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 20   and name HE1 ))
      6.000     4.700     0.000 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.274 ppm2     10.173 CV     1
 OR { 1297}
   (( segid "    " and resid 31   and name HB% ))
   (( segid "    " and resid 20   and name HE1 ))
 OR { 1297}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 20   and name HE1 ))
 ASSI { 1300}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 666  and name HE% ))
      3.000     1.300     1.300 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.22092E-02 ppm1      4.330 ppm2      6.819 CV     1
 OR { 1300}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 666  and name HE% ))
 ASSI { 1301}
   (( segid "    " and resid 665  and name HB3 ))
   (( segid "    " and resid 665  and name HE22))
      3.100     1.400     1.400 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.19070E-02 ppm1      1.622 ppm2      6.819 CV     1
 OR { 1301}
   (( segid "    " and resid 665  and name HB3 ))
   (( segid "    " and resid 666  and name HE% ))
 ASSI { 1306}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 74   and name HE  ))
      2.900     1.200     1.200 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.28845E-02 ppm1      1.451 ppm2      7.255 CV     1
 OR { 1306}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HE  ))
 ASSI { 1307}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 666  and name HD% ))
      2.700     1.100     1.100 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.38689E-02 ppm1      4.334 ppm2      7.257 CV     1
 OR { 1307}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 666  and name HD% ))
 ASSI { 1309}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 20   and name HZ2 ))
      3.400     1.600     1.600 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.10049E-02 ppm1      1.516 ppm2      7.457 CV     1
 OR { 1309}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 20   and name HZ2 ))
 OR { 1309}
   (( segid "    " and resid 57   and name HG  ))
   (( segid "    " and resid 49   and name HN  ))
 OR { 1309}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 20   and name HZ2 ))
 ASSI { 1322}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 81   and name HE% ))
      4.200     2.400     1.800 peak  1322 spectrum    1 weight  0.10000E+01 volume  0.29532E-03 ppm1      1.432 ppm2      7.083 CV     1
 OR { 1322}
   (( segid "    " and resid 80   and name HG  ))
   (( segid "    " and resid 81   and name HE% ))
 ASSI { 1337}
   (( segid "    " and resid 662  and name HA  ))
   (( segid "    " and resid 661  and name HB% ))
      3.900     2.100     2.100 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.41206E-03 ppm1      4.657 ppm2      1.415 CV     1
 OR { 1337}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 80   and name HG  ))
 ASSI { 1338}
   (( segid "    " and resid 658  and name HB2 ))
   (( segid "    " and resid 661  and name HB% ))
      3.000     1.300     1.300 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.21130E-02 ppm1      2.770 ppm2      1.415 CV     1
 OR { 1338}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 1340}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 30   and name HD1%))
      3.900     2.100     2.100 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.42580E-03 ppm1      4.178 ppm2      0.420 CV     1
 OR { 1340}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 57   and name HD2%))
 ASSI { 1349}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 30   and name HG12))
      3.200     1.500     1.500 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.14560E-02 ppm1      5.709 ppm2      1.228 CV     1
 OR { 1349}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 36   and name HB3 ))
 ASSI { 1351}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 78   and name HG13))
      4.000     2.200     2.000 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.38917E-03 ppm1      3.734 ppm2      1.225 CV     1
 OR { 1351}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 675  and name HG2%))
 OR { 1351}
   (( segid "    " and resid 58   and name HA1 ))
   (( segid "    " and resid 36   and name HB3 ))
 ASSI { 1353}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 48   and name HD1%))
      4.400     2.600     1.600 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.21519E-03 ppm1      4.530 ppm2      0.116 CV     1
 OR { 1353}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 48   and name HD1%))
 OR { 1353}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 48   and name HD1%))
 ASSI { 1362}
   (( segid "    " and resid 29   and name HE2 ))
   (( segid "    " and resid 18   and name HD2%))
      3.400     1.600     1.600 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.99810E-03 ppm1      2.464 ppm2      0.751 CV     1
 OR { 1362}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 18   and name HD2%))
 OR { 1362}
   (( segid "    " and resid 21   and name HE3 ))
   (( segid "    " and resid 35   and name HD2%))
 OR { 1362}
   (( segid "    " and resid 21   and name HE2 ))
   (( segid "    " and resid 35   and name HD2%))
 ASSI { 1364}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HG2%))
      2.700     1.100     1.100 peak  1364 spectrum    1 weight  0.10000E+01 volume  0.38460E-02 ppm1      4.304 ppm2      1.138 CV     1
 OR { 1364}
   (( segid "    " and resid 668  and name HA  ))
   (( segid "    " and resid 66   and name HG2%))
 OR { 1364}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 72   and name HD1%))
 ASSI { 1376}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 653  and name HG2%))
      3.600     1.800     1.800 peak  1376 spectrum    1 weight  0.10000E+01 volume  0.75774E-03 ppm1      4.258 ppm2      0.637 CV     1
 OR { 1376}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 71   and name HD1%))
 OR { 1376}
   (( segid "    " and resid 671  and name HB  ))
   (( segid "    " and resid 670  and name HG2%))
 OR { 1376}
   (( segid "    " and resid 661  and name HA  ))
   (( segid "    " and resid 663  and name HD1%))
 ASSI { 1377}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 57   and name HD1%))
      6.000     4.700     0.000 peak  1377 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.258 ppm2      0.674 CV     1
 OR { 1377}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 57   and name HD1%))
 ASSI { 1387}
   (( segid "    " and resid 35   and name HG  ))
   (( segid "    " and resid 30   and name HD1%))
      6.000     4.700     0.000 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.687 ppm2      0.420 CV     1
 OR { 1387}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 57   and name HD2%))
 OR { 1387}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 57   and name HD2%))
 OR { 1387}
   (( segid "    " and resid 49   and name HD2 ))
   (( segid "    " and resid 57   and name HD2%))
 OR { 1387}
   (( segid "    " and resid 49   and name HD3 ))
   (( segid "    " and resid 48   and name HB3 ))
 ASSI { 1388}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 30   and name HD1%))
      6.000     4.700     0.000 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.868 ppm2      0.420 CV     1
 OR { 1388}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 48   and name HB3 ))
 OR { 1388}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 57   and name HD2%))
 OR { 1388}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 48   and name HB3 ))
 ASSI { 1395}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 48   and name HB3 ))
      2.800     1.200     1.200 peak  1395 spectrum    1 weight  0.10000E+01 volume  0.32278E-02 ppm1      3.462 ppm2      0.420 CV     1
 OR { 1395}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 57   and name HD2%))
 ASSI { 1397}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HD2%))
      4.800     3.100     1.200 peak  1397 spectrum    1 weight  0.10000E+01 volume  0.12935E-03 ppm1      4.091 ppm2      0.420 CV     1
 OR { 1397}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name HD2%))
 ASSI { 1399}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HD2%))
      3.000     1.300     1.300 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.22092E-02 ppm1      4.522 ppm2      0.420 CV     1
 OR { 1399}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 30   and name HD1%))
 ASSI { 1401}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 30   and name HD1%))
      2.800     1.200     1.200 peak  1401 spectrum    1 weight  0.10000E+01 volume  0.33652E-02 ppm1      5.709 ppm2      0.420 CV     1
 OR { 1401}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 30   and name HD1%))
 ASSI { 1402}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 57   and name HD2%))
      3.100     1.400     1.400 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.18864E-02 ppm1      5.040 ppm2      0.420 CV     1
 OR { 1402}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 48   and name HB3 ))
 ASSI { 1404}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 30   and name HD1%))
      3.300     1.600     1.600 peak  1404 spectrum    1 weight  0.10000E+01 volume  0.11331E-02 ppm1      4.876 ppm2      0.420 CV     1
 OR { 1404}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 48   and name HB3 ))
 ASSI { 1406}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HG  ))
      3.500     1.700     1.700 peak  1406 spectrum    1 weight  0.10000E+01 volume  0.85157E-03 ppm1      4.077 ppm2      1.544 CV     1
 OR { 1406}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 60   and name HG12))
 OR { 1406}
   (( segid "    " and resid 675  and name HA  ))
   (( segid "    " and resid 676  and name HD3 ))
 ASSI { 1408}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HB2 ))
      6.000     4.700     0.000 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.504 ppm2      2.227 CV     1
 OR { 1408}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HG3 ))
 ASSI { 1409}
   (( segid "    " and resid 666  and name HB3 ))
   (( segid "    " and resid 67   and name HG3 ))
      3.200     1.500     1.500 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.15429E-02 ppm1      2.506 ppm2      0.644 CV     1
 OR { 1409}
   (( segid "    " and resid 666  and name HB3 ))
   (( segid "    " and resid 663  and name HD1%))
 OR { 1409}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 71   and name HD1%))
 OR { 1409}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 71   and name HD1%))
 ASSI { 1415}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HD2%))
      3.700     2.000     2.000 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.56316E-03 ppm1      5.824 ppm2      0.758 CV     1
 OR { 1415}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 673  and name HG2%))
 ASSI { 1424}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 36   and name HD2%))
      3.000     1.300     1.300 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.22893E-02 ppm1      4.551 ppm2      0.853 CV     1
 OR { 1424}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 60   and name HD1%))
 ASSI { 1428}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 670  and name HG1%))
      6.000     4.700     0.000 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.156 ppm2      0.720 CV     1
 OR { 1428}
   (( segid "    " and resid 667  and name HG3 ))
   (( segid "    " and resid 663  and name HD2%))
 OR { 1428}
   (( segid "    " and resid 667  and name HG2 ))
   (( segid "    " and resid 663  and name HD2%))
 OR { 1428}
   (( segid "    " and resid 66   and name HG2%))
   (( segid "    " and resid 663  and name HD2%))
 OR { 1428}
   (( segid "    " and resid 66   and name HG2%))
   (( segid "    " and resid 670  and name HG1%))
 ASSI { 1432}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 35   and name HD1%))
      6.000     4.700     0.000 peak  1432 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.764 ppm2      0.943 CV     1
 OR { 1432}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 21   and name HD2 ))
 OR { 1432}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 21   and name HD3 ))
 ASSI { 1433}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 35   and name HD1%))
      6.000     4.700     0.000 peak  1433 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.691 ppm2      0.944 CV     1
 OR { 1433}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 672  and name HG2%))
 OR { 1433}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 21   and name HD2 ))
 ASSI { 1435}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 35   and name HD1%))
      3.000     1.300     1.300 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.20511E-02 ppm1      5.708 ppm2      0.940 CV     1
 OR { 1435}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 35   and name HD1%))
 OR { 1435}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 35   and name HD1%))
 ASSI { 1436}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 35   and name HD2%))
      6.000     4.700     0.000 peak  1436 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.708 ppm2      0.758 CV     1
 OR { 1436}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 35   and name HD2%))
 ASSI { 1437}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 24   and name HB% ))
      3.600     1.800     1.800 peak  1437 spectrum    1 weight  0.10000E+01 volume  0.75087E-03 ppm1      5.705 ppm2      0.219 CV     1
 OR { 1437}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 24   and name HB% ))
 ASSI { 1438}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 48   and name HD1%))
      4.500     2.700     1.500 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.19207E-03 ppm1      5.704 ppm2      0.117 CV     1
 OR { 1438}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 48   and name HD1%))
 ASSI { 1440}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 36   and name HB2 ))
      6.000     4.700     0.000 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.458 ppm2      1.848 CV     1
 OR { 1440}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 35   and name HB3 ))
 ASSI { 1446}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 72   and name HB2 ))
      2.800     1.200     1.200 peak  1446 spectrum    1 weight  0.10000E+01 volume  0.34796E-02 ppm1      3.566 ppm2      1.892 CV     1
 OR { 1446}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 74   and name HB3 ))
 OR { 1446}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 72   and name HB2 ))
 OR { 1446}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 35   and name HB3 ))
 OR { 1446}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI { 1448}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 78   and name HD1%))
      6.000     4.700     0.000 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.002 ppm2      0.865 CV     1
 OR { 1448}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 78   and name HG2%))
 OR { 1448}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 36   and name HD2%))
 OR { 1448}
   (( segid "    " and resid 660  and name HA1 ))
   (( segid "    " and resid 657  and name HD1%))
 OR { 1448}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 21   and name HG2 ))
 OR { 1448}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 657  and name HD1%))
 ASSI { 1449}
   (( segid "    " and resid 71   and name HG13))
   (( segid "    " and resid 48   and name HD2%))
      6.000     4.700     0.000 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.945 ppm2     -0.816 CV     1
 OR { 1449}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 48   and name HD2%))
 ASSI { 1450}
   (( segid "    " and resid 71   and name HD1%))
   (( segid "    " and resid 48   and name HD2%))
      6.000     4.700     0.000 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.639 ppm2     -0.815 CV     1
 OR { 1450}
   (( segid "    " and resid 670  and name HG2%))
   (( segid "    " and resid 48   and name HD2%))
 ASSI { 1454}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 48   and name HD1%))
      6.000     4.700     0.000 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.957 ppm2      0.115 CV     1
 OR { 1454}
   (( segid "    " and resid 71   and name HG13))
   (( segid "    " and resid 48   and name HD1%))
 ASSI { 1456}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 48   and name HD1%))
      6.000     4.700     0.000 peak  1456 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.608 ppm2      0.115 CV     1
 OR { 1456}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 80   and name HB3 ))
 OR { 1456}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 48   and name HD1%))
 ASSI { 1457}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 48   and name HD1%))
      3.200     1.500     1.500 peak  1457 spectrum    1 weight  0.10000E+01 volume  0.14880E-02 ppm1      4.450 ppm2      0.115 CV     1
 OR { 1457}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 48   and name HD1%))
 ASSI { 1460}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 36   and name HD1%))
      3.100     1.400     1.400 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.17032E-02 ppm1      5.043 ppm2      0.900 CV     1
 OR { 1460}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 30   and name HG2%))
 ASSI { 1462}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 49   and name HG3 ))
      3.600     1.800     1.800 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.71425E-03 ppm1      4.094 ppm2      1.020 CV     1
 OR { 1462}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 49   and name HG3 ))
 ASSI { 1464}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 57   and name HD1%))
      3.200     1.500     1.500 peak  1464 spectrum    1 weight  0.10000E+01 volume  0.14674E-02 ppm1      2.829 ppm2      0.678 CV     1
 OR { 1464}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 663  and name HD2%))
 ASSI { 1469}
   (( segid "    " and resid 30   and name HG12))
   (( segid "    " and resid 30   and name HG2%))
      6.000     4.700     0.000 peak  1469 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.255 ppm2      0.912 CV     1
 OR { 1469}
   (( segid "    " and resid 36   and name HB3 ))
   (( segid "    " and resid 36   and name HD1%))
 OR { 1469}
   (( segid "    " and resid 60   and name HG13))
   (( segid "    " and resid 60   and name HG2%))
 ASSI { 1470}
   (( segid "    " and resid 60   and name HG13))
   (( segid "    " and resid 60   and name HD1%))
      6.000     4.700     0.000 peak  1470 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.255 ppm2      0.855 CV     1
 OR { 1470}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 21   and name HG2 ))
 ASSI { 1472}
   (( segid "    " and resid 60   and name HG12))
   (( segid "    " and resid 60   and name HG13))
      6.000     4.700     0.000 peak  1472 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.520 ppm2      1.256 CV     1
 OR { 1472}
   (( segid "    " and resid 673  and name HG12))
   (( segid "    " and resid 673  and name HG13))
 ASSI { 1476}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HG2 ))
      6.000     4.700     0.000 peak  1476 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.942 ppm2      1.582 CV     1
 OR { 1476}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 72   and name HG  ))
 OR { 1476}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 39   and name HE% ))
 OR { 1476}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 74   and name HG2 ))
 ASSI { 1477}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 668  and name HB3 ))
      3.100     1.400     1.400 peak  1477 spectrum    1 weight  0.10000E+01 volume  0.17398E-02 ppm1      4.942 ppm2      1.414 CV     1
 OR { 1477}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 55   and name HB% ))
 OR { 1477}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI { 1481}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 71   and name HD1%))
      3.900     2.100     2.100 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.44182E-03 ppm1      4.166 ppm2      0.639 CV     1
 OR { 1481}
   (( segid "    " and resid 664  and name HA  ))
   (( segid "    " and resid 663  and name HD1%))
 OR { 1481}
   (( segid "    " and resid 69   and name HA1 ))
   (( segid "    " and resid 71   and name HD1%))
 OR { 1481}
   (( segid "    " and resid 651  and name HA  ))
   (( segid "    " and resid 653  and name HG2%))
 OR { 1481}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 67   and name HG3 ))
 ASSI { 1486}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HD2%))
      3.200     1.500     1.500 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.14170E-02 ppm1      4.612 ppm2      1.104 CV     1
 OR { 1486}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 72   and name HD2%))
 OR { 1486}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 72   and name HD1%))
 OR { 1486}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 66   and name HG2%))
 OR { 1486}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HD1%))
 ASSI { 1490}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 72   and name HD1%))
      3.500     1.700     1.700 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.91115E-03 ppm1      4.258 ppm2      1.102 CV     1
 OR { 1490}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 653  and name HG13))
 OR { 1490}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 72   and name HD2%))
 OR { 1490}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 72   and name HD2%))
 ASSI { 1492}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 57   and name HB3 ))
      6.000     4.700     0.000 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.893 ppm2      0.940 CV     1
 OR { 1492}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 672  and name HG2%))
 OR { 1492}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 60   and name HG2%))
 ASSI { 1505}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 35   and name HD2%))
      2.300     0.800     0.800 peak  1505 spectrum    1 weight  0.10000E+01 volume  0.11904E-01 ppm1      1.884 ppm2      0.763 CV     1
 OR { 1505}
   (( segid "    " and resid 673  and name HB  ))
   (( segid "    " and resid 673  and name HG2%))
 ASSI { 1515}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 71   and name HG2%))
      4.600     2.800     1.400 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.17146E-03 ppm1      4.935 ppm2      0.584 CV     1
 OR { 1515}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 71   and name HG2%))
 ASSI { 1519}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 71   and name HG2%))
      6.000     4.700     0.000 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.484 ppm2      0.584 CV     1
 OR { 1519}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 71   and name HG2%))
 OR { 1519}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 48   and name HG  ))
 OR { 1519}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 48   and name HG  ))
 OR { 1519}
   (( segid "    " and resid 32   and name HB3 ))
   (( segid "    " and resid 48   and name HG  ))
 ASSI { 1521}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 72   and name HB3 ))
      3.000     1.300     1.300 peak  1521 spectrum    1 weight  0.10000E+01 volume  0.21634E-02 ppm1      2.517 ppm2      1.682 CV     1
 OR { 1521}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 49   and name HD2 ))
 OR { 1521}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 49   and name HD3 ))
 OR { 1521}
   (( segid "    " and resid 32   and name HB3 ))
   (( segid "    " and resid 35   and name HG  ))
 ASSI { 1522}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 49   and name HD3 ))
      3.700     1.900     1.900 peak  1522 spectrum    1 weight  0.10000E+01 volume  0.57002E-03 ppm1      4.441 ppm2      1.683 CV     1
 OR { 1522}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 49   and name HD2 ))
 OR { 1522}
   (( segid "    " and resid 681  and name HA  ))
   (( segid "    " and resid 682  and name HD3 ))
 OR { 1522}
   (( segid "    " and resid 681  and name HA  ))
   (( segid "    " and resid 682  and name HD2 ))
 ASSI { 1526}
   (( segid "    " and resid 669  and name HA  ))
   (( segid "    " and resid 670  and name HB  ))
      6.000     4.700     0.000 peak  1526 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.588 ppm2      1.887 CV     1
 OR { 1526}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
 OR { 1526}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 1537}
   (( segid "    " and resid 903  and name HA  ))
   (( segid "    " and resid 903  and name HB2 ))
      6.000     4.700     0.000 peak  1537 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.573 ppm2      3.518 CV     1
 OR { 1537}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HB3 ))
 ASSI { 1543}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 665  and name HB3 ))
      6.000     4.700     0.000 peak  1543 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.765 ppm2      1.622 CV     1
 OR { 1543}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 663  and name HB2 ))
 OR { 1543}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 667  and name HB3 ))
 OR { 1543}
   (( segid "    " and resid 674  and name HA  ))
   (( segid "    " and resid 676  and name HB3 ))
 ASSI { 1546}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 60   and name HA  ))
      6.000     4.700     0.000 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.619 ppm2      3.935 CV     1
 OR { 1546}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 51   and name HB3 ))
 OR { 1546}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
 OR { 1546}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
 OR { 1546}
   (( segid "    " and resid 662  and name HA  ))
   (( segid "    " and resid 664  and name HB3 ))
 OR { 1546}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 51   and name HB3 ))
 ASSI { 1547}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 669  and name HB3 ))
      6.000     4.700     0.000 peak  1547 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.456 ppm2      2.497 CV     1
 OR { 1547}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HG3 ))
 OR { 1547}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HG2 ))
 OR { 1547}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 32   and name HB3 ))
 OR { 1547}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 669  and name HB3 ))
 ASSI { 1550}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 671  and name HG2%))
      3.400     1.700     1.700 peak  1550 spectrum    1 weight  0.10000E+01 volume  0.95002E-03 ppm1      2.686 ppm2      1.272 CV     1
 OR { 1550}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 30   and name HG12))
 OR { 1550}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 21   and name HB3 ))
 ASSI { 1577}
   (( segid "    " and resid 71   and name HG13))
   (( segid "    " and resid 43   and name HZ3 ))
      3.500     1.700     1.700 peak  1577 spectrum    1 weight  0.10000E+01 volume  0.91343E-03 ppm1      0.945 ppm2      6.950 CV     1
 OR { 1577}
   (( segid "    " and resid 35   and name HD1%))
   (( segid "    " and resid 43   and name HD1 ))
 OR { 1577}
   (( segid "    " and resid 71   and name HG13))
   (( segid "    " and resid 43   and name HD1 ))
 OR { 1577}
   (( segid "    " and resid 35   and name HD1%))
   (( segid "    " and resid 20   and name HZ3 ))
 ASSI { 1578}
   (( segid "    " and resid 27   and name HA2 ))
   (( segid "    " and resid 22   and name HE  ))
      3.200     1.400     1.400 peak  1578 spectrum    1 weight  0.10000E+01 volume  0.15567E-02 ppm1      3.873 ppm2      7.269 CV     1
 OR { 1578}
   (( segid "    " and resid 28   and name HA2 ))
   (( segid "    " and resid 44   and name HE1 ))
 OR { 1578}
   (( segid "    " and resid 28   and name HA2 ))
   (( segid "    " and resid 22   and name HE  ))
 OR { 1578}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 22   and name HE  ))
 ASSI { 1579}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 44   and name HE1 ))
      4.200     2.400     1.800 peak  1579 spectrum    1 weight  0.10000E+01 volume  0.27013E-03 ppm1      3.990 ppm2      7.269 CV     1
 OR { 1579}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 44   and name HE1 ))
 ASSI { 1581}
   (( segid "    " and resid 44   and name HE1 ))
   (( segid "    " and resid 28   and name HN  ))
      3.900     2.100     2.100 peak  1581 spectrum    1 weight  0.10000E+01 volume  0.47159E-03 ppm1      7.271 ppm2      9.138 CV     1
 OR { 1581}
   (( segid "    " and resid 22   and name HE  ))
   (( segid "    " and resid 28   and name HN  ))
 ASSI { 1598}
   (( segid "    " and resid 670  and name HG2%))
   (( segid "    " and resid 671  and name HN  ))
      6.000     4.700     0.000 peak  1598 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.664 ppm2      8.967 CV     1
 OR { 1598}
   (( segid "    " and resid 57   and name HD1%))
   (( segid "    " and resid 73   and name HN  ))
 OR { 1598}
   (( segid "    " and resid 57   and name HD1%))
   (( segid "    " and resid 74   and name HN  ))
 ASSI { 1608}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 48   and name HD2%))
      3.900     2.100     2.100 peak  1608 spectrum    1 weight  0.10000E+01 volume  0.46014E-03 ppm1      4.148 ppm2     -0.814 CV     1
 OR { 1608}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 48   and name HD2%))
 ASSI { 1609}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 48   and name HD2%))
      6.000     4.700     0.000 peak  1609 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.445 ppm2     -0.814 CV     1
 OR { 1609}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 48   and name HD2%))
 ASSI { 1610}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      6.000     4.700     0.000 peak  1610 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.615 ppm2     10.077 CV     1
 OR { 1610}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI { 1611}
   (( segid "    " and resid 46   and name HG3 ))
   (( segid "    " and resid 45   and name HN  ))
      3.600     1.800     1.800 peak  1611 spectrum    1 weight  0.10000E+01 volume  0.72569E-03 ppm1      1.633 ppm2     10.033 CV     1
 OR { 1611}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI { 1616}
   (( segid "    " and resid 48   and name HD1%))
   (( segid "    " and resid 57   and name HN  ))
      6.000     4.700     0.000 peak  1616 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.117 ppm2      8.406 CV     1
 OR { 1616}
   (( segid "    " and resid 48   and name HD1%))
   (( segid "    " and resid 670  and name HN  ))
 ASSI { 1620}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HE  ))
      3.400     1.600     1.600 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.10027E-02 ppm1      4.376 ppm2      7.077 CV     1
 OR { 1620}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 56   and name HE22))
 ASSI { 1630}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 43   and name HA  ))
      3.000     1.400     1.400 peak  1630 spectrum    1 weight  0.10000E+01 volume  0.19642E-02 ppm1      4.405 ppm2      5.709 CV     1
 OR { 1630}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI { 1634}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     4.700     0.000 peak  1634 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.568 ppm2      6.141 CV     1
 OR { 1634}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI { 1636}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 911  and name HN  ))
      4.300     2.500     1.700 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.24724E-03 ppm1      1.320 ppm2      8.204 CV     1
 OR { 1636}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 1638}
   (( segid "    " and resid 677  and name HN  ))
   (( segid "    " and resid 679  and name HN  ))
      6.000     4.700     0.000 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.620 ppm2      8.410 CV     1
 OR { 1638}
   (( segid "    " and resid 677  and name HN  ))
   (( segid "    " and resid 680  and name HN  ))
 ASSI { 1642}
   (( segid "    " and resid 71   and name HG2%))
   (( segid "    " and resid 49   and name HN  ))
      3.300     1.500     1.500 peak  1642 spectrum    1 weight  0.10000E+01 volume  0.12454E-02 ppm1      0.587 ppm2      7.456 CV     1
 OR { 1642}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI { 1651}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 42   and name HD% ))
      6.000     4.700     0.000 peak  1651 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.815 ppm2      7.232 CV     1
 OR { 1651}
   (( segid "    " and resid 673  and name HD1%))
   (( segid "    " and resid 42   and name HD% ))
 OR { 1651}
   (( segid "    " and resid 653  and name HD1%))
   (( segid "    " and resid 650  and name HD% ))
 OR { 1651}
   (( segid "    " and resid 653  and name HD1%))
   (( segid "    " and resid 655  and name HD1 ))
 ASSI { 1654}
   (( segid "    " and resid 673  and name HG2%))
   (( segid "    " and resid 37   and name HE% ))
      6.000     4.700     0.000 peak  1654 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.766 ppm2      6.399 CV     1
 OR { 1654}
   (( segid "    " and resid 35   and name HD2%))
   (( segid "    " and resid 37   and name HE% ))
 ASSI { 1660}
   (( segid "    " and resid 31   and name HB% ))
   (( segid "    " and resid 20   and name HZ3 ))
      3.300     1.500     1.500 peak  1660 spectrum    1 weight  0.10000E+01 volume  0.13049E-02 ppm1      1.275 ppm2      6.945 CV     1
 OR { 1660}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 20   and name HZ3 ))
 ASSI { 1675}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HE% ))
      6.000     4.700     0.000 peak  1675 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.451 ppm2      1.580 CV     1
 OR { 1675}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 30   and name HB  ))
 OR { 1675}
   (( segid "    " and resid 681  and name HA  ))
   (( segid "    " and resid 683  and name HB2 ))
 ASSI { 1699}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 668  and name HB3 ))
      6.000     4.700     0.000 peak  1699 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.086 ppm2      1.402 CV     1
 OR { 1699}
   (( segid "    " and resid 651  and name HB2 ))
   (( segid "    " and resid 653  and name HG12))
 OR { 1699}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 55   and name HB% ))
 ASSI { 1737}
   (( segid "    " and resid 48   and name HD2%))
   (( segid "    " and resid 57   and name HN  ))
      6.000     4.700     0.000 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     -0.818 ppm2      8.400 CV     1
 OR { 1737}
   (( segid "    " and resid 48   and name HD2%))
   (( segid "    " and resid 670  and name HN  ))
 ASSI {  708}
   (( segid "    " and resid 658  and name HN  ))
   (( segid "    " and resid 661  and name HB% ))
      6.000     4.700     0.000 peak   708 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.400 ppm2      1.401 CV     1
 OR {  708}
   (( segid "    " and resid 670  and name HN  ))
   (( segid "    " and resid 668  and name HB3 ))
 ASSI {  719}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 667  and name HG2 ))
      3.700     1.900     1.900 peak   719 spectrum    1 weight  0.10000E+01 volume  0.11024E-02 ppm1      8.508 ppm2      1.155 CV     1
 OR {  719}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 38   and name HB% ))
 OR {  719}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 66   and name HG2%))
 OR {  719}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 667  and name HD2 ))
 OR {  719}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 667  and name HG3 ))
 ASSI {  722}
   (( segid "    " and resid 674  and name HN  ))
   (( segid "    " and resid 673  and name HG13))
      3.700     1.900     1.900 peak   722 spectrum    1 weight  0.10000E+01 volume  0.12331E-02 ppm1      8.681 ppm2      1.239 CV     1
 OR {  722}
   (( segid "    " and resid 674  and name HN  ))
   (( segid "    " and resid 675  and name HG2%))
 ASSI {  728}
   (( segid "    " and resid 683  and name HN  ))
   (( segid "    " and resid 684  and name HA2 ))
      3.500     1.800     1.800 peak   728 spectrum    1 weight  0.10000E+01 volume  0.15508E-02 ppm1      8.188 ppm2      3.882 CV     1
 OR {  728}
   (( segid "    " and resid 683  and name HN  ))
   (( segid "    " and resid 681  and name HB2 ))
 OR {  728}
   (( segid "    " and resid 683  and name HN  ))
   (( segid "    " and resid 681  and name HB3 ))
 ASSI {  751}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HG13))
      4.500     2.700     1.500 peak   751 spectrum    1 weight  0.10000E+01 volume  0.38115E-03 ppm1      8.767 ppm2      1.255 CV     1
 OR {  751}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HG2%))
 ASSI {  764}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 72   and name HD2%))
      6.000     4.700     0.000 peak   764 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.001 ppm2      1.105 CV     1
 OR {  764}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 66   and name HG2%))
 ASSI {  770}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.000     1.300     1.300 peak   770 spectrum    1 weight  0.10000E+01 volume  0.44280E-02 ppm1      9.038 ppm2      1.897 CV     1
 OR {  770}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HB3 ))
 OR {  770}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
 ASSI {  773}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      4.300     2.500     1.700 peak   773 spectrum    1 weight  0.10000E+01 volume  0.47738E-03 ppm1      8.958 ppm2      1.881 CV     1
 OR {  773}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 74   and name HB3 ))
 ASSI {  776}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HD% ))
      3.500     1.800     1.800 peak   776 spectrum    1 weight  0.10000E+01 volume  0.15040E-02 ppm1      8.958 ppm2      6.475 CV     1
 OR {  776}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 65   and name HD% ))
 ASSI {  789}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HB3 ))
      6.000     4.700     0.000 peak   789 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.627 ppm2      1.280 CV     1
 OR {  789}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 29   and name HG2 ))
 OR {  789}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 22   and name HG3 ))
 ASSI {  799}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 34   and name HD% ))
      6.000     4.700     0.000 peak   799 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.529 ppm2      7.272 CV     1
 OR {  799}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 22   and name HE  ))
 ASSI {  827}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HG3 ))
      6.000     4.700     0.000 peak   827 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.830 ppm2      1.618 CV     1
 OR {  827}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI {  869}
   (( segid "    " and resid 674  and name HN  ))
   (( segid "    " and resid 672  and name HG2%))
      6.000     4.700     0.000 peak   869 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.681 ppm2      0.938 CV     1
 OR {  869}
   (( segid "    " and resid 674  and name HN  ))
   (( segid "    " and resid 35   and name HD1%))
 ASSI {  305}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 64   and name HB3 ))
      6.000     4.700     0.000 peak   305 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.590 ppm2      3.457 CV     1
 OR {  305}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 43   and name HB2 ))
 ASSI {  306}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 69   and name HA2 ))
      6.000     4.700     0.000 peak   306 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.590 ppm2      3.591 CV     1
 OR {  306}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 41   and name HB2 ))
 ASSI {  380}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 66   and name HG2%))
      4.300     2.500     1.700 peak   380 spectrum    1 weight  0.10000E+01 volume  0.15694E-02 ppm1      1.411 ppm2      1.137 CV     1
 OR {  380}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 38   and name HB% ))
 ASSI {  381}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 670  and name HG2%))
      5.600     4.100     0.400 peak   381 spectrum    1 weight  0.10000E+01 volume  0.34674E-03 ppm1      1.417 ppm2      0.654 CV     1
 OR {  381}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 71   and name HD1%))
 OR {  381}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 57   and name HD1%))
 ASSI {  382}
   (( segid "    " and resid 668  and name HB2 ))
   (( segid "    " and resid 670  and name HG2%))
      5.200     3.500     0.800 peak   382 spectrum    1 weight  0.10000E+01 volume  0.54650E-03 ppm1      1.816 ppm2      0.651 CV     1
 OR {  382}
   (( segid "    " and resid 668  and name HB2 ))
   (( segid "    " and resid 71   and name HD1%))
 ASSI {  384}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 667  and name HB3 ))
      6.000     4.700     0.000 peak   384 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.417 ppm2      1.635 CV     1
 OR {  384}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 71   and name HG12))
 ASSI {  403}
   (( segid "    " and resid 675  and name HG2%))
   (( segid "    " and resid 673  and name HG2%))
      6.000     4.700     0.000 peak   403 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.223 ppm2      0.762 CV     1
 OR {  403}
   (( segid "    " and resid 675  and name HG2%))
   (( segid "    " and resid 35   and name HD2%))
 ASSI {  409}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 670  and name HG2%))
      6.000     4.700     0.000 peak   409 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.153 ppm2      0.654 CV     1
 OR {  409}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 71   and name HD1%))
 ASSI {  419}
   (( segid "    " and resid 673  and name HG13))
   (( segid "    " and resid 671  and name HB  ))
      5.600     4.100     0.400 peak   419 spectrum    1 weight  0.10000E+01 volume  0.34119E-03 ppm1      1.258 ppm2      4.254 CV     1
 OR {  419}
   (( segid "    " and resid 22   and name HG3 ))
   (( segid "    " and resid 27   and name HA1 ))
 ASSI {  420}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 27   and name HA1 ))
      3.800     2.000     2.000 peak   420 spectrum    1 weight  0.10000E+01 volume  0.33935E-02 ppm1      1.423 ppm2      4.254 CV     1
 OR {  420}
   (( segid "    " and resid 657  and name HG12))
   (( segid "    " and resid 654  and name HA  ))
 ASSI {  429}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HG2 ))
      6.000     4.700     0.000 peak   429 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.511 ppm2      1.259 CV     1
 OR {  429}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HG3 ))
 OR {  429}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HG3 ))
 ASSI {  430}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 30   and name HG2%))
      6.000     4.700     0.000 peak   430 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.511 ppm2      0.912 CV     1
 OR {  430}
   (( segid "    " and resid 29   and name HB3 ))
   (( segid "    " and resid 30   and name HG2%))
 OR {  430}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 30   and name HG2%))
 ASSI {  546}
   (( segid "    " and resid 35   and name HD1%))
   (( segid "    " and resid 42   and name HA  ))
      6.000     4.700     0.000 peak   546 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.933 ppm2      5.709 CV     1
 OR {  546}
   (( segid "    " and resid 35   and name HD1%))
   (( segid "    " and resid 43   and name HA  ))
 ASSI {  547}
   (( segid "    " and resid 35   and name HD2%))
   (( segid "    " and resid 673  and name HG13))
      6.000     4.700     0.000 peak   547 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.757 ppm2      1.231 CV     1
 OR {  547}
   (( segid "    " and resid 35   and name HD2%))
   (( segid "    " and resid 675  and name HG2%))
 ASSI {  557}
   (( segid "    " and resid 72   and name HD2%))
   (( segid "    " and resid 52   and name HB2 ))
      6.000     4.700     0.000 peak   557 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.097 ppm2      3.778 CV     1
 OR {  557}
   (( segid "    " and resid 72   and name HD2%))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  559}
   (( segid "    " and resid 72   and name HD2%))
   (( segid "    " and resid 68   and name HB2 ))
      6.000     4.700     0.000 peak   559 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.097 ppm2      4.247 CV     1
 OR {  559}
   (( segid "    " and resid 72   and name HD2%))
   (( segid "    " and resid 50   and name HA  ))
 ASSI {  564}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 74   and name HG2 ))
      6.000     4.700     0.000 peak   564 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.471 ppm2      1.585 CV     1
 OR {  564}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 39   and name HE% ))
 OR {  564}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 48   and name HB2 ))



 ASSI {    1}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      2.600     1.000     1.000 peak     1 spectrum    1 weight  0.10000E+01 volume  0.54255E-02 ppm1      4.455 ppm2      9.861 CV     1
 ASSI {    2}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 39   and name HN  ))
      3.100     1.400     1.400 peak     2 spectrum    1 weight  0.10000E+01 volume  0.18497E-02 ppm1      1.154 ppm2      9.861 CV     1
 ASSI {    3}
   (( segid "    " and resid 650  and name HB3 ))
   (( segid "    " and resid 650  and name HN  ))
      2.700     1.100     1.100 peak     3 spectrum    1 weight  0.10000E+01 volume  0.37544E-02 ppm1      3.031 ppm2      8.302 CV     1
 ASSI {    4}
   (( segid "    " and resid 650  and name HB2 ))
   (( segid "    " and resid 650  and name HN  ))
      2.900     1.300     1.300 peak     4 spectrum    1 weight  0.10000E+01 volume  0.24495E-02 ppm1      3.164 ppm2      8.303 CV     1
 ASSI {    5}
   (( segid "    " and resid 650  and name HB2 ))
   (( segid "    " and resid 650  and name HD% ))
      6.000     4.700     0.000 peak     5 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.166 ppm2      7.227 CV     1
 ASSI {    6}
   (( segid "    " and resid 650  and name HB3 ))
   (( segid "    " and resid 650  and name HD% ))
      6.000     4.700     0.000 peak     6 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.031 ppm2      7.227 CV     1
 ASSI {    7}
   (( segid "    " and resid 650  and name HD% ))
   (( segid "    " and resid 650  and name HN  ))
      6.000     4.700     0.000 peak     7 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.234 ppm2      8.302 CV     1
 ASSI {    8}
   (( segid "    " and resid 655  and name HB3 ))
   (( segid "    " and resid 655  and name HN  ))
      2.700     1.100     1.100 peak     8 spectrum    1 weight  0.10000E+01 volume  0.39833E-02 ppm1      3.196 ppm2      8.049 CV     1
 ASSI {    9}
   (( segid "    " and resid 655  and name HB2 ))
   (( segid "    " and resid 655  and name HN  ))
      2.800     1.200     1.200 peak     9 spectrum    1 weight  0.10000E+01 volume  0.33423E-02 ppm1      3.312 ppm2      8.051 CV     1
 ASSI {   10}
   (( segid "    " and resid 655  and name HA  ))
   (( segid "    " and resid 655  and name HN  ))
      2.900     1.200     1.200 peak    10 spectrum    1 weight  0.10000E+01 volume  0.27013E-02 ppm1      4.671 ppm2      8.049 CV     1
 ASSI {   11}
   (( segid "    " and resid 655  and name HB3 ))
   (( segid "    " and resid 655  and name HE1 ))
      6.000     4.700     0.000 peak    11 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.192 ppm2     10.107 CV     1
 ASSI {   12}
   (( segid "    " and resid 655  and name HB2 ))
   (( segid "    " and resid 655  and name HE1 ))
      6.000     4.700     0.000 peak    12 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.311 ppm2     10.106 CV     1
 ASSI {   13}
   (( segid "    " and resid 655  and name HD1 ))
   (( segid "    " and resid 655  and name HE1 ))
      6.000     4.700     0.000 peak    13 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.231 ppm2     10.107 CV     1
 ASSI {   14}
   (( segid "    " and resid 655  and name HD1 ))
   (( segid "    " and resid 655  and name HN  ))
      3.400     1.600     1.600 peak    14 spectrum    1 weight  0.10000E+01 volume  0.10348E-02 ppm1      7.229 ppm2      8.048 CV     1
 ASSI {   15}
   (( segid "    " and resid 655  and name HB3 ))
   (( segid "    " and resid 655  and name HD1 ))
      6.000     4.700     0.000 peak    15 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.198 ppm2      7.226 CV     1
 ASSI {   16}
   (( segid "    " and resid 655  and name HB2 ))
   (( segid "    " and resid 655  and name HD1 ))
      6.000     4.700     0.000 peak    16 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.312 ppm2      7.228 CV     1
 ASSI {   17}
   (( segid "    " and resid 655  and name HA  ))
   (( segid "    " and resid 655  and name HD1 ))
      3.100     1.400     1.400 peak    17 spectrum    1 weight  0.10000E+01 volume  0.18612E-02 ppm1      4.669 ppm2      7.229 CV     1
 ASSI {   18}
   (( segid "    " and resid 655  and name HB3 ))
   (( segid "    " and resid 655  and name HE3 ))
      3.000     1.300     1.300 peak    18 spectrum    1 weight  0.10000E+01 volume  0.22594E-02 ppm1      3.198 ppm2      7.576 CV     1
 ASSI {   19}
   (( segid "    " and resid 655  and name HB2 ))
   (( segid "    " and resid 655  and name HE3 ))
      2.900     1.200     1.200 peak    19 spectrum    1 weight  0.10000E+01 volume  0.28616E-02 ppm1      3.313 ppm2      7.576 CV     1
 ASSI {   20}
   (( segid "    " and resid 655  and name HA  ))
   (( segid "    " and resid 655  and name HE3 ))
      6.000     4.700     0.000 peak    20 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.669 ppm2      7.578 CV     1
 ASSI {   21}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 20   and name HN  ))
      2.900     1.200     1.200 peak    21 spectrum    1 weight  0.10000E+01 volume  0.28616E-02 ppm1      3.061 ppm2      7.639 CV     1
 ASSI {   22}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      2.900     1.200     1.200 peak    22 spectrum    1 weight  0.10000E+01 volume  0.27242E-02 ppm1      3.140 ppm2      7.639 CV     1
 ASSI {   23}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.800     1.200     1.200 peak    23 spectrum    1 weight  0.10000E+01 volume  0.32507E-02 ppm1      4.654 ppm2      7.639 CV     1
 ASSI {   24}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HN  ))
      3.300     1.600     1.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.11309E-02 ppm1      7.193 ppm2      7.639 CV     1
 ASSI {   25}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 20   and name HE1 ))
      6.000     4.700     0.000 peak    25 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.059 ppm2     10.172 CV     1
 ASSI {   26}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HE1 ))
      6.000     4.700     0.000 peak    26 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.138 ppm2     10.172 CV     1
 ASSI {   27}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HE1 ))
      2.500     1.000     1.000 peak    27 spectrum    1 weight  0.10000E+01 volume  0.71883E-02 ppm1      7.196 ppm2     10.174 CV     1
 ASSI {   28}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HD1 ))
      3.200     1.500     1.500 peak    28 spectrum    1 weight  0.10000E+01 volume  0.15498E-02 ppm1      4.654 ppm2      7.195 CV     1
 ASSI {   29}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HD1 ))
      2.900     1.200     1.200 peak    29 spectrum    1 weight  0.10000E+01 volume  0.26326E-02 ppm1      3.139 ppm2      7.194 CV     1
 ASSI {   30}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 20   and name HD1 ))
      2.600     1.100     1.100 peak    30 spectrum    1 weight  0.10000E+01 volume  0.48532E-02 ppm1      3.059 ppm2      7.194 CV     1
 ASSI {   31}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HE3 ))
      6.000     4.700     0.000 peak    31 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.655 ppm2      7.381 CV     1
 ASSI {   32}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HE3 ))
      3.100     1.400     1.400 peak    32 spectrum    1 weight  0.10000E+01 volume  0.17238E-02 ppm1      3.141 ppm2      7.381 CV     1
 ASSI {   33}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 20   and name HE3 ))
      3.000     1.300     1.300 peak    33 spectrum    1 weight  0.10000E+01 volume  0.21359E-02 ppm1      3.060 ppm2      7.381 CV     1
 ASSI {   34}
   (( segid "    " and resid 655  and name HZ2 ))
   (( segid "    " and resid 655  and name HE1 ))
      6.000     4.700     0.000 peak    34 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.434 ppm2     10.106 CV     1
 ASSI {   35}
   (( segid "    " and resid 655  and name HE3 ))
   (( segid "    " and resid 655  and name HE1 ))
      6.000     4.700     0.000 peak    35 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.579 ppm2     10.108 CV     1
 ASSI {   36}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HE1 ))
      4.200     2.400     1.800 peak    36 spectrum    1 weight  0.10000E+01 volume  0.29989E-03 ppm1      7.643 ppm2     10.174 CV     1
 ASSI {   37}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HZ2 ))
      6.000     4.700     0.000 peak    37 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.193 ppm2      7.465 CV     1
 ASSI {   39}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HZ3 ))
      6.000     4.700     0.000 peak    39 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.140 ppm2      6.939 CV     1
 ASSI {   40}
   (( segid "    " and resid 20   and name HZ3 ))
   (( segid "    " and resid 20   and name HE3 ))
      2.400     0.900     0.900 peak    40 spectrum    1 weight  0.10000E+01 volume  0.89509E-02 ppm1      6.945 ppm2      7.384 CV     1
 ASSI {   41}
   (( segid "    " and resid 20   and name HZ3 ))
   (( segid "    " and resid 20   and name HZ2 ))
      3.100     1.400     1.400 peak    41 spectrum    1 weight  0.10000E+01 volume  0.18543E-02 ppm1      6.944 ppm2      7.465 CV     1
 ASSI {   42}
   (( segid "    " and resid 20   and name HZ2 ))
   (( segid "    " and resid 20   and name HE1 ))
      2.900     1.200     1.200 peak    42 spectrum    1 weight  0.10000E+01 volume  0.28158E-02 ppm1      7.464 ppm2     10.174 CV     1
 ASSI {   43}
   (( segid "    " and resid 20   and name HZ3 ))
   (( segid "    " and resid 20   and name HH2 ))
      6.000     4.700     0.000 peak    43 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.949 ppm2      7.174 CV     1
 ASSI {   44}
   (( segid "    " and resid 20   and name HH2 ))
   (( segid "    " and resid 20   and name HZ2 ))
      6.000     4.700     0.000 peak    44 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.176 ppm2      7.465 CV     1
 ASSI {   45}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 34   and name HN  ))
      3.000     1.300     1.300 peak    45 spectrum    1 weight  0.10000E+01 volume  0.23122E-02 ppm1      2.918 ppm2      8.205 CV     1
 ASSI {   46}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HN  ))
      6.000     4.700     0.000 peak    46 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.985 ppm2      8.204 CV     1
 ASSI {   47}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HN  ))
      3.000     1.300     1.300 peak    47 spectrum    1 weight  0.10000E+01 volume  0.20718E-02 ppm1      5.824 ppm2      8.206 CV     1
 ASSI {   48}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HE% ))
      3.500     1.700     1.700 peak    48 spectrum    1 weight  0.10000E+01 volume  0.86991E-03 ppm1      5.822 ppm2      7.339 CV     1
 ASSI {   49}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HD% ))
      2.700     1.100     1.100 peak    49 spectrum    1 weight  0.10000E+01 volume  0.38231E-02 ppm1      5.822 ppm2      7.284 CV     1
 ASSI {   50}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HE% ))
      6.000     4.700     0.000 peak    50 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.985 ppm2      7.339 CV     1
 ASSI {   51}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 34   and name HE% ))
      6.000     4.700     0.000 peak    51 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.920 ppm2      7.339 CV     1
 ASSI {   52}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 34   and name HD% ))
      3.000     1.300     1.300 peak    52 spectrum    1 weight  0.10000E+01 volume  0.21198E-02 ppm1      2.917 ppm2      7.284 CV     1
 ASSI {   53}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HD% ))
      2.500     1.000     1.000 peak    53 spectrum    1 weight  0.10000E+01 volume  0.64099E-02 ppm1      2.985 ppm2      7.284 CV     1
 ASSI {   54}
   (( segid "    " and resid 34   and name HD% ))
   (( segid "    " and resid 34   and name HN  ))
      2.900     1.200     1.200 peak    54 spectrum    1 weight  0.10000E+01 volume  0.27242E-02 ppm1      7.284 ppm2      8.206 CV     1
 ASSI {   55}
   (( segid "    " and resid 34   and name HE% ))
   (( segid "    " and resid 34   and name HN  ))
      6.000     4.700     0.000 peak    55 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.336 ppm2      8.206 CV     1
 ASSI {   56}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      2.300     0.900     0.900 peak    56 spectrum    1 weight  0.10000E+01 volume  0.99354E-02 ppm1      5.708 ppm2      9.125 CV     1
 ASSI {   57}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HN  ))
      3.500     1.700     1.700 peak    57 spectrum    1 weight  0.10000E+01 volume  0.86991E-03 ppm1      3.455 ppm2      9.125 CV     1
 ASSI {   58}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HD1 ))
      6.000     4.700     0.000 peak    58 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.456 ppm2      6.962 CV     1
 ASSI {   59}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HD1 ))
      6.000     4.700     0.000 peak    59 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.702 ppm2      6.958 CV     1
 ASSI {   60}
   (( segid "    " and resid 43   and name HD1 ))
   (( segid "    " and resid 43   and name HN  ))
      2.800     1.200     1.200 peak    60 spectrum    1 weight  0.10000E+01 volume  0.30905E-02 ppm1      6.959 ppm2      9.126 CV     1
 ASSI {   62}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HN  ))
      2.800     1.200     1.200 peak    62 spectrum    1 weight  0.10000E+01 volume  0.30218E-02 ppm1      2.931 ppm2      8.112 CV     1
 ASSI {   63}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HE% ))
      6.000     4.700     0.000 peak    63 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.651 ppm2      7.082 CV     1
 ASSI {   64}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HD% ))
      2.300     0.900     0.900 peak    64 spectrum    1 weight  0.10000E+01 volume  0.10279E-01 ppm1      4.648 ppm2      6.851 CV     1
 ASSI {   65}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HE% ))
      4.000     2.200     2.000 peak    65 spectrum    1 weight  0.10000E+01 volume  0.40291E-03 ppm1      2.934 ppm2      7.086 CV     1
 ASSI {   66}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HD% ))
      2.500     1.000     1.000 peak    66 spectrum    1 weight  0.10000E+01 volume  0.65701E-02 ppm1      2.933 ppm2      6.852 CV     1
 ASSI {   67}
   (( segid "    " and resid 81   and name HD% ))
   (( segid "    " and resid 81   and name HE% ))
      6.000     4.700     0.000 peak    67 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.853 ppm2      7.081 CV     1
 ASSI {   69}
   (( segid "    " and resid 81   and name HE% ))
   (( segid "    " and resid 81   and name HN  ))
      4.100     2.300     1.900 peak    69 spectrum    1 weight  0.10000E+01 volume  0.31821E-03 ppm1      7.081 ppm2      8.111 CV     1
 ASSI {   70}
   (( segid "    " and resid 645  and name HB3 ))
   (( segid "    " and resid 645  and name HN  ))
      2.800     1.200     1.200 peak    70 spectrum    1 weight  0.10000E+01 volume  0.31134E-02 ppm1      2.768 ppm2      8.459 CV     1
 ASSI {   71}
   (( segid "    " and resid 645  and name HB2 ))
   (( segid "    " and resid 645  and name HN  ))
      2.500     1.000     1.000 peak    71 spectrum    1 weight  0.10000E+01 volume  0.67304E-02 ppm1      2.835 ppm2      8.459 CV     1
 ASSI {   72}
   (( segid "    " and resid 645  and name HA  ))
   (( segid "    " and resid 645  and name HN  ))
      6.000     4.700     0.000 peak    72 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.657 ppm2      8.459 CV     1
 ASSI {   73}
   (( segid "    " and resid 645  and name HB2 ))
   (( segid "    " and resid 646  and name HN  ))
      6.000     4.700     0.000 peak    73 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.836 ppm2      8.393 CV     1
 ASSI {   74}
   (( segid "    " and resid 645  and name HA  ))
   (( segid "    " and resid 646  and name HN  ))
      6.000     4.700     0.000 peak    74 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.656 ppm2      8.391 CV     1
 ASSI {   75}
   (( segid "    " and resid 646  and name HA  ))
   (( segid "    " and resid 646  and name HN  ))
      6.000     4.700     0.000 peak    75 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.276 ppm2      8.393 CV     1
 ASSI {   76}
   (( segid "    " and resid 646  and name HB2 ))
   (( segid "    " and resid 646  and name HN  ))
      6.000     4.700     0.000 peak    76 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.131 ppm2      8.393 CV     1
 ASSI {   77}
   (( segid "    " and resid 646  and name HB3 ))
   (( segid "    " and resid 646  and name HN  ))
      6.000     4.700     0.000 peak    77 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.979 ppm2      8.393 CV     1
 ASSI {   78}
   (( segid "    " and resid 652  and name HB3 ))
   (( segid "    " and resid 652  and name HN  ))
      2.800     1.200     1.200 peak    78 spectrum    1 weight  0.10000E+01 volume  0.35025E-02 ppm1      2.681 ppm2      8.319 CV     1
 ASSI {   79}
   (( segid "    " and resid 647  and name HB3 ))
   (( segid "    " and resid 647  and name HN  ))
      2.900     1.300     1.300 peak    79 spectrum    1 weight  0.10000E+01 volume  0.24953E-02 ppm1      2.611 ppm2      8.377 CV     1
 ASSI {   80}
   (( segid "    " and resid 646  and name HB2 ))
   (( segid "    " and resid 647  and name HN  ))
      6.000     4.700     0.000 peak    80 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.131 ppm2      8.377 CV     1
 ASSI {   81}
   (( segid "    " and resid 646  and name HB3 ))
   (( segid "    " and resid 647  and name HN  ))
      6.000     4.700     0.000 peak    81 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.979 ppm2      8.377 CV     1
 ASSI {   82}
   (( segid "    " and resid 647  and name HA  ))
   (( segid "    " and resid 647  and name HN  ))
      6.000     4.700     0.000 peak    82 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.610 ppm2      8.375 CV     1
 ASSI {   83}
   (( segid "    " and resid 648  and name HA  ))
   (( segid "    " and resid 648  and name HN  ))
      2.900     1.200     1.200 peak    83 spectrum    1 weight  0.10000E+01 volume  0.27929E-02 ppm1      4.139 ppm2      8.059 CV     1
 ASSI {   84}
   (( segid "    " and resid 647  and name HA  ))
   (( segid "    " and resid 648  and name HN  ))
      2.400     0.900     0.900 peak    84 spectrum    1 weight  0.10000E+01 volume  0.75545E-02 ppm1      4.612 ppm2      8.059 CV     1
 ASSI {   85}
   (( segid "    " and resid 647  and name HB3 ))
   (( segid "    " and resid 648  and name HN  ))
      6.000     4.700     0.000 peak    85 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.611 ppm2      8.058 CV     1
 ASSI {   86}
   (( segid "    " and resid 648  and name HB  ))
   (( segid "    " and resid 648  and name HN  ))
      3.000     1.300     1.300 peak    86 spectrum    1 weight  0.10000E+01 volume  0.22664E-02 ppm1      2.074 ppm2      8.060 CV     1
 ASSI {   87}
   (( segid "    " and resid 648  and name HG1%)))
   (( segid "    " and resid 648  and name HN  ))
      2.700     1.100     1.100 peak    87 spectrum    1 weight  0.10000E+01 volume  0.39604E-02 ppm1      0.872 ppm2      8.058 CV     1
 ASSI {   88}
   (( segid "    " and resid 649  and name HB2 ))
   (( segid "    " and resid 649  and name HN  ))
      2.100     0.800     0.800 peak    88 spectrum    1 weight  0.10000E+01 volume  0.15956E-01 ppm1      3.815 ppm2      8.362 CV     1
 OR {   88}
   (( segid "    " and resid 649  and name HB3 ))
   (( segid "    " and resid 649  and name HN  ))
 ASSI {   89}
   (( segid "    " and resid 648  and name HA  ))
   (( segid "    " and resid 647  and name HN  ))
      6.000     4.700     0.000 peak    89 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.142 ppm2      8.362 CV     1
 ASSI {   90}
   (( segid "    " and resid 649  and name HA  ))
   (( segid "    " and resid 649  and name HN  ))
      6.000     4.700     0.000 peak    90 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.417 ppm2      8.362 CV     1
 ASSI {   91}
   (( segid "    " and resid 648  and name HN  ))
   (( segid "    " and resid 647  and name HN  ))
      3.200     1.400     1.400 peak    91 spectrum    1 weight  0.10000E+01 volume  0.15796E-02 ppm1      8.059 ppm2      8.364 CV     1
 ASSI {   92}
   (( segid "    " and resid 648  and name HA  ))
   (( segid "    " and resid 648  and name HB  ))
      2.900     1.300     1.300 peak    92 spectrum    1 weight  0.10000E+01 volume  0.25411E-02 ppm1      4.133 ppm2      2.075 CV     1
 ASSI {   93}
   (( segid "    " and resid 648  and name HA  ))
   (( segid "    " and resid 648  and name HG1%)))
      6.000     4.700     0.000 peak    93 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.142 ppm2      0.875 CV     1
 ASSI {   94}
   (( segid "    " and resid 648  and name HB  ))
   (( segid "    " and resid 648  and name HG1%)))
      1.900     0.700     0.700 peak    94 spectrum    1 weight  0.10000E+01 volume  0.31592E-01 ppm1      2.076 ppm2      0.875 CV     1
 ASSI {   95}
   (( segid "    " and resid 647  and name HA  ))
   (( segid "    " and resid 647  and name HB3 ))
      2.100     0.700     0.700 peak    95 spectrum    1 weight  0.10000E+01 volume  0.19070E-01 ppm1      4.608 ppm2      2.612 CV     1
 ASSI {   96}
   (( segid "    " and resid 654  and name HG3 ))
   (( segid "    " and resid 654  and name HN  ))
      2.600     1.100     1.100 peak    96 spectrum    1 weight  0.10000E+01 volume  0.47159E-02 ppm1      2.192 ppm2      8.328 CV     1
 OR {   96}
   (( segid "    " and resid 654  and name HG2 ))
   (( segid "    " and resid 654  and name HN  ))
 ASSI {   97}
   (( segid "    " and resid 651  and name HA  ))
   (( segid "    " and resid 651  and name HN  ))
      6.000     4.700     0.000 peak    97 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.180 ppm2      8.329 CV     1
 ASSI {   98}
   (( segid "    " and resid 650  and name HB3 ))
   (( segid "    " and resid 651  and name HN  ))
      6.000     4.700     0.000 peak    98 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.029 ppm2      8.327 CV     1
 ASSI {   99}
   (( segid "    " and resid 650  and name HB2 ))
   (( segid "    " and resid 651  and name HN  ))
      6.000     4.700     0.000 peak    99 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.162 ppm2      8.327 CV     1
 ASSI {  100}
   (( segid "    " and resid 652  and name HB2 ))
   (( segid "    " and resid 652  and name HN  ))
      2.900     1.300     1.300 peak   100 spectrum    1 weight  0.10000E+01 volume  0.24037E-02 ppm1      2.797 ppm2      8.319 CV     1
 ASSI {  101}
   (( segid "    " and resid 652  and name HA  ))
   (( segid "    " and resid 652  and name HN  ))
      6.000     4.700     0.000 peak   101 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.659 ppm2      8.316 CV     1
 ASSI {  102}
   (( segid "    " and resid 653  and name HN  ))
   (( segid "    " and resid 652  and name HN  ))
      6.000     4.700     0.000 peak   102 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.968 ppm2      8.320 CV     1
 ASSI {  104}
   (( segid "    " and resid 652  and name HB3 ))
   (( segid "    " and resid 653  and name HN  ))
      6.000     4.700     0.000 peak   104 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.679 ppm2      7.964 CV     1
 ASSI {  105}
   (( segid "    " and resid 652  and name HB2 ))
   (( segid "    " and resid 653  and name HN  ))
      2.500     1.000     1.000 peak   105 spectrum    1 weight  0.10000E+01 volume  0.60894E-02 ppm1      2.798 ppm2      7.965 CV     1
 ASSI {  106}
   (( segid "    " and resid 653  and name HB  ))
   (( segid "    " and resid 653  and name HN  ))
      2.600     1.100     1.100 peak   106 spectrum    1 weight  0.10000E+01 volume  0.47159E-02 ppm1      1.727 ppm2      7.966 CV     1
 ASSI {  109}
   (( segid "    " and resid 653  and name HG2%)))
   (( segid "    " and resid 653  and name HN  ))
      3.100     1.400     1.400 peak   109 spectrum    1 weight  0.10000E+01 volume  0.17124E-02 ppm1      0.629 ppm2      7.966 CV     1
 ASSI {  110}
   (( segid "    " and resid 653  and name HD1%)))
   (( segid "    " and resid 653  and name HN  ))
      4.000     2.200     2.000 peak   110 spectrum    1 weight  0.10000E+01 volume  0.37086E-03 ppm1      0.783 ppm2      7.967 CV     1
 ASSI {  111}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 653  and name HN  ))
      2.600     1.100     1.100 peak   111 spectrum    1 weight  0.10000E+01 volume  0.48761E-02 ppm1      4.023 ppm2      7.968 CV     1
 ASSI {  112}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 653  and name HG12))))
      6.000     4.700     0.000 peak   112 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.024 ppm2      1.379 CV     1
 ASSI {  113}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 653  and name HG13))))
      6.000     4.700     0.000 peak   113 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.024 ppm2      1.077 CV     1
 ASSI {  114}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 653  and name HD1%)))
      6.000     4.700     0.000 peak   114 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.027 ppm2      0.783 CV     1
 ASSI {  115}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 653  and name HG2%)))
      2.700     1.100     1.100 peak   115 spectrum    1 weight  0.10000E+01 volume  0.44870E-02 ppm1      4.024 ppm2      0.630 CV     1
 ASSI {  116}
   (( segid "    " and resid 653  and name HB  ))
   (( segid "    " and resid 653  and name HG2%)))
      2.200     0.800     0.800 peak   116 spectrum    1 weight  0.10000E+01 volume  0.13713E-01 ppm1      1.727 ppm2      0.631 CV     1
 ASSI {  117}
   (( segid "    " and resid 653  and name HG12))))
   (( segid "    " and resid 653  and name HG2%)))
      6.000     4.700     0.000 peak   117 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.376 ppm2      0.631 CV     1
 ASSI {  118}
   (( segid "    " and resid 653  and name HG12))))
   (( segid "    " and resid 653  and name HG13))))
      6.000     4.700     0.000 peak   118 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.376 ppm2      1.077 CV     1
 ASSI {  119}
   (( segid "    " and resid 653  and name HB  ))
   (( segid "    " and resid 653  and name HG12))))
      6.000     4.700     0.000 peak   119 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.727 ppm2      1.379 CV     1
 ASSI {  120}
   (( segid "    " and resid 653  and name HG2%)))
   (( segid "    " and resid 654  and name HN  ))
      2.900     1.200     1.200 peak   120 spectrum    1 weight  0.10000E+01 volume  0.28616E-02 ppm1      0.630 ppm2      8.323 CV     1
 ASSI {  121}
   (( segid "    " and resid 653  and name HD1%)))
   (( segid "    " and resid 654  and name HN  ))
      6.000     4.700     0.000 peak   121 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.784 ppm2      8.325 CV     1
 ASSI {  122}
   (( segid "    " and resid 653  and name HG13))))
   (( segid "    " and resid 654  and name HN  ))
      6.000     4.700     0.000 peak   122 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.082 ppm2      8.325 CV     1
 ASSI {  123}
   (( segid "    " and resid 653  and name HG12))))
   (( segid "    " and resid 654  and name HN  ))
      6.000     4.700     0.000 peak   123 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.374 ppm2      8.325 CV     1
 ASSI {  124}
   (( segid "    " and resid 653  and name HB  ))
   (( segid "    " and resid 654  and name HN  ))
      6.000     4.700     0.000 peak   124 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.728 ppm2      8.325 CV     1
 ASSI {  125}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 654  and name HN  ))
      2.200     0.800     0.800 peak   125 spectrum    1 weight  0.10000E+01 volume  0.13026E-01 ppm1      4.022 ppm2      8.325 CV     1
 ASSI {  126}
   (( segid "    " and resid 654  and name HB2 ))
   (( segid "    " and resid 654  and name HN  ))
      6.000     4.700     0.000 peak   126 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.966 ppm2      8.325 CV     1
 ASSI {  127}
   (( segid "    " and resid 654  and name HB3 ))
   (( segid "    " and resid 654  and name HN  ))
      2.200     0.800     0.800 peak   127 spectrum    1 weight  0.10000E+01 volume  0.13621E-01 ppm1      1.871 ppm2      8.327 CV     1
 ASSI {  128}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 654  and name HN  ))
      6.000     4.700     0.000 peak   128 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.262 ppm2      8.326 CV     1
 ASSI {  129}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 654  and name HB2 ))
      6.000     4.700     0.000 peak   129 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.261 ppm2      1.954 CV     1
 ASSI {  130}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 654  and name HB3 ))
      6.000     4.700     0.000 peak   130 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.262 ppm2      1.874 CV     1
 ASSI {  131}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 655  and name HN  ))
      6.000     4.700     0.000 peak   131 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.259 ppm2      8.051 CV     1
 ASSI {  132}
   (( segid "    " and resid 654  and name HB2 ))
   (( segid "    " and resid 655  and name HN  ))
      6.000     4.700     0.000 peak   132 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.957 ppm2      8.048 CV     1
 ASSI {  133}
   (( segid "    " and resid 654  and name HB3 ))
   (( segid "    " and resid 655  and name HN  ))
      6.000     4.700     0.000 peak   133 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.871 ppm2      8.050 CV     1
 ASSI {  134}
   (( segid "    " and resid 655  and name HN  ))
   (( segid "    " and resid 654  and name HN  ))
      6.000     4.700     0.000 peak   134 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.052 ppm2      8.325 CV     1
 ASSI {  135}
   (( segid "    " and resid 655  and name HA  ))
   (( segid "    " and resid 655  and name HB3 ))
      6.000     4.700     0.000 peak   135 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.669 ppm2      3.191 CV     1
 ASSI {  136}
   (( segid "    " and resid 655  and name HA  ))
   (( segid "    " and resid 655  and name HB2 ))
      2.600     1.000     1.000 peak   136 spectrum    1 weight  0.10000E+01 volume  0.51050E-02 ppm1      4.669 ppm2      3.312 CV     1
 ASSI {  137}
   (( segid "    " and resid 655  and name HB2 ))
   (( segid "    " and resid 655  and name HB3 ))
      6.000     4.700     0.000 peak   137 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.306 ppm2      3.201 CV     1
 ASSI {  138}
   (( segid "    " and resid 656  and name HA  ))
   (( segid "    " and resid 656  and name HN  ))
      2.900     1.200     1.200 peak   138 spectrum    1 weight  0.10000E+01 volume  0.27929E-02 ppm1      4.396 ppm2      8.141 CV     1
 ASSI {  139}
   (( segid "    " and resid 656  and name HB3 ))
   (( segid "    " and resid 656  and name HN  ))
      3.000     1.300     1.300 peak   139 spectrum    1 weight  0.10000E+01 volume  0.23350E-02 ppm1      3.705 ppm2      8.142 CV     1
 ASSI {  140}
   (( segid "    " and resid 656  and name HB2 ))
   (( segid "    " and resid 656  and name HN  ))
      3.000     1.400     1.400 peak   140 spectrum    1 weight  0.10000E+01 volume  0.19344E-02 ppm1      3.766 ppm2      8.142 CV     1
 ASSI {  141}
   (( segid "    " and resid 655  and name HB2 ))
   (( segid "    " and resid 656  and name HN  ))
      6.000     4.700     0.000 peak   141 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.315 ppm2      8.139 CV     1
 ASSI {  142}
   (( segid "    " and resid 655  and name HB3 ))
   (( segid "    " and resid 656  and name HN  ))
      3.200     1.500     1.500 peak   142 spectrum    1 weight  0.10000E+01 volume  0.15361E-02 ppm1      3.198 ppm2      8.139 CV     1
 ASSI {  143}
   (( segid "    " and resid 655  and name HA  ))
   (( segid "    " and resid 656  and name HN  ))
      2.400     0.900     0.900 peak   143 spectrum    1 weight  0.10000E+01 volume  0.79208E-02 ppm1      4.668 ppm2      8.141 CV     1
 ASSI {  144}
   (( segid "    " and resid 656  and name HA  ))
   (( segid "    " and resid 656  and name HB3 ))
      6.000     4.700     0.000 peak   144 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.396 ppm2      3.705 CV     1
 ASSI {  145}
   (( segid "    " and resid 656  and name HA  ))
   (( segid "    " and resid 656  and name HB2 ))
      6.000     4.700     0.000 peak   145 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.396 ppm2      3.769 CV     1
 ASSI {  146}
   (( segid "    " and resid 656  and name HA  ))
   (( segid "    " and resid 657  and name HN  ))
      2.300     0.900     0.900 peak   146 spectrum    1 weight  0.10000E+01 volume  0.98441E-02 ppm1      4.397 ppm2      8.024 CV     1
 ASSI {  147}
   (( segid "    " and resid 656  and name HB2 ))
   (( segid "    " and resid 657  and name HN  ))
      6.000     4.700     0.000 peak   147 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.766 ppm2      8.025 CV     1
 ASSI {  148}
   (( segid "    " and resid 656  and name HB3 ))
   (( segid "    " and resid 657  and name HN  ))
      6.000     4.700     0.000 peak   148 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.704 ppm2      8.025 CV     1
 ASSI {  149}
   (( segid "    " and resid 657  and name HB  ))
   (( segid "    " and resid 657  and name HN  ))
      2.800     1.200     1.200 peak   149 spectrum    1 weight  0.10000E+01 volume  0.34567E-02 ppm1      1.809 ppm2      8.024 CV     1
 ASSI {  150}
   (( segid "    " and resid 657  and name HG12))))
   (( segid "    " and resid 657  and name HN  ))
      3.300     1.600     1.600 peak   150 spectrum    1 weight  0.10000E+01 volume  0.12225E-02 ppm1      1.427 ppm2      8.024 CV     1
 ASSI {  151}
   (( segid "    " and resid 657  and name HG13))))
   (( segid "    " and resid 657  and name HN  ))
      2.800     1.200     1.200 peak   151 spectrum    1 weight  0.10000E+01 volume  0.31134E-02 ppm1      1.141 ppm2      8.024 CV     1
 ASSI {  152}
   (( segid "    " and resid 657  and name HD1%)))
   (( segid "    " and resid 657  and name HN  ))
      6.000     4.700     0.000 peak   152 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.859 ppm2      8.023 CV     1
 ASSI {  153}
   (( segid "    " and resid 657  and name HG2%)))
   (( segid "    " and resid 657  and name HN  ))
      6.000     4.700     0.000 peak   153 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.857 ppm2      8.023 CV     1
 ASSI {  154}
   (( segid "    " and resid 657  and name HA  ))
   (( segid "    " and resid 657  and name HN  ))
      2.600     1.100     1.100 peak   154 spectrum    1 weight  0.10000E+01 volume  0.46472E-02 ppm1      4.142 ppm2      8.022 CV     1
 ASSI {  155}
   (( segid "    " and resid 657  and name HB  ))
   (( segid "    " and resid 657  and name HD1%)))
      6.000     4.700     0.000 peak   155 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.811 ppm2      0.861 CV     1
 ASSI {  156}
   (( segid "    " and resid 657  and name HA  ))
   (( segid "    " and resid 657  and name HD1%)))
      6.000     4.700     0.000 peak   156 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.142 ppm2      0.857 CV     1
 ASSI {  157}
   (( segid "    " and resid 657  and name HA  ))
   (( segid "    " and resid 657  and name HG13))))
      6.000     4.700     0.000 peak   157 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.143 ppm2      1.134 CV     1
 ASSI {  158}
   (( segid "    " and resid 657  and name HA  ))
   (( segid "    " and resid 657  and name HB  ))
      2.700     1.100     1.100 peak   158 spectrum    1 weight  0.10000E+01 volume  0.38689E-02 ppm1      4.141 ppm2      1.808 CV     1
 ASSI {  159}
   (( segid "    " and resid 657  and name HA  ))
   (( segid "    " and resid 658  and name HN  ))
      2.300     0.900     0.900 peak   159 spectrum    1 weight  0.10000E+01 volume  0.99582E-02 ppm1      4.141 ppm2      8.408 CV     1
 ASSI {  160}
   (( segid "    " and resid 657  and name HN  ))
   (( segid "    " and resid 658  and name HN  ))
      6.000     4.700     0.000 peak   160 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.025 ppm2      8.409 CV     1
 ASSI {  161}
   (( segid "    " and resid 657  and name HB  ))
   (( segid "    " and resid 658  and name HN  ))
      6.000     4.700     0.000 peak   161 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.811 ppm2      8.409 CV     1
 ASSI {  162}
   (( segid "    " and resid 657  and name HG12))))
   (( segid "    " and resid 658  and name HN  ))
      6.000     4.700     0.000 peak   162 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.426 ppm2      8.403 CV     1
 ASSI {  164}
   (( segid "    " and resid 657  and name HD1%)))
   (( segid "    " and resid 658  and name HN  ))
      2.700     1.100     1.100 peak   164 spectrum    1 weight  0.10000E+01 volume  0.42122E-02 ppm1      0.856 ppm2      8.407 CV     1
 ASSI {  165}
   (( segid "    " and resid 658  and name HB3 ))
   (( segid "    " and resid 658  and name HN  ))
      6.000     4.700     0.000 peak   165 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.567 ppm2      8.409 CV     1
 ASSI {  166}
   (( segid "    " and resid 658  and name HB2 ))
   (( segid "    " and resid 658  and name HN  ))
      2.600     1.000     1.000 peak   166 spectrum    1 weight  0.10000E+01 volume  0.52195E-02 ppm1      2.761 ppm2      8.407 CV     1
 ASSI {  167}
   (( segid "    " and resid 660  and name HA2 ))
   (( segid "    " and resid 660  and name HN  ))
      6.000     4.700     0.000 peak   167 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.849 ppm2      8.568 CV     1
 ASSI {  168}
   (( segid "    " and resid 660  and name HA1 ))
   (( segid "    " and resid 660  and name HN  ))
      2.000     0.700     0.700 peak   168 spectrum    1 weight  0.10000E+01 volume  0.22068E-01 ppm1      3.986 ppm2      8.569 CV     1
 ASSI {  169}
   (( segid "    " and resid 659  and name HA  ))
   (( segid "    " and resid 660  and name HN  ))
      2.500     1.000     1.000 peak   169 spectrum    1 weight  0.10000E+01 volume  0.57460E-02 ppm1      4.395 ppm2      8.567 CV     1
 ASSI {  172}
   (( segid "    " and resid 659  and name HA  ))
   (( segid "    " and resid 659  and name HB3 ))
      6.000     4.700     0.000 peak   172 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.398 ppm2      1.978 CV     1
 ASSI {  173}
   (( segid "    " and resid 659  and name HA  ))
   (( segid "    " and resid 659  and name HB2 ))
      6.000     4.700     0.000 peak   173 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.395 ppm2      2.282 CV     1
 ASSI {  174}
   (( segid "    " and resid 659  and name HD3 ))
   (( segid "    " and resid 659  and name HB3 ))
      6.000     4.700     0.000 peak   174 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.813 ppm2      1.978 CV     1
 OR {  174}
   (( segid "    " and resid 659  and name HD2 ))
   (( segid "    " and resid 659  and name HB3 ))
 ASSI {  175}
   (( segid "    " and resid 659  and name HD2 ))
   (( segid "    " and resid 659  and name HB2 ))
      3.000     1.300     1.300 peak   175 spectrum    1 weight  0.10000E+01 volume  0.21427E-02 ppm1      3.817 ppm2      2.266 CV     1
 OR {  175}
   (( segid "    " and resid 659  and name HD3 ))
   (( segid "    " and resid 659  and name HB2 ))
 ASSI {  176}
   (( segid "    " and resid 659  and name HG2 ))
   (( segid "    " and resid 660  and name HN  ))
      6.000     4.700     0.000 peak   176 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.983 ppm2      8.567 CV     1
 ASSI {  177}
   (( segid "    " and resid 659  and name HD2 ))
   (( segid "    " and resid 659  and name HG2 ))
      6.000     4.700     0.000 peak   177 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.815 ppm2      1.978 CV     1
 OR {  177}
   (( segid "    " and resid 659  and name HD3 ))
   (( segid "    " and resid 659  and name HG3 ))
 OR {  177}
   (( segid "    " and resid 659  and name HD2 ))
   (( segid "    " and resid 659  and name HG3 ))
 ASSI {  178}
   (( segid "    " and resid 659  and name HA  ))
   (( segid "    " and resid 659  and name HG3 ))
      6.000     4.700     0.000 peak   178 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.396 ppm2      1.974 CV     1
 OR {  178}
   (( segid "    " and resid 659  and name HA  ))
   (( segid "    " and resid 659  and name HG2 ))
 ASSI {  179}
   (( segid "    " and resid 660  and name HA2 ))
   (( segid "    " and resid 661  and name HN  ))
      2.900     1.300     1.300 peak   179 spectrum    1 weight  0.10000E+01 volume  0.25868E-02 ppm1      3.851 ppm2      7.926 CV     1
 ASSI {  180}
   (( segid "    " and resid 660  and name HA1 ))
   (( segid "    " and resid 661  and name HN  ))
      2.900     1.200     1.200 peak   180 spectrum    1 weight  0.10000E+01 volume  0.26784E-02 ppm1      3.992 ppm2      7.926 CV     1
 ASSI {  181}
   (( segid "    " and resid 661  and name HN  ))
   (( segid "    " and resid 660  and name HN  ))
      2.900     1.200     1.200 peak   181 spectrum    1 weight  0.10000E+01 volume  0.27929E-02 ppm1      7.928 ppm2      8.567 CV     1
 ASSI {  182}
   (( segid "    " and resid 661  and name HA  ))
   (( segid "    " and resid 661  and name HN  ))
      2.700     1.100     1.100 peak   182 spectrum    1 weight  0.10000E+01 volume  0.37544E-02 ppm1      4.272 ppm2      7.926 CV     1
 ASSI {  183}
   (( segid "    " and resid 661  and name HB% ))
   (( segid "    " and resid 661  and name HN  ))
      2.300     0.900     0.900 peak   183 spectrum    1 weight  0.10000E+01 volume  0.93168E-02 ppm1      1.414 ppm2      7.926 CV     1
 ASSI {  184}
   (( segid "    " and resid 661  and name HA  ))
   (( segid "    " and resid 661  and name HB% ))
      2.000     0.700     0.700 peak   184 spectrum    1 weight  0.10000E+01 volume  0.24037E-01 ppm1      4.272 ppm2      1.415 CV     1
 ASSI {  186}
   (( segid "    " and resid 662  and name HB3 ))
   (( segid "    " and resid 662  and name HN  ))
      6.000     4.700     0.000 peak   186 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.727 ppm2      8.394 CV     1
 ASSI {  187}
   (( segid "    " and resid 662  and name HB2 ))
   (( segid "    " and resid 662  and name HN  ))
      2.600     1.000     1.000 peak   187 spectrum    1 weight  0.10000E+01 volume  0.50821E-02 ppm1      2.841 ppm2      8.393 CV     1
 ASSI {  188}
   (( segid "    " and resid 662  and name HA  ))
   (( segid "    " and resid 662  and name HN  ))
      6.000     4.700     0.000 peak   188 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.650 ppm2      8.389 CV     1
 ASSI {  190}
   (( segid "    " and resid 663  and name HB3 ))
   (( segid "    " and resid 663  and name HN  ))
      6.000     4.700     0.000 peak   190 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.608 ppm2      8.389 CV     1
 ASSI {  191}
   (( segid "    " and resid 663  and name HG  ))
   (( segid "    " and resid 663  and name HN  ))
      6.000     4.700     0.000 peak   191 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.549 ppm2      8.389 CV     1
 ASSI {  192}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 663  and name HB2 ))
      6.000     4.700     0.000 peak   192 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.335 ppm2      1.622 CV     1
 OR {  192}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 663  and name HB3 ))
 ASSI {  195}
   (( segid "    " and resid 664  and name HA  ))
   (( segid "    " and resid 665  and name HN  ))
      2.700     1.100     1.100 peak   195 spectrum    1 weight  0.10000E+01 volume  0.36170E-02 ppm1      4.183 ppm2      8.275 CV     1
 ASSI {  196}
   (( segid "    " and resid 665  and name HB3 ))
   (( segid "    " and resid 665  and name HN  ))
      2.700     1.100     1.100 peak   196 spectrum    1 weight  0.10000E+01 volume  0.36170E-02 ppm1      1.623 ppm2      8.272 CV     1
 ASSI {  197}
   (( segid "    " and resid 665  and name HB2 ))
   (( segid "    " and resid 665  and name HN  ))
      6.000     4.700     0.000 peak   197 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.760 ppm2      8.274 CV     1
 ASSI {  198}
   (( segid "    " and resid 665  and name HA  ))
   (( segid "    " and resid 665  and name HN  ))
      2.700     1.100     1.100 peak   198 spectrum    1 weight  0.10000E+01 volume  0.43953E-02 ppm1      4.055 ppm2      8.272 CV     1
 ASSI {  199}
   (( segid "    " and resid 665  and name HA  ))
   (( segid "    " and resid 665  and name HB2 ))
      2.400     0.900     0.900 peak   199 spectrum    1 weight  0.10000E+01 volume  0.81268E-02 ppm1      4.055 ppm2      1.768 CV     1
 ASSI {  200}
   (( segid "    " and resid 665  and name HA  ))
   (( segid "    " and resid 665  and name HB3 ))
      2.500     1.000     1.000 peak   200 spectrum    1 weight  0.10000E+01 volume  0.63641E-02 ppm1      4.055 ppm2      1.623 CV     1
 ASSI {  202}
   (( segid "    " and resid 665  and name HA  ))
   (( segid "    " and resid 666  and name HN  ))
      2.900     1.200     1.200 peak   202 spectrum    1 weight  0.10000E+01 volume  0.27242E-02 ppm1      4.056 ppm2      7.790 CV     1
 ASSI {  203}
   (( segid "    " and resid 665  and name HB3 ))
   (( segid "    " and resid 666  and name HN  ))
      6.000     4.700     0.000 peak   203 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.624 ppm2      7.792 CV     1
 ASSI {  204}
   (( segid "    " and resid 665  and name HB2 ))
   (( segid "    " and resid 666  and name HN  ))
      6.000     4.700     0.000 peak   204 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.760 ppm2      7.789 CV     1
 ASSI {  205}
   (( segid "    " and resid 666  and name HB3 ))
   (( segid "    " and resid 666  and name HN  ))
      2.800     1.200     1.200 peak   205 spectrum    1 weight  0.10000E+01 volume  0.29074E-02 ppm1      2.533 ppm2      7.791 CV     1
 ASSI {  206}
   (( segid "    " and resid 666  and name HB2 ))
   (( segid "    " and resid 666  and name HN  ))
      6.000     4.700     0.000 peak   206 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.654 ppm2      7.789 CV     1
 ASSI {  208}
   (( segid "    " and resid 666  and name HB2 ))
   (( segid "    " and resid 666  and name HB3 ))
      2.500     1.000     1.000 peak   208 spectrum    1 weight  0.10000E+01 volume  0.65930E-02 ppm1      3.658 ppm2      2.533 CV     1
 ASSI {  209}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 666  and name HB3 ))
      2.500     1.000     1.000 peak   209 spectrum    1 weight  0.10000E+01 volume  0.62497E-02 ppm1      4.754 ppm2      2.538 CV     1
 ASSI {  211}
   (( segid "    " and resid 666  and name HE% ))
   (( segid "    " and resid 666  and name HN  ))
      6.000     4.700     0.000 peak   211 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.821 ppm2      7.789 CV     1
 ASSI {  212}
   (( segid "    " and resid 666  and name HB2 ))
   (( segid "    " and resid 666  and name HE% ))
      3.400     1.700     1.700 peak   212 spectrum    1 weight  0.10000E+01 volume  0.94089E-03 ppm1      3.656 ppm2      6.817 CV     1
 ASSI {  213}
   (( segid "    " and resid 667  and name HG3 ))
   (( segid "    " and resid 667  and name HN  ))
      3.000     1.300     1.300 peak   213 spectrum    1 weight  0.10000E+01 volume  0.20397E-02 ppm1      1.168 ppm2      7.192 CV     1
 OR {  213}
   (( segid "    " and resid 667  and name HG2 ))
   (( segid "    " and resid 667  and name HN  ))
 ASSI {  214}
   (( segid "    " and resid 667  and name HB3 ))
   (( segid "    " and resid 667  and name HN  ))
      2.700     1.100     1.100 peak   214 spectrum    1 weight  0.10000E+01 volume  0.40291E-02 ppm1      1.622 ppm2      7.191 CV     1
 ASSI {  215}
   (( segid "    " and resid 667  and name HB2 ))
   (( segid "    " and resid 667  and name HN  ))
      2.500     1.000     1.000 peak   215 spectrum    1 weight  0.10000E+01 volume  0.61123E-02 ppm1      1.681 ppm2      7.191 CV     1
 ASSI {  216}
   (( segid "    " and resid 667  and name HA  ))
   (( segid "    " and resid 667  and name HN  ))
      3.000     1.400     1.400 peak   216 spectrum    1 weight  0.10000E+01 volume  0.19551E-02 ppm1      3.838 ppm2      7.192 CV     1
 ASSI {  218}
   (( segid "    " and resid 667  and name HA  ))
   (( segid "    " and resid 667  and name HB3 ))
      2.800     1.200     1.200 peak   218 spectrum    1 weight  0.10000E+01 volume  0.31821E-02 ppm1      3.835 ppm2      1.616 CV     1
 ASSI {  219}
   (( segid "    " and resid 667  and name HA  ))
   (( segid "    " and resid 667  and name HB2 ))
      3.700     1.900     1.900 peak   219 spectrum    1 weight  0.10000E+01 volume  0.57918E-03 ppm1      3.838 ppm2      1.683 CV     1
 ASSI {  220}
   (( segid "    " and resid 668  and name HB2 ))
   (( segid "    " and resid 668  and name HN  ))
      3.000     1.300     1.300 peak   220 spectrum    1 weight  0.10000E+01 volume  0.21771E-02 ppm1      1.807 ppm2      8.645 CV     1
 ASSI {  221}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 668  and name HN  ))
      2.400     0.900     0.900 peak   221 spectrum    1 weight  0.10000E+01 volume  0.80124E-02 ppm1      1.419 ppm2      8.648 CV     1
 ASSI {  223}
   (( segid "    " and resid 667  and name HB3 ))
   (( segid "    " and resid 668  and name HN  ))
      6.000     4.700     0.000 peak   223 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.623 ppm2      8.646 CV     1
 ASSI {  224}
   (( segid "    " and resid 667  and name HB2 ))
   (( segid "    " and resid 668  and name HN  ))
      2.500     1.000     1.000 peak   224 spectrum    1 weight  0.10000E+01 volume  0.59520E-02 ppm1      1.684 ppm2      8.648 CV     1
 ASSI {  225}
   (( segid "    " and resid 667  and name HA  ))
   (( segid "    " and resid 668  and name HN  ))
      2.500     1.000     1.000 peak   225 spectrum    1 weight  0.10000E+01 volume  0.71425E-02 ppm1      3.838 ppm2      8.646 CV     1
 ASSI {  226}
   (( segid "    " and resid 667  and name HN  ))
   (( segid "    " and resid 668  and name HN  ))
      6.000     4.700     0.000 peak   226 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.193 ppm2      8.646 CV     1
 ASSI {  227}
   (( segid "    " and resid 668  and name HA  ))
   (( segid "    " and resid 668  and name HB2 ))
      2.500     1.000     1.000 peak   227 spectrum    1 weight  0.10000E+01 volume  0.56773E-02 ppm1      4.299 ppm2      1.809 CV     1
 ASSI {  228}
   (( segid "    " and resid 668  and name HA  ))
   (( segid "    " and resid 668  and name HB3 ))
      6.000     4.700     0.000 peak   228 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.303 ppm2      1.412 CV     1
 ASSI {  229}
   (( segid "    " and resid 668  and name HB2 ))
   (( segid "    " and resid 668  and name HB3 ))
      6.000     4.700     0.000 peak   229 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.810 ppm2      1.406 CV     1
 ASSI {  230}
   (( segid "    " and resid 669  and name HB3 ))
   (( segid "    " and resid 669  and name HN  ))
      2.600     1.100     1.100 peak   230 spectrum    1 weight  0.10000E+01 volume  0.48074E-02 ppm1      2.508 ppm2      8.514 CV     1
 ASSI {  235}
   (( segid "    " and resid 669  and name HA  ))
   (( segid "    " and resid 669  and name HB3 ))
      6.000     4.700     0.000 peak   235 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.592 ppm2      2.503 CV     1
 ASSI {  236}
   (( segid "    " and resid 669  and name HB3 ))
   (( segid "    " and resid 670  and name HN  ))
      6.000     4.700     0.000 peak   236 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.508 ppm2      8.426 CV     1
 ASSI {  237}
   (( segid "    " and resid 669  and name HA  ))
   (( segid "    " and resid 670  and name HN  ))
      6.000     4.700     0.000 peak   237 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.589 ppm2      8.426 CV     1
 ASSI {  239}
   (( segid "    " and resid 670  and name HB  ))
   (( segid "    " and resid 670  and name HN  ))
      6.000     4.700     0.000 peak   239 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.892 ppm2      8.426 CV     1
 ASSI {  240}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 670  and name HN  ))
      6.000     4.700     0.000 peak   240 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.440 ppm2      8.426 CV     1
 ASSI {  241}
   (( segid "    " and resid 670  and name HG1%)))
   (( segid "    " and resid 670  and name HN  ))
      6.000     4.700     0.000 peak   241 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.711 ppm2      8.426 CV     1
 ASSI {  243}
   (( segid "    " and resid 670  and name HB  ))
   (( segid "    " and resid 670  and name HG1%)))
      2.000     0.700     0.700 peak   243 spectrum    1 weight  0.10000E+01 volume  0.26555E-01 ppm1      1.889 ppm2      0.720 CV     1
 ASSI {  247}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 671  and name HN  ))
      2.400     0.900     0.900 peak   247 spectrum    1 weight  0.10000E+01 volume  0.83786E-02 ppm1      4.445 ppm2      8.945 CV     1
 ASSI {  248}
   (( segid "    " and resid 670  and name HB  ))
   (( segid "    " and resid 671  and name HN  ))
      6.000     4.700     0.000 peak   248 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.896 ppm2      8.944 CV     1
 ASSI {  249}
   (( segid "    " and resid 670  and name HG1%)))
   (( segid "    " and resid 671  and name HN  ))
      2.600     1.100     1.100 peak   249 spectrum    1 weight  0.10000E+01 volume  0.48074E-02 ppm1      0.712 ppm2      8.944 CV     1
 ASSI {  250}
   (( segid "    " and resid 670  and name HG2%)))
   (( segid "    " and resid 671  and name HN  ))
      6.000     4.700     0.000 peak   250 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.651 ppm2      8.944 CV     1
 ASSI {  251}
   (( segid "    " and resid 671  and name HA  ))
   (( segid "    " and resid 671  and name HN  ))
      6.000     4.700     0.000 peak   251 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.699 ppm2      8.944 CV     1
 ASSI {  253}
   (( segid "    " and resid 671  and name HG2%)))
   (( segid "    " and resid 671  and name HN  ))
      6.000     4.700     0.000 peak   253 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.267 ppm2      8.944 CV     1
 ASSI {  254}
   (( segid "    " and resid 671  and name HA  ))
   (( segid "    " and resid 672  and name HN  ))
      2.300     0.900     0.900 peak   254 spectrum    1 weight  0.10000E+01 volume  0.92712E-02 ppm1      4.699 ppm2      8.966 CV     1
 ASSI {  255}
   (( segid "    " and resid 671  and name HB  ))
   (( segid "    " and resid 672  and name HN  ))
      6.000     4.700     0.000 peak   255 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.252 ppm2      8.966 CV     1
 ASSI {  256}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 672  and name HN  ))
      3.200     1.500     1.500 peak   256 spectrum    1 weight  0.10000E+01 volume  0.13736E-02 ppm1      4.550 ppm2      8.965 CV     1
 ASSI {  257}
   (( segid "    " and resid 672  and name HB  ))
   (( segid "    " and resid 672  and name HN  ))
      2.600     1.000     1.000 peak   257 spectrum    1 weight  0.10000E+01 volume  0.51279E-02 ppm1      2.049 ppm2      8.967 CV     1
 ASSI {  258}
   (( segid "    " and resid 672  and name HG2%)))
   (( segid "    " and resid 672  and name HN  ))
      2.600     1.100     1.100 peak   258 spectrum    1 weight  0.10000E+01 volume  0.45099E-02 ppm1      0.917 ppm2      8.966 CV     1
 ASSI {  259}
   (( segid "    " and resid 672  and name HB  ))
   (( segid "    " and resid 672  and name HG2%)))
      2.200     0.800     0.800 peak   259 spectrum    1 weight  0.10000E+01 volume  0.13895E-01 ppm1      2.044 ppm2      0.914 CV     1
 ASSI {  260}
   (( segid "    " and resid 672  and name HG1%)))
   (( segid "    " and resid 672  and name HN  ))
      3.300     1.600     1.600 peak   260 spectrum    1 weight  0.10000E+01 volume  0.11172E-02 ppm1      0.978 ppm2      8.968 CV     1
 ASSI {  261}
   (( segid "    " and resid 672  and name HB  ))
   (( segid "    " and resid 672  and name HG1%)))
      2.300     0.900     0.900 peak   261 spectrum    1 weight  0.10000E+01 volume  0.97292E-02 ppm1      2.044 ppm2      0.976 CV     1
 ASSI {  262}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 672  and name HG2%)))
      2.500     1.000     1.000 peak   262 spectrum    1 weight  0.10000E+01 volume  0.64557E-02 ppm1      4.550 ppm2      0.915 CV     1
 ASSI {  263}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 672  and name HG1%)))
      2.800     1.100     1.100 peak   263 spectrum    1 weight  0.10000E+01 volume  0.35941E-02 ppm1      4.549 ppm2      0.976 CV     1
 ASSI {  264}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 672  and name HB  ))
      6.000     4.700     0.000 peak   264 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.550 ppm2      2.047 CV     1
 ASSI {  265}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 673  and name HN  ))
      2.400     0.900     0.900 peak   265 spectrum    1 weight  0.10000E+01 volume  0.83557E-02 ppm1      4.552 ppm2      9.508 CV     1
 ASSI {  266}
   (( segid "    " and resid 672  and name HB  ))
   (( segid "    " and resid 673  and name HN  ))
      3.500     1.700     1.700 peak   266 spectrum    1 weight  0.10000E+01 volume  0.89737E-03 ppm1      2.045 ppm2      9.506 CV     1
 ASSI {  267}
   (( segid "    " and resid 672  and name HG1%)))
   (( segid "    " and resid 673  and name HN  ))
      2.800     1.100     1.100 peak   267 spectrum    1 weight  0.10000E+01 volume  0.35941E-02 ppm1      0.974 ppm2      9.507 CV     1
 ASSI {  268}
   (( segid "    " and resid 672  and name HG2%)))
   (( segid "    " and resid 673  and name HN  ))
      6.000     4.700     0.000 peak   268 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.920 ppm2      9.506 CV     1
 ASSI {  269}
   (( segid "    " and resid 672  and name HN  ))
   (( segid "    " and resid 673  and name HN  ))
      6.000     4.700     0.000 peak   269 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.974 ppm2      9.509 CV     1
 ASSI {  270}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 673  and name HN  ))
      3.400     1.700     1.700 peak   270 spectrum    1 weight  0.10000E+01 volume  0.92712E-03 ppm1      4.377 ppm2      9.509 CV     1
 ASSI {  271}
   (( segid "    " and resid 673  and name HB  ))
   (( segid "    " and resid 673  and name HN  ))
      2.600     1.100     1.100 peak   271 spectrum    1 weight  0.10000E+01 volume  0.48761E-02 ppm1      1.893 ppm2      9.509 CV     1
 ASSI {  272}
   (( segid "    " and resid 673  and name HG13))))
   (( segid "    " and resid 673  and name HN  ))
      3.100     1.400     1.400 peak   272 spectrum    1 weight  0.10000E+01 volume  0.18108E-02 ppm1      1.254 ppm2      9.509 CV     1
 ASSI {  273}
   (( segid "    " and resid 673  and name HG12))))
   (( segid "    " and resid 673  and name HN  ))
      3.500     1.700     1.700 peak   273 spectrum    1 weight  0.10000E+01 volume  0.88368E-03 ppm1      1.488 ppm2      9.507 CV     1
 ASSI {  274}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 672  and name HG1%)))
      6.000     4.700     0.000 peak   274 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.374 ppm2      0.974 CV     1
 ASSI {  275}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 673  and name HG12))))
      6.000     4.700     0.000 peak   275 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.374 ppm2      1.490 CV     1
 ASSI {  276}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 673  and name HB  ))
      6.000     4.700     0.000 peak   276 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.374 ppm2      1.893 CV     1
 ASSI {  277}
   (( segid "    " and resid 674  and name HN  ))
   (( segid "    " and resid 673  and name HN  ))
      4.100     2.300     1.900 peak   277 spectrum    1 weight  0.10000E+01 volume  0.35025E-03 ppm1      8.690 ppm2      9.510 CV     1
 ASSI {  278}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 674  and name HN  ))
      2.300     0.900     0.900 peak   278 spectrum    1 weight  0.10000E+01 volume  0.93168E-02 ppm1      4.375 ppm2      8.682 CV     1
 ASSI {  279}
   (( segid "    " and resid 674  and name HB2 ))
   (( segid "    " and resid 674  and name HN  ))
      2.800     1.100     1.100 peak   279 spectrum    1 weight  0.10000E+01 volume  0.35483E-02 ppm1      3.122 ppm2      8.682 CV     1
 ASSI {  280}
   (( segid "    " and resid 674  and name HB3 ))
   (( segid "    " and resid 674  and name HN  ))
      2.800     1.200     1.200 peak   280 spectrum    1 weight  0.10000E+01 volume  0.30447E-02 ppm1      2.677 ppm2      8.681 CV     1
 ASSI {  281}
   (( segid "    " and resid 674  and name HA  ))
   (( segid "    " and resid 675  and name HN  ))
      2.400     0.900     0.900 peak   281 spectrum    1 weight  0.10000E+01 volume  0.73256E-02 ppm1      4.775 ppm2      8.675 CV     1
 ASSI {  282}
   (( segid "    " and resid 674  and name HB2 ))
   (( segid "    " and resid 674  and name HB3 ))
      6.000     4.700     0.000 peak   282 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.121 ppm2      2.678 CV     1
 ASSI {  283}
   (( segid "    " and resid 674  and name HA  ))
   (( segid "    " and resid 674  and name HB3 ))
      3.100     1.400     1.400 peak   283 spectrum    1 weight  0.10000E+01 volume  0.16277E-02 ppm1      4.772 ppm2      2.678 CV     1
 ASSI {  284}
   (( segid "    " and resid 674  and name HA  ))
   (( segid "    " and resid 674  and name HB2 ))
      6.000     4.700     0.000 peak   284 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.772 ppm2      3.121 CV     1
 ASSI {  287}
   (( segid "    " and resid 675  and name HA  ))
   (( segid "    " and resid 675  and name HG2%)))
      2.500     1.000     1.000 peak   287 spectrum    1 weight  0.10000E+01 volume  0.61352E-02 ppm1      4.050 ppm2      1.226 CV     1
 ASSI {  288}
   (( segid "    " and resid 675  and name HB  ))
   (( segid "    " and resid 675  and name HG2%)))
      2.200     0.800     0.800 peak   288 spectrum    1 weight  0.10000E+01 volume  0.13049E-01 ppm1      4.320 ppm2      1.227 CV     1
 ASSI {  291}
   (( segid "    " and resid 676  and name HA  ))
   (( segid "    " and resid 676  and name HB2 ))
      6.000     4.700     0.000 peak   291 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.211 ppm2      1.827 CV     1
 ASSI {  292}
   (( segid "    " and resid 676  and name HB3 ))
   (( segid "    " and resid 677  and name HN  ))
      3.600     1.900     1.900 peak   292 spectrum    1 weight  0.10000E+01 volume  0.67304E-03 ppm1      1.628 ppm2      7.616 CV     1
 ASSI {  293}
   (( segid "    " and resid 676  and name HB2 ))
   (( segid "    " and resid 677  and name HN  ))
      3.200     1.500     1.500 peak   293 spectrum    1 weight  0.10000E+01 volume  0.13438E-02 ppm1      1.834 ppm2      7.617 CV     1
 ASSI {  294}
   (( segid "    " and resid 676  and name HA  ))
   (( segid "    " and resid 677  and name HN  ))
      2.800     1.200     1.200 peak   294 spectrum    1 weight  0.10000E+01 volume  0.31134E-02 ppm1      4.217 ppm2      7.617 CV     1
 ASSI {  296}
   (( segid "    " and resid 677  and name HB2 ))
   (( segid "    " and resid 677  and name HN  ))
      2.400     0.900     0.900 peak   296 spectrum    1 weight  0.10000E+01 volume  0.87447E-02 ppm1      2.770 ppm2      7.616 CV     1
 ASSI {  297}
   (( segid "    " and resid 677  and name HA  ))
   (( segid "    " and resid 677  and name HN  ))
      2.800     1.200     1.200 peak   297 spectrum    1 weight  0.10000E+01 volume  0.29989E-02 ppm1      4.588 ppm2      7.617 CV     1
 ASSI {  300}
   (( segid "    " and resid 678  and name HA1 ))
   (( segid "    " and resid 678  and name HN  ))
      6.000     4.700     0.000 peak   300 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.956 ppm2      8.502 CV     1
 OR {  300}
   (( segid "    " and resid 678  and name HA2 ))
   (( segid "    " and resid 678  and name HN  ))
 ASSI {  301}
   (( segid "    " and resid 677  and name HN  ))
   (( segid "    " and resid 678  and name HN  ))
      2.900     1.300     1.300 peak   301 spectrum    1 weight  0.10000E+01 volume  0.25639E-02 ppm1      7.619 ppm2      8.505 CV     1
 ASSI {  302}
   (( segid "    " and resid 679  and name HB3 ))
   (( segid "    " and resid 679  and name HN  ))
      6.000     4.700     0.000 peak   302 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.959 ppm2      8.399 CV     1
 OR {  302}
   (( segid "    " and resid 679  and name HB2 ))
   (( segid "    " and resid 679  and name HN  ))
 ASSI {  304}
   (( segid "    " and resid 680  and name HG2 ))
   (( segid "    " and resid 680  and name HN  ))
      6.000     4.700     0.000 peak   304 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.322 ppm2      8.381 CV     1
 ASSI {  305}
   (( segid "    " and resid 680  and name HB2 ))
   (( segid "    " and resid 680  and name HN  ))
      6.000     4.700     0.000 peak   305 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.126 ppm2      8.381 CV     1
 ASSI {  306}
   (( segid "    " and resid 680  and name HB3 ))
   (( segid "    " and resid 680  and name HN  ))
      6.000     4.700     0.000 peak   306 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.976 ppm2      8.382 CV     1
 ASSI {  307}
   (( segid "    " and resid 680  and name HA  ))
   (( segid "    " and resid 680  and name HN  ))
      6.000     4.700     0.000 peak   307 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.540 ppm2      8.376 CV     1
 ASSI {  308}
   (( segid "    " and resid 680  and name HA  ))
   (( segid "    " and resid 680  and name HB3 ))
      3.900     2.100     2.100 peak   308 spectrum    1 weight  0.10000E+01 volume  0.43495E-03 ppm1      4.526 ppm2      1.973 CV     1
 ASSI {  309}
   (( segid "    " and resid 680  and name HA  ))
   (( segid "    " and resid 680  and name HB2 ))
      2.600     1.000     1.000 peak   309 spectrum    1 weight  0.10000E+01 volume  0.50821E-02 ppm1      4.526 ppm2      2.135 CV     1
 ASSI {  310}
   (( segid "    " and resid 680  and name HA  ))
   (( segid "    " and resid 680  and name HG2 ))
      6.000     4.700     0.000 peak   310 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.528 ppm2      2.315 CV     1
 ASSI {  311}
   (( segid "    " and resid 680  and name HB3 ))
   (( segid "    " and resid 681  and name HN  ))
      6.000     4.700     0.000 peak   311 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.972 ppm2      8.286 CV     1
 ASSI {  312}
   (( segid "    " and resid 680  and name HB2 ))
   (( segid "    " and resid 681  and name HN  ))
      6.000     4.700     0.000 peak   312 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.124 ppm2      8.286 CV     1
 ASSI {  313}
   (( segid "    " and resid 680  and name HA  ))
   (( segid "    " and resid 681  and name HN  ))
      6.000     4.700     0.000 peak   313 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.526 ppm2      8.286 CV     1
 ASSI {  314}
   (( segid "    " and resid 681  and name HA  ))
   (( segid "    " and resid 681  and name HN  ))
      6.000     4.700     0.000 peak   314 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.421 ppm2      8.286 CV     1
 ASSI {  315}
   (( segid "    " and resid 681  and name HB3 ))
   (( segid "    " and resid 681  and name HN  ))
      6.000     4.700     0.000 peak   315 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.863 ppm2      8.286 CV     1
 OR {  315}
   (( segid "    " and resid 681  and name HB2 ))
   (( segid "    " and resid 681  and name HN  ))
 ASSI {  316}
   (( segid "    " and resid 681  and name HA  ))
   (( segid "    " and resid 682  and name HN  ))
      6.000     4.700     0.000 peak   316 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.421 ppm2      8.336 CV     1
 ASSI {  317}
   (( segid "    " and resid 682  and name HG2 ))
   (( segid "    " and resid 682  and name HN  ))
      6.000     4.700     0.000 peak   317 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.401 ppm2      8.337 CV     1
 OR {  317}
   (( segid "    " and resid 682  and name HG3 ))
   (( segid "    " and resid 682  and name HN  ))
 ASSI {  318}
   (( segid "    " and resid 682  and name HB3 ))
   (( segid "    " and resid 682  and name HN  ))
      6.000     4.700     0.000 peak   318 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.732 ppm2      8.336 CV     1
 ASSI {  319}
   (( segid "    " and resid 682  and name HA  ))
   (( segid "    " and resid 682  and name HN  ))
      6.000     4.700     0.000 peak   319 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.369 ppm2      8.336 CV     1
 ASSI {  320}
   (( segid "    " and resid 682  and name HA  ))
   (( segid "    " and resid 682  and name HG2 ))
      6.000     4.700     0.000 peak   320 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.369 ppm2      1.407 CV     1
 OR {  320}
   (( segid "    " and resid 682  and name HA  ))
   (( segid "    " and resid 682  and name HG3 ))
 ASSI {  321}
   (( segid "    " and resid 682  and name HA  ))
   (( segid "    " and resid 682  and name HB2 ))
      6.000     4.700     0.000 peak   321 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.368 ppm2      1.825 CV     1
 ASSI {  322}
   (( segid "    " and resid 682  and name HG2 ))
   (( segid "    " and resid 683  and name HN  ))
      6.000     4.700     0.000 peak   322 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.421 ppm2      8.195 CV     1
 OR {  322}
   (( segid "    " and resid 682  and name HG3 ))
   (( segid "    " and resid 683  and name HN  ))
 ASSI {  323}
   (( segid "    " and resid 682  and name HB3 ))
   (( segid "    " and resid 683  and name HN  ))
      6.000     4.700     0.000 peak   323 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.733 ppm2      8.192 CV     1
 ASSI {  324}
   (( segid "    " and resid 682  and name HA  ))
   (( segid "    " and resid 683  and name HN  ))
      2.500     1.000     1.000 peak   324 spectrum    1 weight  0.10000E+01 volume  0.60207E-02 ppm1      4.370 ppm2      8.191 CV     1
 ASSI {  325}
   (( segid "    " and resid 683  and name HB2 ))
   (( segid "    " and resid 683  and name HN  ))
      2.300     0.900     0.900 peak   325 spectrum    1 weight  0.10000E+01 volume  0.93861E-02 ppm1      1.552 ppm2      8.192 CV     1
 ASSI {  326}
   (( segid "    " and resid 683  and name HA  ))
   (( segid "    " and resid 683  and name HN  ))
      2.900     1.300     1.300 peak   326 spectrum    1 weight  0.10000E+01 volume  0.24953E-02 ppm1      4.272 ppm2      8.192 CV     1
 ASSI {  327}
   (( segid "    " and resid 683  and name HD2%)))
   (( segid "    " and resid 683  and name HN  ))
      3.500     1.700     1.700 peak   327 spectrum    1 weight  0.10000E+01 volume  0.84929E-03 ppm1      0.787 ppm2      8.194 CV     1
 ASSI {  328}
   (( segid "    " and resid 683  and name HD1%)))
   (( segid "    " and resid 683  and name HN  ))
      2.900     1.300     1.300 peak   328 spectrum    1 weight  0.10000E+01 volume  0.25639E-02 ppm1      0.829 ppm2      8.194 CV     1
 ASSI {  329}
   (( segid "    " and resid 683  and name HG  ))
   (( segid "    " and resid 683  and name HN  ))
      6.000     4.700     0.000 peak   329 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.536 ppm2      8.195 CV     1
 ASSI {  331}
   (( segid "    " and resid 683  and name HG  ))
   (( segid "    " and resid 684  and name HN  ))
      6.000     4.700     0.000 peak   331 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.557 ppm2      8.426 CV     1
 ASSI {  332}
   (( segid "    " and resid 684  and name HA1 ))
   (( segid "    " and resid 684  and name HN  ))
      6.000     4.700     0.000 peak   332 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.959 ppm2      8.426 CV     1
 ASSI {  333}
   (( segid "    " and resid 684  and name HA2 ))
   (( segid "    " and resid 684  and name HN  ))
      6.000     4.700     0.000 peak   333 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.886 ppm2      8.426 CV     1
 ASSI {  335}
   (( segid "    " and resid 18   and name HD2%)))
   (( segid "    " and resid 18   and name HN  ))
      3.600     1.800     1.800 peak   335 spectrum    1 weight  0.10000E+01 volume  0.76232E-03 ppm1      0.748 ppm2      8.065 CV     1
 ASSI {  336}
   (( segid "    " and resid 18   and name HD1%)))
   (( segid "    " and resid 18   and name HN  ))
      3.500     1.700     1.700 peak   336 spectrum    1 weight  0.10000E+01 volume  0.86535E-03 ppm1      0.797 ppm2      8.065 CV     1
 ASSI {  338}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HN  ))
      6.000     4.700     0.000 peak   338 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.506 ppm2      8.065 CV     1
 ASSI {  339}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      6.000     4.700     0.000 peak   339 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.252 ppm2      8.065 CV     1
 ASSI {  340}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 18   and name HN  ))
      6.000     4.700     0.000 peak   340 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.506 ppm2      8.066 CV     1
 ASSI {  342}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      2.600     1.100     1.100 peak   342 spectrum    1 weight  0.10000E+01 volume  0.48532E-02 ppm1      4.308 ppm2      8.090 CV     1
 ASSI {  343}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      6.000     4.700     0.000 peak   343 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.245 ppm2      8.090 CV     1
 ASSI {  344}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 19   and name HN  ))
      6.000     4.700     0.000 peak   344 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.717 ppm2      8.092 CV     1
 OR {  344}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI {  347}
   (( segid "    " and resid 18   and name HD1%)))
   (( segid "    " and resid 19   and name HN  ))
      6.000     4.700     0.000 peak   347 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.800 ppm2      8.093 CV     1
 ASSI {  348}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HD2%)))
      2.500     1.000     1.000 peak   348 spectrum    1 weight  0.10000E+01 volume  0.62955E-02 ppm1      4.242 ppm2      0.745 CV     1
 ASSI {  349}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HD1%)))
      6.000     4.700     0.000 peak   349 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.246 ppm2      0.802 CV     1
 ASSI {  350}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
      6.000     4.700     0.000 peak   350 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.243 ppm2      1.350 CV     1
 ASSI {  351}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
      6.000     4.700     0.000 peak   351 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.246 ppm2      1.509 CV     1
 ASSI {  352}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name HD2%)))
      6.000     4.700     0.000 peak   352 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.350 ppm2      0.746 CV     1
 ASSI {  353}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HD2%)))
      6.000     4.700     0.000 peak   353 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.507 ppm2      0.749 CV     1
 ASSI {  355}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 20   and name HN  ))
      2.900     1.200     1.200 peak   355 spectrum    1 weight  0.10000E+01 volume  0.26326E-02 ppm1      3.718 ppm2      7.640 CV     1
 OR {  355}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI {  356}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.500     1.000     1.000 peak   356 spectrum    1 weight  0.10000E+01 volume  0.64099E-02 ppm1      4.312 ppm2      7.639 CV     1
 ASSI {  357}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HB3 ))
      6.000     4.700     0.000 peak   357 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.652 ppm2      3.062 CV     1
 ASSI {  358}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HB2 ))
      2.800     1.200     1.200 peak   358 spectrum    1 weight  0.10000E+01 volume  0.29303E-02 ppm1      4.652 ppm2      3.142 CV     1
 ASSI {  359}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 21   and name HN  ))
      3.100     1.400     1.400 peak   359 spectrum    1 weight  0.10000E+01 volume  0.16207E-02 ppm1      3.061 ppm2      8.749 CV     1
 ASSI {  360}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 21   and name HN  ))
      2.500     1.000     1.000 peak   360 spectrum    1 weight  0.10000E+01 volume  0.62955E-02 ppm1      3.140 ppm2      8.747 CV     1
 ASSI {  361}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      2.400     0.900     0.900 peak   361 spectrum    1 weight  0.10000E+01 volume  0.74400E-02 ppm1      4.654 ppm2      8.751 CV     1
 ASSI {  362}
   (( segid "    " and resid 21   and name HE2 ))
   (( segid "    " and resid 21   and name HN  ))
      4.000     2.200     2.000 peak   362 spectrum    1 weight  0.10000E+01 volume  0.39604E-03 ppm1      2.463 ppm2      8.747 CV     1
 OR {  362}
   (( segid "    " and resid 21   and name HE3 ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  363}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      6.000     4.700     0.000 peak   363 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.196 ppm2      8.747 CV     1
 ASSI {  364}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 21   and name HN  ))
      2.700     1.100     1.100 peak   364 spectrum    1 weight  0.10000E+01 volume  0.40291E-02 ppm1      1.422 ppm2      8.750 CV     1
 ASSI {  365}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 21   and name HN  ))
      6.000     4.700     0.000 peak   365 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.262 ppm2      8.747 CV     1
 ASSI {  366}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 21   and name HN  ))
      6.000     4.700     0.000 peak   366 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.946 ppm2      8.747 CV     1
 OR {  366}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  367}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HN  ))
      3.200     1.500     1.500 peak   367 spectrum    1 weight  0.10000E+01 volume  0.13392E-02 ppm1      0.551 ppm2      8.751 CV     1
 ASSI {  370}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB3 ))
      6.000     4.700     0.000 peak   370 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.181 ppm2      1.262 CV     1
 ASSI {  371}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 21   and name HD3 ))
      6.000     4.700     0.000 peak   371 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.424 ppm2      0.965 CV     1
 OR {  371}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 21   and name HD2 ))
 ASSI {  372}
   (( segid "    " and resid 22   and name HG3 ))
   (( segid "    " and resid 23   and name HN  ))
      6.000     4.700     0.000 peak   372 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.258 ppm2      8.606 CV     1
 ASSI {  373}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 23   and name HN  ))
      6.000     4.700     0.000 peak   373 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.506 ppm2      8.607 CV     1
 OR {  373}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
 ASSI {  374}
   (( segid "    " and resid 22   and name HD2 ))
   (( segid "    " and resid 23   and name HN  ))
      6.000     4.700     0.000 peak   374 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.090 ppm2      8.609 CV     1
 ASSI {  377}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
      2.600     1.100     1.100 peak   377 spectrum    1 weight  0.10000E+01 volume  0.45328E-02 ppm1      3.355 ppm2      8.613 CV     1
 ASSI {  378}
   (( segid "    " and resid 22   and name HD2 ))
   (( segid "    " and resid 22   and name HG3 ))
      6.000     4.700     0.000 peak   378 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.090 ppm2      1.283 CV     1
 ASSI {  379}
   (( segid "    " and resid 22   and name HD2 ))
   (( segid "    " and resid 22   and name HB2 ))
      6.000     4.700     0.000 peak   379 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.090 ppm2      1.486 CV     1
 OR {  379}
   (( segid "    " and resid 22   and name HD2 ))
   (( segid "    " and resid 22   and name HB3 ))
 ASSI {  380}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HB3 ))
      2.500     1.000     1.000 peak   380 spectrum    1 weight  0.10000E+01 volume  0.64099E-02 ppm1      3.353 ppm2      2.261 CV     1
 ASSI {  381}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB3 ))
      2.300     0.900     0.900 peak   381 spectrum    1 weight  0.10000E+01 volume  0.10416E-01 ppm1      4.397 ppm2      2.264 CV     1
 ASSI {  382}
   (( segid "    " and resid 24   and name HB% ))
   (( segid "    " and resid 24   and name HN  ))
      2.500     1.000     1.000 peak   382 spectrum    1 weight  0.10000E+01 volume  0.58376E-02 ppm1      0.220 ppm2      8.817 CV     1
 ASSI {  384}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      3.000     1.300     1.300 peak   384 spectrum    1 weight  0.10000E+01 volume  0.22229E-02 ppm1      4.396 ppm2      8.817 CV     1
 ASSI {  385}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 24   and name HB% ))
      2.300     0.900     0.900 peak   385 spectrum    1 weight  0.10000E+01 volume  0.10462E-01 ppm1      3.859 ppm2      0.219 CV     1
 ASSI {  386}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      3.200     1.500     1.500 peak   386 spectrum    1 weight  0.10000E+01 volume  0.14010E-02 ppm1      3.859 ppm2      9.059 CV     1
 ASSI {  387}
   (( segid "    " and resid 24   and name HB% ))
   (( segid "    " and resid 25   and name HN  ))
      3.000     1.300     1.300 peak   387 spectrum    1 weight  0.10000E+01 volume  0.20992E-02 ppm1      0.220 ppm2      9.059 CV     1
 ASSI {  388}
   (( segid "    " and resid 25   and name HA2 ))
   (( segid "    " and resid 25   and name HN  ))
      2.800     1.200     1.200 peak   388 spectrum    1 weight  0.10000E+01 volume  0.32965E-02 ppm1      3.989 ppm2      9.056 CV     1
 ASSI {  389}
   (( segid "    " and resid 25   and name HA1 ))
   (( segid "    " and resid 25   and name HN  ))
      2.600     1.100     1.100 peak   389 spectrum    1 weight  0.10000E+01 volume  0.47159E-02 ppm1      4.342 ppm2      9.053 CV     1
 ASSI {  390}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      3.100     1.400     1.400 peak   390 spectrum    1 weight  0.10000E+01 volume  0.17215E-02 ppm1      8.818 ppm2      9.057 CV     1
 ASSI {  391}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 26   and name HN  ))
      6.000     4.700     0.000 peak   391 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.166 ppm2      8.190 CV     1
 ASSI {  392}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HN  ))
      6.000     4.700     0.000 peak   392 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.342 ppm2      8.188 CV     1
 ASSI {  393}
   (( segid "    " and resid 25   and name HA2 ))
   (( segid "    " and resid 26   and name HN  ))
      6.000     4.700     0.000 peak   393 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.990 ppm2      8.190 CV     1
 ASSI {  394}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      3.200     1.400     1.400 peak   394 spectrum    1 weight  0.10000E+01 volume  0.15842E-02 ppm1      5.094 ppm2      8.183 CV     1
 ASSI {  395}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HB3 ))
      2.300     0.900     0.900 peak   395 spectrum    1 weight  0.10000E+01 volume  0.95687E-02 ppm1      5.093 ppm2      3.166 CV     1
 ASSI {  396}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HB2 ))
      2.300     0.900     0.900 peak   396 spectrum    1 weight  0.10000E+01 volume  0.10600E-01 ppm1      5.093 ppm2      3.344 CV     1
 ASSI {  397}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 53   and name HN  ))
      6.000     4.700     0.000 peak   397 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.191 ppm2      8.191 CV     1
 ASSI {  398}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
      6.000     4.700     0.000 peak   398 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.259 ppm2      8.190 CV     1
 ASSI {  399}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      3.000     1.300     1.300 peak   399 spectrum    1 weight  0.10000E+01 volume  0.21267E-02 ppm1      4.978 ppm2      8.192 CV     1
 ASSI {  400}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      6.000     4.700     0.000 peak   400 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.980 ppm2      3.258 CV     1
 ASSI {  401}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB3 ))
      2.200     0.800     0.800 peak   401 spectrum    1 weight  0.10000E+01 volume  0.12156E-01 ppm1      4.980 ppm2      3.196 CV     1
 ASSI {  402}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      3.300     1.600     1.600 peak   402 spectrum    1 weight  0.10000E+01 volume  0.11172E-02 ppm1      8.190 ppm2      9.057 CV     1
 ASSI {  403}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 27   and name HN  ))
      3.300     1.600     1.600 peak   403 spectrum    1 weight  0.10000E+01 volume  0.11904E-02 ppm1      5.095 ppm2      8.093 CV     1
 ASSI {  404}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 27   and name HN  ))
      6.000     4.700     0.000 peak   404 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.166 ppm2      8.095 CV     1
 ASSI {  405}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 27   and name HN  ))
      6.000     4.700     0.000 peak   405 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.342 ppm2      8.097 CV     1
 ASSI {  406}
   (( segid "    " and resid 27   and name HA2 ))
   (( segid "    " and resid 27   and name HN  ))
      6.000     4.700     0.000 peak   406 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.876 ppm2      8.095 CV     1
 ASSI {  407}
   (( segid "    " and resid 27   and name HA1 ))
   (( segid "    " and resid 27   and name HN  ))
      6.000     4.700     0.000 peak   407 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.257 ppm2      8.094 CV     1
 ASSI {  408}
   (( segid "    " and resid 27   and name HA1 ))
   (( segid "    " and resid 28   and name HN  ))
      3.200     1.500     1.500 peak   408 spectrum    1 weight  0.10000E+01 volume  0.13575E-02 ppm1      4.259 ppm2      9.140 CV     1
 ASSI {  409}
   (( segid "    " and resid 28   and name HA2 ))
   (( segid "    " and resid 28   and name HN  ))
      6.000     4.700     0.000 peak   409 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.873 ppm2      9.138 CV     1
 ASSI {  410}
   (( segid "    " and resid 28   and name HA1 ))
   (( segid "    " and resid 28   and name HN  ))
      2.500     1.000     1.000 peak   410 spectrum    1 weight  0.10000E+01 volume  0.64786E-02 ppm1      4.344 ppm2      9.138 CV     1
 ASSI {  411}
   (( segid "    " and resid 27   and name HA2 ))
   (( segid "    " and resid 28   and name HN  ))
      6.000     4.700     0.000 peak   411 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.875 ppm2      9.137 CV     1
 ASSI {  412}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      2.600     1.100     1.100 peak   412 spectrum    1 weight  0.10000E+01 volume  0.46014E-02 ppm1      8.096 ppm2      9.137 CV     1
 ASSI {  413}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      3.200     1.500     1.500 peak   413 spectrum    1 weight  0.10000E+01 volume  0.14834E-02 ppm1      8.537 ppm2      9.137 CV     1
 ASSI {  414}
   (( segid "    " and resid 29   and name HG3 ))
   (( segid "    " and resid 29   and name HN  ))
      3.400     1.600     1.600 peak   414 spectrum    1 weight  0.10000E+01 volume  0.10691E-02 ppm1      1.009 ppm2      8.536 CV     1
 ASSI {  415}
   (( segid "    " and resid 29   and name HD3 ))
   (( segid "    " and resid 29   and name HN  ))
      6.000     4.700     0.000 peak   415 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.176 ppm2      8.536 CV     1
 OR {  415}
   (( segid "    " and resid 29   and name HD2 ))
   (( segid "    " and resid 29   and name HN  ))
 ASSI {  416}
   (( segid "    " and resid 29   and name HB3 ))
   (( segid "    " and resid 29   and name HN  ))
      2.600     1.000     1.000 peak   416 spectrum    1 weight  0.10000E+01 volume  0.56087E-02 ppm1      1.509 ppm2      8.536 CV     1
 OR {  416}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HN  ))
 ASSI {  417}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 29   and name HN  ))
      6.000     4.700     0.000 peak   417 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.467 ppm2      8.536 CV     1
 ASSI {  418}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      6.000     4.700     0.000 peak   418 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.309 ppm2      8.536 CV     1
 ASSI {  419}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 29   and name HG3 ))
      6.000     4.700     0.000 peak   419 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.467 ppm2      1.010 CV     1
 ASSI {  420}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HG3 ))
      6.000     4.700     0.000 peak   420 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.306 ppm2      1.010 CV     1
 ASSI {  421}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HB2 ))
      6.000     4.700     0.000 peak   421 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.306 ppm2      1.508 CV     1
 OR {  421}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HB3 ))
 ASSI {  422}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 30   and name HN  ))
      2.800     1.200     1.200 peak   422 spectrum    1 weight  0.10000E+01 volume  0.31821E-02 ppm1      0.420 ppm2      8.607 CV     1
 ASSI {  423}
   (( segid "    " and resid 30   and name HG2%)))
   (( segid "    " and resid 30   and name HN  ))
      3.600     1.800     1.800 peak   423 spectrum    1 weight  0.10000E+01 volume  0.68677E-03 ppm1      0.898 ppm2      8.606 CV     1
 ASSI {  424}
   (( segid "    " and resid 30   and name HG12))))
   (( segid "    " and resid 30   and name HN  ))
      6.000     4.700     0.000 peak   424 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.258 ppm2      8.606 CV     1
 ASSI {  425}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 30   and name HN  ))
      6.000     4.700     0.000 peak   425 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.538 ppm2      8.604 CV     1
 ASSI {  426}
   (( segid "    " and resid 30   and name HG13))))
   (( segid "    " and resid 30   and name HN  ))
      2.900     1.300     1.300 peak   426 spectrum    1 weight  0.10000E+01 volume  0.25639E-02 ppm1     -0.604 ppm2      8.606 CV     1
 ASSI {  427}
   (( segid "    " and resid 29   and name HD2 ))
   (( segid "    " and resid 30   and name HN  ))
      6.000     4.700     0.000 peak   427 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.176 ppm2      8.608 CV     1
 OR {  427}
   (( segid "    " and resid 29   and name HD3 ))
   (( segid "    " and resid 30   and name HN  ))
 ASSI {  428}
   (( segid "    " and resid 29   and name HG3 ))
   (( segid "    " and resid 30   and name HN  ))
      6.000     4.700     0.000 peak   428 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.009 ppm2      8.606 CV     1
 ASSI {  429}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      2.200     0.800     0.800 peak   429 spectrum    1 weight  0.10000E+01 volume  0.12156E-01 ppm1      4.303 ppm2      8.604 CV     1
 ASSI {  430}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      6.000     4.700     0.000 peak   430 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.980 ppm2      8.606 CV     1
 ASSI {  431}
   (( segid "    " and resid 30   and name HG12))))
   (( segid "    " and resid 30   and name HG13))))
      6.000     4.700     0.000 peak   431 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.252 ppm2     -0.606 CV     1
 ASSI {  432}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 30   and name HG13))))
      6.000     4.700     0.000 peak   432 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.418 ppm2     -0.607 CV     1
 ASSI {  433}
   (( segid "    " and resid 30   and name HG2%)))
   (( segid "    " and resid 30   and name HG13))))
      3.300     1.500     1.500 peak   433 spectrum    1 weight  0.10000E+01 volume  0.12591E-02 ppm1      0.895 ppm2     -0.608 CV     1
 ASSI {  434}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 30   and name HG13))))
      6.000     4.700     0.000 peak   434 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.547 ppm2     -0.609 CV     1
 ASSI {  435}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HG13))))
      3.300     1.500     1.500 peak   435 spectrum    1 weight  0.10000E+01 volume  0.12477E-02 ppm1      3.990 ppm2     -0.609 CV     1
 ASSI {  436}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HD1%)))
      3.800     2.000     2.000 peak   436 spectrum    1 weight  0.10000E+01 volume  0.55400E-03 ppm1      3.990 ppm2      0.419 CV     1
 ASSI {  437}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HG2%)))
      2.500     1.000     1.000 peak   437 spectrum    1 weight  0.10000E+01 volume  0.66617E-02 ppm1      3.994 ppm2      0.899 CV     1
 ASSI {  438}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 30   and name HG2%)))
      6.000     4.700     0.000 peak   438 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.564 ppm2      0.895 CV     1
 ASSI {  439}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 30   and name HD1%)))
      2.200     0.800     0.800 peak   439 spectrum    1 weight  0.10000E+01 volume  0.14399E-01 ppm1      1.561 ppm2      0.419 CV     1
 ASSI {  441}
   (( segid "    " and resid 30   and name HG12))))
   (( segid "    " and resid 31   and name HN  ))
      6.000     4.700     0.000 peak   441 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.263 ppm2      9.405 CV     1
 ASSI {  442}
   (( segid "    " and resid 30   and name HG2%)))
   (( segid "    " and resid 31   and name HN  ))
      3.600     1.800     1.800 peak   442 spectrum    1 weight  0.10000E+01 volume  0.70738E-03 ppm1      0.895 ppm2      9.406 CV     1
 ASSI {  443}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      3.600     1.800     1.800 peak   443 spectrum    1 weight  0.10000E+01 volume  0.71196E-03 ppm1      3.990 ppm2      9.406 CV     1
 ASSI {  444}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      3.900     2.100     2.100 peak   444 spectrum    1 weight  0.10000E+01 volume  0.47159E-03 ppm1      4.472 ppm2      9.406 CV     1
 ASSI {  445}
   (( segid "    " and resid 31   and name HB% ))
   (( segid "    " and resid 31   and name HN  ))
      6.000     4.700     0.000 peak   445 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.281 ppm2      9.406 CV     1
 ASSI {  446}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB% ))
      2.100     0.700     0.700 peak   446 spectrum    1 weight  0.10000E+01 volume  0.19275E-01 ppm1      4.469 ppm2      1.280 CV     1
 ASSI {  447}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      2.200     0.800     0.800 peak   447 spectrum    1 weight  0.10000E+01 volume  0.12248E-01 ppm1      4.474 ppm2      6.777 CV     1
 ASSI {  448}
   (( segid "    " and resid 31   and name HB% ))
   (( segid "    " and resid 32   and name HN  ))
      3.100     1.400     1.400 peak   448 spectrum    1 weight  0.10000E+01 volume  0.18955E-02 ppm1      1.279 ppm2      6.777 CV     1
 ASSI {  449}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      2.800     1.200     1.200 peak   449 spectrum    1 weight  0.10000E+01 volume  0.30447E-02 ppm1      4.532 ppm2      6.775 CV     1
 ASSI {  450}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 32   and name HN  ))
      2.900     1.300     1.300 peak   450 spectrum    1 weight  0.10000E+01 volume  0.25182E-02 ppm1      3.372 ppm2      6.773 CV     1
 ASSI {  451}
   (( segid "    " and resid 32   and name HB3 ))
   (( segid "    " and resid 32   and name HN  ))
      2.800     1.200     1.200 peak   451 spectrum    1 weight  0.10000E+01 volume  0.33194E-02 ppm1      2.501 ppm2      6.775 CV     1
 ASSI {  452}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HB2 ))
      2.500     1.000     1.000 peak   452 spectrum    1 weight  0.10000E+01 volume  0.64099E-02 ppm1      4.529 ppm2      3.367 CV     1
 ASSI {  454}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      3.200     1.500     1.500 peak   454 spectrum    1 weight  0.10000E+01 volume  0.14170E-02 ppm1      6.777 ppm2      9.405 CV     1
 ASSI {  455}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 33   and name HN  ))
      3.000     1.300     1.300 peak   455 spectrum    1 weight  0.10000E+01 volume  0.22893E-02 ppm1      3.369 ppm2      8.534 CV     1
 ASSI {  456}
   (( segid "    " and resid 32   and name HB3 ))
   (( segid "    " and resid 33   and name HN  ))
      6.000     4.700     0.000 peak   456 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.498 ppm2      8.534 CV     1
 ASSI {  457}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name HN  ))
      6.000     4.700     0.000 peak   457 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.529 ppm2      8.534 CV     1
 ASSI {  458}
   (( segid "    " and resid 33   and name HB3 ))
   (( segid "    " and resid 33   and name HN  ))
      6.000     4.700     0.000 peak   458 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.480 ppm2      8.534 CV     1
 ASSI {  459}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HN  ))
      6.000     4.700     0.000 peak   459 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.803 ppm2      8.534 CV     1
 ASSI {  460}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HN  ))
      2.700     1.100     1.100 peak   460 spectrum    1 weight  0.10000E+01 volume  0.37773E-02 ppm1      3.743 ppm2      8.534 CV     1
 ASSI {  461}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      3.800     2.000     2.000 peak   461 spectrum    1 weight  0.10000E+01 volume  0.54942E-03 ppm1      6.775 ppm2      8.532 CV     1
 ASSI {  462}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HB2 ))
      3.100     1.400     1.400 peak   462 spectrum    1 weight  0.10000E+01 volume  0.17856E-02 ppm1      3.740 ppm2      1.810 CV     1
 ASSI {  463}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 34   and name HN  ))
      6.000     4.700     0.000 peak   463 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.743 ppm2      8.201 CV     1
 ASSI {  464}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      3.000     1.300     1.300 peak   464 spectrum    1 weight  0.10000E+01 volume  0.21336E-02 ppm1      8.212 ppm2      8.534 CV     1
 ASSI {  465}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB3 ))
      2.700     1.100     1.100 peak   465 spectrum    1 weight  0.10000E+01 volume  0.36399E-02 ppm1      5.823 ppm2      2.909 CV     1
 ASSI {  466}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
      2.700     1.100     1.100 peak   466 spectrum    1 weight  0.10000E+01 volume  0.40520E-02 ppm1      5.823 ppm2      2.986 CV     1
 ASSI {  467}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 35   and name HN  ))
      6.000     4.700     0.000 peak   467 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.919 ppm2      9.096 CV     1
 ASSI {  468}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
      6.000     4.700     0.000 peak   468 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.990 ppm2      9.094 CV     1
 ASSI {  469}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      2.500     1.000     1.000 peak   469 spectrum    1 weight  0.10000E+01 volume  0.66617E-02 ppm1      5.823 ppm2      9.094 CV     1
 ASSI {  470}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      6.000     4.700     0.000 peak   470 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.203 ppm2      9.091 CV     1
 ASSI {  471}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      3.600     1.800     1.800 peak   471 spectrum    1 weight  0.10000E+01 volume  0.69365E-03 ppm1      4.879 ppm2      9.097 CV     1
 ASSI {  472}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
      3.600     1.900     1.900 peak   472 spectrum    1 weight  0.10000E+01 volume  0.67532E-03 ppm1      2.053 ppm2      9.096 CV     1
 ASSI {  473}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 35   and name HN  ))
      6.000     4.700     0.000 peak   473 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.884 ppm2      9.094 CV     1
 ASSI {  474}
   (( segid "    " and resid 35   and name HD1%)))
   (( segid "    " and resid 35   and name HN  ))
      6.000     4.700     0.000 peak   474 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.952 ppm2      9.097 CV     1
 ASSI {  475}
   (( segid "    " and resid 35   and name HD2%)))
   (( segid "    " and resid 35   and name HN  ))
      3.500     1.700     1.700 peak   475 spectrum    1 weight  0.10000E+01 volume  0.91799E-03 ppm1      0.757 ppm2      9.097 CV     1
 ASSI {  476}
   (( segid "    " and resid 35   and name HG  ))
   (( segid "    " and resid 35   and name HN  ))
      6.000     4.700     0.000 peak   476 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.702 ppm2      9.094 CV     1
 ASSI {  478}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HG  ))
      3.400     1.600     1.600 peak   478 spectrum    1 weight  0.10000E+01 volume  0.10164E-02 ppm1      4.872 ppm2      1.700 CV     1
 ASSI {  481}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 36   and name HN  ))
      2.800     1.100     1.100 peak   481 spectrum    1 weight  0.10000E+01 volume  0.35941E-02 ppm1      2.054 ppm2      8.783 CV     1
 ASSI {  482}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 36   and name HN  ))
      6.000     4.700     0.000 peak   482 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.884 ppm2      8.783 CV     1
 ASSI {  483}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 36   and name HN  ))
      6.000     4.700     0.000 peak   483 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.858 ppm2      8.781 CV     1
 ASSI {  484}
   (( segid "    " and resid 35   and name HG  ))
   (( segid "    " and resid 36   and name HN  ))
      6.000     4.700     0.000 peak   484 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.694 ppm2      8.781 CV     1
 ASSI {  485}
   (( segid "    " and resid 35   and name HD1%)))
   (( segid "    " and resid 36   and name HN  ))
      6.000     4.700     0.000 peak   485 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.952 ppm2      8.781 CV     1
 ASSI {  486}
   (( segid "    " and resid 35   and name HD2%)))
   (( segid "    " and resid 36   and name HN  ))
      3.300     1.600     1.600 peak   486 spectrum    1 weight  0.10000E+01 volume  0.11583E-02 ppm1      0.756 ppm2      8.781 CV     1
 ASSI {  487}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HN  ))
      6.000     4.700     0.000 peak   487 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.868 ppm2      8.781 CV     1
 ASSI {  488}
   (( segid "    " and resid 36   and name HB3 ))
   (( segid "    " and resid 36   and name HN  ))
      6.000     4.700     0.000 peak   488 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.244 ppm2      8.781 CV     1
 ASSI {  489}
   (( segid "    " and resid 36   and name HD2%)))
   (( segid "    " and resid 36   and name HN  ))
      6.000     4.700     0.000 peak   489 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.862 ppm2      8.781 CV     1
 ASSI {  490}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HN  ))
      3.200     1.500     1.500 peak   490 spectrum    1 weight  0.10000E+01 volume  0.14789E-02 ppm1      5.608 ppm2      8.785 CV     1
 ASSI {  491}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 36   and name HB3 ))
      1.900     0.700     0.700 peak   491 spectrum    1 weight  0.10000E+01 volume  0.30218E-01 ppm1      1.855 ppm2      1.230 CV     1
 ASSI {  492}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB3 ))
      2.900     1.200     1.200 peak   492 spectrum    1 weight  0.10000E+01 volume  0.28845E-02 ppm1      5.611 ppm2      1.228 CV     1
 ASSI {  493}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HD2%)))
      2.600     1.000     1.000 peak   493 spectrum    1 weight  0.10000E+01 volume  0.54255E-02 ppm1      5.609 ppm2      0.854 CV     1
 ASSI {  495}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HN  ))
      2.800     1.200     1.200 peak   495 spectrum    1 weight  0.10000E+01 volume  0.29532E-02 ppm1      2.682 ppm2      9.309 CV     1
 ASSI {  496}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HN  ))
      3.000     1.300     1.300 peak   496 spectrum    1 weight  0.10000E+01 volume  0.22114E-02 ppm1      2.878 ppm2      9.308 CV     1
 ASSI {  497}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 37   and name HN  ))
      3.400     1.600     1.600 peak   497 spectrum    1 weight  0.10000E+01 volume  0.10393E-02 ppm1      1.861 ppm2      9.308 CV     1
 ASSI {  498}
   (( segid "    " and resid 36   and name HB3 ))
   (( segid "    " and resid 37   and name HN  ))
      6.000     4.700     0.000 peak   498 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.239 ppm2      9.308 CV     1
 ASSI {  499}
   (( segid "    " and resid 36   and name HD2%)))
   (( segid "    " and resid 37   and name HN  ))
      6.000     4.700     0.000 peak   499 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.862 ppm2      9.308 CV     1
 ASSI {  500}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      2.600     1.000     1.000 peak   500 spectrum    1 weight  0.10000E+01 volume  0.56544E-02 ppm1      5.611 ppm2      9.308 CV     1
 ASSI {  501}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      6.000     4.700     0.000 peak   501 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.684 ppm2      9.308 CV     1
 ASSI {  504}
   (( segid "    " and resid 37   and name HD% ))
   (( segid "    " and resid 37   and name HN  ))
      6.000     4.700     0.000 peak   504 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.706 ppm2      9.308 CV     1
 ASSI {  505}
   (( segid "    " and resid 37   and name HE% ))
   (( segid "    " and resid 37   and name HD% ))
      1.800     0.600     0.600 peak   505 spectrum    1 weight  0.10000E+01 volume  0.45785E-01 ppm1      6.397 ppm2      6.705 CV     1
 ASSI {  506}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HD% ))
      6.000     4.700     0.000 peak   506 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.684 ppm2      6.705 CV     1
 ASSI {  508}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HD% ))
      2.900     1.200     1.200 peak   508 spectrum    1 weight  0.10000E+01 volume  0.26555E-02 ppm1      2.690 ppm2      6.705 CV     1
 ASSI {  509}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HD% ))
      2.900     1.300     1.300 peak   509 spectrum    1 weight  0.10000E+01 volume  0.23808E-02 ppm1      2.878 ppm2      6.705 CV     1
 ASSI {  510}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HE% ))
      6.000     4.700     0.000 peak   510 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.685 ppm2      6.399 CV     1
 ASSI {  511}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HE% ))
      6.000     4.700     0.000 peak   511 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.878 ppm2      6.399 CV     1
 ASSI {  512}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      6.000     4.700     0.000 peak   512 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.895 ppm2      9.308 CV     1
 ASSI {  513}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      2.400     0.900     0.900 peak   513 spectrum    1 weight  0.10000E+01 volume  0.90887E-02 ppm1      5.684 ppm2      8.894 CV     1
 ASSI {  514}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 38   and name HN  ))
      6.000     4.700     0.000 peak   514 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.878 ppm2      8.894 CV     1
 ASSI {  515}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 38   and name HN  ))
      6.000     4.700     0.000 peak   515 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.685 ppm2      8.894 CV     1
 ASSI {  516}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      6.000     4.700     0.000 peak   516 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.453 ppm2      8.894 CV     1
 ASSI {  517}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 38   and name HN  ))
      6.000     4.700     0.000 peak   517 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.157 ppm2      8.894 CV     1
 ASSI {  518}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB% ))
      2.100     0.800     0.800 peak   518 spectrum    1 weight  0.10000E+01 volume  0.15819E-01 ppm1      4.453 ppm2      1.156 CV     1
 ASSI {  519}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HB3 ))
      3.000     1.400     1.400 peak   519 spectrum    1 weight  0.10000E+01 volume  0.19642E-02 ppm1      3.976 ppm2      2.121 CV     1
 ASSI {  520}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HG3 ))
      2.800     1.200     1.200 peak   520 spectrum    1 weight  0.10000E+01 volume  0.34110E-02 ppm1      3.976 ppm2      2.497 CV     1
 OR {  520}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HG2 ))
 ASSI {  521}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      2.500     1.000     1.000 peak   521 spectrum    1 weight  0.10000E+01 volume  0.65015E-02 ppm1      3.977 ppm2      9.861 CV     1
 ASSI {  522}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 39   and name HN  ))
      6.000     4.700     0.000 peak   522 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.121 ppm2      9.864 CV     1
 ASSI {  523}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 39   and name HN  ))
      3.200     1.500     1.500 peak   523 spectrum    1 weight  0.10000E+01 volume  0.15315E-02 ppm1      2.495 ppm2      9.861 CV     1
 OR {  523}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 39   and name HN  ))
 ASSI {  524}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HB2 ))
      2.700     1.100     1.100 peak   524 spectrum    1 weight  0.10000E+01 volume  0.36399E-02 ppm1      3.976 ppm2      2.397 CV     1
 ASSI {  525}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HN  ))
      3.400     1.600     1.600 peak   525 spectrum    1 weight  0.10000E+01 volume  0.10943E-02 ppm1      2.402 ppm2      9.860 CV     1
 ASSI {  526}
   (( segid "    " and resid 666  and name HB2 ))
   (( segid "    " and resid 666  and name HD% ))
      2.600     1.000     1.000 peak   526 spectrum    1 weight  0.10000E+01 volume  0.56316E-02 ppm1      3.655 ppm2      7.255 CV     1
 ASSI {  527}
   (( segid "    " and resid 666  and name HB3 ))
   (( segid "    " and resid 666  and name HD% ))
      2.600     1.000     1.000 peak   527 spectrum    1 weight  0.10000E+01 volume  0.54255E-02 ppm1      2.533 ppm2      7.255 CV     1
 ASSI {  528}
   (( segid "    " and resid 666  and name HB3 ))
   (( segid "    " and resid 666  and name HE% ))
      3.400     1.600     1.600 peak   528 spectrum    1 weight  0.10000E+01 volume  0.10301E-02 ppm1      2.530 ppm2      6.819 CV     1
 ASSI {  529}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 666  and name HD% ))
      6.000     4.700     0.000 peak   529 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.757 ppm2      7.255 CV     1
 ASSI {  530}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 666  and name HE% ))
      6.000     4.700     0.000 peak   530 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.757 ppm2      6.819 CV     1
 ASSI {  531}
   (( segid "    " and resid 666  and name HE% ))
   (( segid "    " and resid 666  and name HD% ))
      2.200     0.800     0.800 peak   531 spectrum    1 weight  0.10000E+01 volume  0.13575E-01 ppm1      6.820 ppm2      7.255 CV     1
 ASSI {  532}
   (( segid "    " and resid 666  and name HD% ))
   (( segid "    " and resid 666  and name HN  ))
      2.800     1.200     1.200 peak   532 spectrum    1 weight  0.10000E+01 volume  0.34110E-02 ppm1      7.255 ppm2      7.790 CV     1
 ASSI {  534}
   (( segid "    " and resid 668  and name HA  ))
   (( segid "    " and resid 668  and name HG2 ))
      6.000     4.700     0.000 peak   534 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.295 ppm2      2.201 CV     1
 OR {  534}
   (( segid "    " and resid 668  and name HA  ))
   (( segid "    " and resid 668  and name HG3 ))
 ASSI {  535}
   (( segid "    " and resid 668  and name HG2 ))
   (( segid "    " and resid 669  and name HN  ))
      3.400     1.600     1.600 peak   535 spectrum    1 weight  0.10000E+01 volume  0.10897E-02 ppm1      2.200 ppm2      8.512 CV     1
 OR {  535}
   (( segid "    " and resid 668  and name HG3 ))
   (( segid "    " and resid 669  and name HN  ))
 ASSI {  536}
   (( segid "    " and resid 668  and name HG3 ))
   (( segid "    " and resid 668  and name HN  ))
      6.000     4.700     0.000 peak   536 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.200 ppm2      8.644 CV     1
 OR {  536}
   (( segid "    " and resid 668  and name HG2 ))
   (( segid "    " and resid 668  and name HN  ))
 ASSI {  537}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      3.200     1.500     1.500 peak   537 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      8.580 ppm2      9.862 CV     1
 ASSI {  538}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      3.100     1.400     1.400 peak   538 spectrum    1 weight  0.10000E+01 volume  0.17925E-02 ppm1      5.708 ppm2      8.570 CV     1
 ASSI {  539}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      6.000     4.700     0.000 peak   539 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.566 ppm2      8.570 CV     1
 ASSI {  540}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 42   and name HN  ))
      6.000     4.700     0.000 peak   540 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.578 ppm2      8.570 CV     1
 ASSI {  541}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 42   and name HN  ))
      6.000     4.700     0.000 peak   541 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.528 ppm2      8.570 CV     1
 ASSI {  542}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HN  ))
      6.000     4.700     0.000 peak   542 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.763 ppm2      8.572 CV     1
 ASSI {  543}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 42   and name HN  ))
      6.000     4.700     0.000 peak   543 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.692 ppm2      8.570 CV     1
 ASSI {  544}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB2 ))
      2.700     1.100     1.100 peak   544 spectrum    1 weight  0.10000E+01 volume  0.38689E-02 ppm1      5.708 ppm2      2.770 CV     1
 ASSI {  545}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB3 ))
      6.000     4.700     0.000 peak   545 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.708 ppm2      2.696 CV     1
 ASSI {  546}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 42   and name HD% ))
      2.400     0.900     0.900 peak   546 spectrum    1 weight  0.10000E+01 volume  0.81268E-02 ppm1      2.695 ppm2      7.232 CV     1
 ASSI {  547}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 42   and name HE% ))
      6.000     6.000     0.000 peak   547 spectrum    1 weight  0.10000E+01 volume  0.10645E-04 ppm1      2.690 ppm2      6.705 CV     1
 ASSI {  548}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HD% ))
      6.000     4.700     0.000 peak   548 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.763 ppm2      7.234 CV     1
 ASSI {  549}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HE% ))
      3.300     1.500     1.500 peak   549 spectrum    1 weight  0.10000E+01 volume  0.12636E-02 ppm1      2.763 ppm2      6.706 CV     1
 ASSI {  550}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HE% ))
      6.000     4.700     0.000 peak   550 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.708 ppm2      6.706 CV     1
 ASSI {  551}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HD% ))
      2.500     1.000     1.000 peak   551 spectrum    1 weight  0.10000E+01 volume  0.57231E-02 ppm1      5.708 ppm2      7.232 CV     1
 ASSI {  552}
   (( segid "    " and resid 42   and name HE% ))
   (( segid "    " and resid 42   and name HD% ))
      1.800     0.600     0.600 peak   552 spectrum    1 weight  0.10000E+01 volume  0.45785E-01 ppm1      6.702 ppm2      7.232 CV     1
 ASSI {  553}
   (( segid "    " and resid 42   and name HE% ))
   (( segid "    " and resid 42   and name HN  ))
      3.900     2.100     2.100 peak   553 spectrum    1 weight  0.10000E+01 volume  0.45556E-03 ppm1      6.702 ppm2      8.570 CV     1
 ASSI {  554}
   (( segid "    " and resid 42   and name HD% ))
   (( segid "    " and resid 42   and name HN  ))
      2.700     1.100     1.100 peak   554 spectrum    1 weight  0.10000E+01 volume  0.36628E-02 ppm1      7.231 ppm2      8.570 CV     1
 ASSI {  555}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 43   and name HN  ))
      6.000     4.700     0.000 peak   555 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.692 ppm2      9.127 CV     1
 ASSI {  556}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 43   and name HN  ))
      6.000     4.700     0.000 peak   556 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.763 ppm2      9.127 CV     1
 ASSI {  558}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB2 ))
      3.000     1.300     1.300 peak   558 spectrum    1 weight  0.10000E+01 volume  0.22526E-02 ppm1      5.705 ppm2      3.455 CV     1
 ASSI {  559}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 44   and name HN  ))
      3.000     1.300     1.300 peak   559 spectrum    1 weight  0.10000E+01 volume  0.20969E-02 ppm1      3.455 ppm2      9.264 CV     1
 ASSI {  560}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      2.600     1.100     1.100 peak   560 spectrum    1 weight  0.10000E+01 volume  0.48761E-02 ppm1      5.706 ppm2      9.264 CV     1
 ASSI {  561}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
      6.000     4.700     0.000 peak   561 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.134 ppm2      9.264 CV     1
 ASSI {  562}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      3.400     1.700     1.700 peak   562 spectrum    1 weight  0.10000E+01 volume  0.98441E-03 ppm1      5.042 ppm2      9.263 CV     1
 ASSI {  563}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HN  ))
      3.200     1.500     1.500 peak   563 spectrum    1 weight  0.10000E+01 volume  0.15132E-02 ppm1      3.566 ppm2      9.264 CV     1
 ASSI {  564}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HN  ))
      6.000     4.700     0.000 peak   564 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.965 ppm2      9.264 CV     1
 ASSI {  565}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
      6.000     4.700     0.000 peak   565 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.952 ppm2     10.035 CV     1
 ASSI {  566}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 45   and name HN  ))
      3.100     1.400     1.400 peak   566 spectrum    1 weight  0.10000E+01 volume  0.16459E-02 ppm1      3.569 ppm2     10.031 CV     1
 ASSI {  567}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      4.200     2.400     1.800 peak   567 spectrum    1 weight  0.10000E+01 volume  0.28387E-03 ppm1      9.255 ppm2     10.029 CV     1
 ASSI {  568}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 45   and name HN  ))
      3.000     1.300     1.300 peak   568 spectrum    1 weight  0.10000E+01 volume  0.21816E-02 ppm1      3.929 ppm2     10.032 CV     1
 ASSI {  569}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
      2.900     1.200     1.200 peak   569 spectrum    1 weight  0.10000E+01 volume  0.26555E-02 ppm1      4.001 ppm2     10.030 CV     1
 ASSI {  570}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 46   and name HN  ))
      3.400     1.600     1.600 peak   570 spectrum    1 weight  0.10000E+01 volume  0.10462E-02 ppm1      3.933 ppm2      7.984 CV     1
 ASSI {  571}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      6.000     4.700     0.000 peak   571 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.002 ppm2      7.984 CV     1
 ASSI {  572}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      3.200     1.500     1.500 peak   572 spectrum    1 weight  0.10000E+01 volume  0.15498E-02 ppm1      7.985 ppm2     10.031 CV     1
 ASSI {  573}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      6.000     4.700     0.000 peak   573 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.377 ppm2      7.982 CV     1
 ASSI {  574}
   (( segid "    " and resid 46   and name HD3 ))
   (( segid "    " and resid 46   and name HN  ))
      6.000     4.700     0.000 peak   574 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.122 ppm2      7.982 CV     1
 OR {  574}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI {  575}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      6.000     4.700     0.000 peak   575 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.895 ppm2      7.984 CV     1
 OR {  575}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI {  576}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HN  ))
      6.000     4.700     0.000 peak   576 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.895 ppm2      7.985 CV     1
 ASSI {  577}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HD2 ))
      3.300     1.600     1.600 peak   577 spectrum    1 weight  0.10000E+01 volume  0.12179E-02 ppm1      4.378 ppm2      3.127 CV     1
 OR {  577}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HD3 ))
 ASSI {  578}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HB3 ))
      6.000     4.700     0.000 peak   578 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.364 ppm2      1.894 CV     1
 OR {  578}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI {  579}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HG2 ))
      2.300     0.900     0.900 peak   579 spectrum    1 weight  0.10000E+01 volume  0.10920E-01 ppm1      3.124 ppm2      1.889 CV     1
 OR {  579}
   (( segid "    " and resid 46   and name HD3 ))
   (( segid "    " and resid 46   and name HG2 ))
 ASSI {  580}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      6.000     4.700     0.000 peak   580 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.379 ppm2      7.829 CV     1
 ASSI {  581}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 47   and name HN  ))
      6.000     4.700     0.000 peak   581 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.895 ppm2      7.828 CV     1
 OR {  581}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 47   and name HN  ))
 ASSI {  582}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 47   and name HN  ))
      6.000     4.700     0.000 peak   582 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.300 ppm2      7.828 CV     1
 ASSI {  583}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HN  ))
      6.000     4.700     0.000 peak   583 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.528 ppm2      7.828 CV     1
 ASSI {  584}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      2.800     1.200     1.200 peak   584 spectrum    1 weight  0.10000E+01 volume  0.29761E-02 ppm1      4.443 ppm2      7.828 CV     1
 ASSI {  587}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.700     0.000 peak   587 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.442 ppm2      7.033 CV     1
 ASSI {  588}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.700     0.000 peak   588 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.528 ppm2      7.031 CV     1
 ASSI {  589}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.700     0.000 peak   589 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.300 ppm2      7.031 CV     1
 ASSI {  590}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      2.700     1.100     1.100 peak   590 spectrum    1 weight  0.10000E+01 volume  0.37544E-02 ppm1      1.608 ppm2      7.033 CV     1
 ASSI {  591}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 48   and name HN  ))
      2.800     1.200     1.200 peak   591 spectrum    1 weight  0.10000E+01 volume  0.32507E-02 ppm1      0.440 ppm2      7.032 CV     1
 ASSI {  592}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 48   and name HN  ))
      3.000     1.300     1.300 peak   592 spectrum    1 weight  0.10000E+01 volume  0.20809E-02 ppm1      0.112 ppm2      7.033 CV     1
 ASSI {  593}
   (( segid "    " and resid 48   and name HD2%)))
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.700     0.000 peak   593 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     -0.815 ppm2      7.035 CV     1
 ASSI {  594}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.700     0.000 peak   594 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.917 ppm2      7.033 CV     1
 ASSI {  595}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 48   and name HD2%)))
      2.500     1.000     1.000 peak   595 spectrum    1 weight  0.10000E+01 volume  0.65930E-02 ppm1      0.117 ppm2     -0.815 CV     1
 ASSI {  596}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 48   and name HD2%)))
      2.900     1.200     1.200 peak   596 spectrum    1 weight  0.10000E+01 volume  0.27471E-02 ppm1      0.430 ppm2     -0.815 CV     1
 ASSI {  597}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HD2%)))
      2.600     1.000     1.000 peak   597 spectrum    1 weight  0.10000E+01 volume  0.51050E-02 ppm1      1.585 ppm2     -0.815 CV     1
 ASSI {  599}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HB3 ))
      6.000     4.700     0.000 peak   599 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.608 ppm2      0.444 CV     1
 ASSI {  600}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HB3 ))
      3.000     1.300     1.300 peak   600 spectrum    1 weight  0.10000E+01 volume  0.21588E-02 ppm1      3.918 ppm2      0.435 CV     1
 ASSI {  601}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HD1%)))
      3.300     1.600     1.600 peak   601 spectrum    1 weight  0.10000E+01 volume  0.11950E-02 ppm1      3.917 ppm2      0.118 CV     1
 ASSI {  603}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HD2%)))
      2.600     1.100     1.100 peak   603 spectrum    1 weight  0.10000E+01 volume  0.45099E-02 ppm1      3.915 ppm2     -0.815 CV     1
 ASSI {  604}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      6.000     4.700     0.000 peak   604 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.050 ppm2      7.828 CV     1
 ASSI {  605}
   (( segid "    " and resid 48   and name HD2%)))
   (( segid "    " and resid 49   and name HN  ))
      2.800     1.200     1.200 peak   605 spectrum    1 weight  0.10000E+01 volume  0.31134E-02 ppm1     -0.816 ppm2      7.455 CV     1
 ASSI {  606}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      2.400     0.900     0.900 peak   606 spectrum    1 weight  0.10000E+01 volume  0.87675E-02 ppm1      3.916 ppm2      7.455 CV     1
 ASSI {  607}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      6.000     4.700     0.000 peak   607 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.036 ppm2      7.454 CV     1
 ASSI {  608}
   (( segid "    " and resid 49   and name HG3 ))
   (( segid "    " and resid 49   and name HN  ))
      3.400     1.600     1.600 peak   608 spectrum    1 weight  0.10000E+01 volume  0.10210E-02 ppm1      1.024 ppm2      7.456 CV     1
 ASSI {  609}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 49   and name HN  ))
      3.800     2.000     2.000 peak   609 spectrum    1 weight  0.10000E+01 volume  0.52195E-03 ppm1      1.141 ppm2      7.456 CV     1
 ASSI {  610}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HN  ))
      3.800     2.000     2.000 peak   610 spectrum    1 weight  0.10000E+01 volume  0.48761E-03 ppm1      1.290 ppm2      7.456 CV     1
 ASSI {  611}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HN  ))
      3.200     1.500     1.500 peak   611 spectrum    1 weight  0.10000E+01 volume  0.15498E-02 ppm1      1.374 ppm2      7.456 CV     1
 ASSI {  612}
   (( segid "    " and resid 49   and name HD2 ))
   (( segid "    " and resid 49   and name HN  ))
      4.100     2.300     1.900 peak   612 spectrum    1 weight  0.10000E+01 volume  0.32507E-03 ppm1      1.684 ppm2      7.456 CV     1
 OR {  612}
   (( segid "    " and resid 49   and name HD3 ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  614}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HG2 ))
      3.400     1.700     1.700 peak   614 spectrum    1 weight  0.10000E+01 volume  0.93168E-03 ppm1      5.040 ppm2      1.132 CV     1
 ASSI {  615}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HB3 ))
      3.000     1.300     1.300 peak   615 spectrum    1 weight  0.10000E+01 volume  0.22893E-02 ppm1      5.042 ppm2      1.302 CV     1
 ASSI {  616}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HB2 ))
      2.900     1.300     1.300 peak   616 spectrum    1 weight  0.10000E+01 volume  0.24724E-02 ppm1      5.041 ppm2      1.391 CV     1
 ASSI {  618}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      2.600     1.000     1.000 peak   618 spectrum    1 weight  0.10000E+01 volume  0.52653E-02 ppm1      5.040 ppm2      8.666 CV     1
 ASSI {  619}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      6.000     4.700     0.000 peak   619 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.241 ppm2      8.667 CV     1
 ASSI {  620}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.100     1.400     1.400 peak   620 spectrum    1 weight  0.10000E+01 volume  0.18085E-02 ppm1      3.408 ppm2      8.667 CV     1
 ASSI {  621}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 50   and name HN  ))
      3.100     1.400     1.400 peak   621 spectrum    1 weight  0.10000E+01 volume  0.19299E-02 ppm1      2.830 ppm2      8.667 CV     1
 ASSI {  622}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      6.000     4.700     0.000 peak   622 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.456 ppm2      8.666 CV     1
 ASSI {  623}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HB3 ))
      6.000     4.700     0.000 peak   623 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.408 ppm2      2.828 CV     1
 ASSI {  625}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 51   and name HN  ))
      3.700     1.900     1.900 peak   625 spectrum    1 weight  0.10000E+01 volume  0.64328E-03 ppm1      2.833 ppm2     10.073 CV     1
 ASSI {  626}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 51   and name HN  ))
      4.100     2.300     1.900 peak   626 spectrum    1 weight  0.10000E+01 volume  0.33423E-03 ppm1      3.406 ppm2     10.074 CV     1
 ASSI {  627}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      2.500     1.000     1.000 peak   627 spectrum    1 weight  0.10000E+01 volume  0.56773E-02 ppm1      4.252 ppm2     10.077 CV     1
 ASSI {  628}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      6.000     4.700     0.000 peak   628 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.301 ppm2     10.076 CV     1
 ASSI {  629}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 51   and name HN  ))
      2.800     1.200     1.200 peak   629 spectrum    1 weight  0.10000E+01 volume  0.29074E-02 ppm1      3.937 ppm2     10.072 CV     1
 OR {  629}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  630}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      3.600     1.900     1.900 peak   630 spectrum    1 weight  0.10000E+01 volume  0.66159E-03 ppm1      8.669 ppm2     10.072 CV     1
 ASSI {  631}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      3.100     1.400     1.400 peak   631 spectrum    1 weight  0.10000E+01 volume  0.17696E-02 ppm1      8.924 ppm2     10.075 CV     1
 ASSI {  632}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      2.500     1.000     1.000 peak   632 spectrum    1 weight  0.10000E+01 volume  0.65930E-02 ppm1      4.601 ppm2      8.923 CV     1
 ASSI {  633}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HN  ))
      2.600     1.000     1.000 peak   633 spectrum    1 weight  0.10000E+01 volume  0.56544E-02 ppm1      3.783 ppm2      8.923 CV     1
 ASSI {  634}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 52   and name HN  ))
      2.700     1.100     1.100 peak   634 spectrum    1 weight  0.10000E+01 volume  0.38917E-02 ppm1      3.566 ppm2      8.923 CV     1
 ASSI {  635}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 52   and name HN  ))
      2.800     1.200     1.200 peak   635 spectrum    1 weight  0.10000E+01 volume  0.32050E-02 ppm1      3.949 ppm2      8.923 CV     1
 OR {  635}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI {  636}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB3 ))
      2.600     1.000     1.000 peak   636 spectrum    1 weight  0.10000E+01 volume  0.52424E-02 ppm1      4.598 ppm2      3.564 CV     1
 ASSI {  637}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      3.100     1.400     1.400 peak   637 spectrum    1 weight  0.10000E+01 volume  0.16758E-02 ppm1      4.603 ppm2      3.785 CV     1
 ASSI {  638}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 53   and name HN  ))
      3.100     1.400     1.400 peak   638 spectrum    1 weight  0.10000E+01 volume  0.19207E-02 ppm1      3.565 ppm2      8.193 CV     1
 ASSI {  639}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
      6.000     4.700     0.000 peak   639 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.787 ppm2      8.194 CV     1
 ASSI {  640}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      2.700     1.100     1.100 peak   640 spectrum    1 weight  0.10000E+01 volume  0.36170E-02 ppm1      4.604 ppm2      8.192 CV     1
 ASSI {  643}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 54   and name HN  ))
      6.000     4.700     0.000 peak   643 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.259 ppm2      7.964 CV     1
 ASSI {  644}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      2.300     0.800     0.800 peak   644 spectrum    1 weight  0.10000E+01 volume  0.11401E-01 ppm1      4.129 ppm2      7.965 CV     1
 ASSI {  645}
   (( segid "    " and resid 54   and name HG3 ))
   (( segid "    " and resid 54   and name HN  ))
      3.000     1.400     1.400 peak   645 spectrum    1 weight  0.10000E+01 volume  0.19894E-02 ppm1      2.210 ppm2      7.964 CV     1
 ASSI {  647}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.700     1.100     1.100 peak   647 spectrum    1 weight  0.10000E+01 volume  0.44640E-02 ppm1      7.965 ppm2      8.190 CV     1
 ASSI {  648}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
      6.000     4.700     0.000 peak   648 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.119 ppm2      2.519 CV     1
 ASSI {  649}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HG2 ))
      2.100     0.700     0.700 peak   649 spectrum    1 weight  0.10000E+01 volume  0.20649E-01 ppm1      4.122 ppm2      2.314 CV     1
 ASSI {  650}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HG3 ))
      6.000     4.700     0.000 peak   650 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.119 ppm2      2.209 CV     1
 ASSI {  651}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 55   and name HN  ))
      6.000     4.700     0.000 peak   651 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.340 ppm2      8.864 CV     1
 ASSI {  652}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 55   and name HN  ))
      3.200     1.500     1.500 peak   652 spectrum    1 weight  0.10000E+01 volume  0.15521E-02 ppm1      2.529 ppm2      8.864 CV     1
 ASSI {  653}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      2.800     1.200     1.200 peak   653 spectrum    1 weight  0.10000E+01 volume  0.33652E-02 ppm1      4.130 ppm2      8.864 CV     1
 ASSI {  654}
   (( segid "    " and resid 55   and name HB% ))
   (( segid "    " and resid 55   and name HN  ))
      2.400     0.900     0.900 peak   654 spectrum    1 weight  0.10000E+01 volume  0.81955E-02 ppm1      1.419 ppm2      8.866 CV     1
 ASSI {  655}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      2.700     1.100     1.100 peak   655 spectrum    1 weight  0.10000E+01 volume  0.39375E-02 ppm1      4.237 ppm2      8.866 CV     1
 ASSI {  656}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      3.000     1.300     1.300 peak   656 spectrum    1 weight  0.10000E+01 volume  0.22732E-02 ppm1      7.965 ppm2      8.866 CV     1
 ASSI {  657}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB% ))
      6.000     4.700     0.000 peak   657 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.238 ppm2      1.422 CV     1
 ASSI {  659}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      2.200     0.800     0.800 peak   659 spectrum    1 weight  0.10000E+01 volume  0.15521E-01 ppm1      4.236 ppm2      8.648 CV     1
 ASSI {  660}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HN  ))
      2.500     1.000     1.000 peak   660 spectrum    1 weight  0.10000E+01 volume  0.59749E-02 ppm1      2.043 ppm2      8.647 CV     1
 ASSI {  661}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      2.500     1.000     1.000 peak   661 spectrum    1 weight  0.10000E+01 volume  0.60894E-02 ppm1      2.232 ppm2      8.645 CV     1
 ASSI {  662}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 56   and name HN  ))
      2.800     1.200     1.200 peak   662 spectrum    1 weight  0.10000E+01 volume  0.29989E-02 ppm1      2.432 ppm2      8.646 CV     1
 ASSI {  663}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HN  ))
      2.800     1.200     1.200 peak   663 spectrum    1 weight  0.10000E+01 volume  0.35025E-02 ppm1      2.502 ppm2      8.646 CV     1
 ASSI {  664}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      6.000     4.700     0.000 peak   664 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.084 ppm2      8.646 CV     1
 ASSI {  666}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HG2 ))
      6.000     4.700     0.000 peak   666 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.086 ppm2      2.505 CV     1
 ASSI {  667}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HG3 ))
      3.000     1.300     1.300 peak   667 spectrum    1 weight  0.10000E+01 volume  0.20581E-02 ppm1      4.085 ppm2      2.431 CV     1
 ASSI {  668}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      6.000     4.700     0.000 peak   668 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.092 ppm2      2.228 CV     1
 ASSI {  669}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB3 ))
      2.900     1.300     1.300 peak   669 spectrum    1 weight  0.10000E+01 volume  0.24495E-02 ppm1      4.086 ppm2      2.043 CV     1
 ASSI {  670}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HE21))))
      3.400     1.700     1.700 peak   670 spectrum    1 weight  0.10000E+01 volume  0.97292E-03 ppm1      2.041 ppm2      7.846 CV     1
 ASSI {  671}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HE21))))
      3.200     1.500     1.500 peak   671 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      2.231 ppm2      7.846 CV     1
 ASSI {  672}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 56   and name HE21))))
      3.400     1.600     1.600 peak   672 spectrum    1 weight  0.10000E+01 volume  0.10988E-02 ppm1      2.433 ppm2      7.846 CV     1
 ASSI {  673}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HE21))))
      3.000     1.400     1.400 peak   673 spectrum    1 weight  0.10000E+01 volume  0.19344E-02 ppm1      2.503 ppm2      7.846 CV     1
 ASSI {  674}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HE22))))
      3.100     1.400     1.400 peak   674 spectrum    1 weight  0.10000E+01 volume  0.17375E-02 ppm1      2.502 ppm2      7.064 CV     1
 ASSI {  676}
   (( segid "    " and resid 56   and name HE22))))
   (( segid "    " and resid 56   and name HE21))))
      2.100     0.700     0.700 peak   676 spectrum    1 weight  0.10000E+01 volume  0.20558E-01 ppm1      7.076 ppm2      7.847 CV     1
 ASSI {  677}
   (( segid "    " and resid 56   and name HE21))))
   (( segid "    " and resid 56   and name HN  ))
      6.000     4.700     0.000 peak   677 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.845 ppm2      8.646 CV     1
 ASSI {  679}
   (( segid "    " and resid 57   and name HD1%)))
   (( segid "    " and resid 58   and name HN  ))
      4.200     2.400     1.800 peak   679 spectrum    1 weight  0.10000E+01 volume  0.27699E-03 ppm1      0.670 ppm2      8.609 CV     1
 ASSI {  680}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HD1%)))
      2.400     0.900     0.900 peak   680 spectrum    1 weight  0.10000E+01 volume  0.86078E-02 ppm1      4.528 ppm2      0.676 CV     1
 ASSI {  681}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      6.000     4.700     0.000 peak   681 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.519 ppm2      1.486 CV     1
 OR {  681}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB3 ))
 ASSI {  684}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      2.600     1.100     1.100 peak   684 spectrum    1 weight  0.10000E+01 volume  0.47845E-02 ppm1      4.620 ppm2      7.703 CV     1
 ASSI {  685}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HN  ))
      2.800     1.200     1.200 peak   685 spectrum    1 weight  0.10000E+01 volume  0.33881E-02 ppm1      2.608 ppm2      7.704 CV     1
 ASSI {  686}
   (( segid "    " and resid 59   and name HB3 ))
   (( segid "    " and resid 59   and name HN  ))
      2.700     1.100     1.100 peak   686 spectrum    1 weight  0.10000E+01 volume  0.39146E-02 ppm1      2.496 ppm2      7.703 CV     1
 ASSI {  687}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      3.000     1.300     1.300 peak   687 spectrum    1 weight  0.10000E+01 volume  0.20878E-02 ppm1      7.704 ppm2      8.608 CV     1
 ASSI {  688}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB3 ))
      2.300     0.900     0.900 peak   688 spectrum    1 weight  0.10000E+01 volume  0.10210E-01 ppm1      4.608 ppm2      2.499 CV     1
 ASSI {  689}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.300     1.600     1.600 peak   689 spectrum    1 weight  0.10000E+01 volume  0.11538E-02 ppm1      4.608 ppm2      2.612 CV     1
 ASSI {  690}
   (( segid "    " and resid 59   and name HB3 ))
   (( segid "    " and resid 60   and name HN  ))
      3.400     1.700     1.700 peak   690 spectrum    1 weight  0.10000E+01 volume  0.99126E-03 ppm1      2.497 ppm2      8.288 CV     1
 ASSI {  691}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
      3.200     1.400     1.400 peak   691 spectrum    1 weight  0.10000E+01 volume  0.15613E-02 ppm1      2.608 ppm2      8.290 CV     1
 ASSI {  692}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
      2.200     0.800     0.800 peak   692 spectrum    1 weight  0.10000E+01 volume  0.13895E-01 ppm1      4.617 ppm2      8.292 CV     1
 ASSI {  693}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      3.000     1.300     1.300 peak   693 spectrum    1 weight  0.10000E+01 volume  0.20626E-02 ppm1      7.707 ppm2      8.289 CV     1
 ASSI {  694}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
      6.000     4.700     0.000 peak   694 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.940 ppm2      8.288 CV     1
 ASSI {  695}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HN  ))
      6.000     4.700     0.000 peak   695 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.851 ppm2      8.288 CV     1
 ASSI {  696}
   (( segid "    " and resid 60   and name HG12))))
   (( segid "    " and resid 60   and name HN  ))
      2.700     1.100     1.100 peak   696 spectrum    1 weight  0.10000E+01 volume  0.40749E-02 ppm1      1.532 ppm2      8.290 CV     1
 ASSI {  697}
   (( segid "    " and resid 60   and name HG13))))
   (( segid "    " and resid 60   and name HN  ))
      2.800     1.200     1.200 peak   697 spectrum    1 weight  0.10000E+01 volume  0.32736E-02 ppm1      1.255 ppm2      8.290 CV     1
 ASSI {  698}
   (( segid "    " and resid 60   and name HG2%)))
   (( segid "    " and resid 60   and name HN  ))
      2.900     1.200     1.200 peak   698 spectrum    1 weight  0.10000E+01 volume  0.27929E-02 ppm1      0.925 ppm2      8.290 CV     1
 ASSI {  699}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HB  ))
      2.500     1.000     1.000 peak   699 spectrum    1 weight  0.10000E+01 volume  0.62039E-02 ppm1      3.932 ppm2      1.850 CV     1
 ASSI {  700}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HG12))))
      6.000     4.700     0.000 peak   700 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.932 ppm2      1.537 CV     1
 ASSI {  701}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HG13))))
      3.000     1.300     1.300 peak   701 spectrum    1 weight  0.10000E+01 volume  0.22206E-02 ppm1      3.933 ppm2      1.254 CV     1
 ASSI {  702}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HG2%)))
      2.600     1.000     1.000 peak   702 spectrum    1 weight  0.10000E+01 volume  0.52653E-02 ppm1      3.933 ppm2      0.924 CV     1
 ASSI {  703}
   (( segid "    " and resid 60   and name HG2%)))
   (( segid "    " and resid 61   and name HN  ))
      2.400     0.900     0.900 peak   703 spectrum    1 weight  0.10000E+01 volume  0.89053E-02 ppm1      0.924 ppm2      8.763 CV     1
 ASSI {  704}
   (( segid "    " and resid 60   and name HG13))))
   (( segid "    " and resid 61   and name HN  ))
      6.000     4.700     0.000 peak   704 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.258 ppm2      8.765 CV     1
 ASSI {  707}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      2.400     0.900     0.900 peak   707 spectrum    1 weight  0.10000E+01 volume  0.90658E-02 ppm1      3.932 ppm2      8.764 CV     1
 ASSI {  708}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.400     1.600     1.600 peak   708 spectrum    1 weight  0.10000E+01 volume  0.99810E-03 ppm1      8.294 ppm2      8.763 CV     1
 ASSI {  709}
   (( segid "    " and resid 61   and name HA1 ))
   (( segid "    " and resid 61   and name HN  ))
      6.000     4.700     0.000 peak   709 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.108 ppm2      8.764 CV     1
 ASSI {  710}
   (( segid "    " and resid 61   and name HA2 ))
   (( segid "    " and resid 61   and name HN  ))
      6.000     4.700     0.000 peak   710 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.800 ppm2      8.763 CV     1
 ASSI {  711}
   (( segid "    " and resid 61   and name HA1 ))
   (( segid "    " and resid 62   and name HN  ))
      6.000     4.700     0.000 peak   711 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.105 ppm2      7.728 CV     1
 ASSI {  712}
   (( segid "    " and resid 61   and name HA2 ))
   (( segid "    " and resid 62   and name HN  ))
      6.000     4.700     0.000 peak   712 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.797 ppm2      7.726 CV     1
 ASSI {  713}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      2.700     1.100     1.100 peak   713 spectrum    1 weight  0.10000E+01 volume  0.37773E-02 ppm1      7.730 ppm2      8.767 CV     1
 ASSI {  714}
   (( segid "    " and resid 62   and name HG2%)))
   (( segid "    " and resid 62   and name HN  ))
      2.700     1.100     1.100 peak   714 spectrum    1 weight  0.10000E+01 volume  0.38002E-02 ppm1      1.256 ppm2      7.726 CV     1
 ASSI {  715}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 62   and name HN  ))
      6.000     4.700     0.000 peak   715 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.175 ppm2      7.729 CV     1
 ASSI {  716}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      2.700     1.100     1.100 peak   716 spectrum    1 weight  0.10000E+01 volume  0.43724E-02 ppm1      4.508 ppm2      7.728 CV     1
 ASSI {  717}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 62   and name HG2%)))
      6.000     4.700     0.000 peak   717 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.173 ppm2      1.257 CV     1
 ASSI {  718}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HG2%)))
      2.200     0.800     0.800 peak   718 spectrum    1 weight  0.10000E+01 volume  0.14560E-01 ppm1      4.507 ppm2      1.256 CV     1
 ASSI {  719}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      2.400     0.900     0.900 peak   719 spectrum    1 weight  0.10000E+01 volume  0.90422E-02 ppm1      4.508 ppm2      8.777 CV     1
 ASSI {  722}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      4.300     2.600     1.700 peak   722 spectrum    1 weight  0.10000E+01 volume  0.23122E-03 ppm1      7.737 ppm2      8.777 CV     1
 ASSI {  723}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      6.000     4.700     0.000 peak   723 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.535 ppm2      8.777 CV     1
 ASSI {  724}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 63   and name HN  ))
      3.100     1.400     1.400 peak   724 spectrum    1 weight  0.10000E+01 volume  0.16139E-02 ppm1      3.704 ppm2      8.777 CV     1
 OR {  724}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HN  ))
 ASSI {  725}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 64   and name HN  ))
      2.800     1.200     1.200 peak   725 spectrum    1 weight  0.10000E+01 volume  0.34567E-02 ppm1      3.702 ppm2      8.373 CV     1
 OR {  725}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI {  727}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 64   and name HN  ))
      3.900     2.100     2.100 peak   727 spectrum    1 weight  0.10000E+01 volume  0.43266E-03 ppm1      3.469 ppm2      8.372 CV     1
 ASSI {  728}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HN  ))
      3.900     2.100     2.100 peak   728 spectrum    1 weight  0.10000E+01 volume  0.41893E-03 ppm1      3.615 ppm2      8.377 CV     1
 ASSI {  729}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB3 ))
      2.700     1.100     1.100 peak   729 spectrum    1 weight  0.10000E+01 volume  0.39146E-02 ppm1      4.793 ppm2      3.465 CV     1
 ASSI {  730}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      2.700     1.100     1.100 peak   730 spectrum    1 weight  0.10000E+01 volume  0.38002E-02 ppm1      4.792 ppm2      3.612 CV     1
 ASSI {  731}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      2.600     1.000     1.000 peak   731 spectrum    1 weight  0.10000E+01 volume  0.53569E-02 ppm1      4.793 ppm2      8.932 CV     1
 ASSI {  732}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 65   and name HN  ))
      6.000     4.700     0.000 peak   732 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.467 ppm2      8.932 CV     1
 ASSI {  733}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      6.000     4.700     0.000 peak   733 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.616 ppm2      8.933 CV     1
 ASSI {  734}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      6.000     4.700     0.000 peak   734 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.943 ppm2      8.931 CV     1
 ASSI {  735}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 65   and name HN  ))
      6.000     4.700     0.000 peak   735 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.277 ppm2      8.931 CV     1
 ASSI {  736}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      6.000     4.700     0.000 peak   736 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.427 ppm2      8.931 CV     1
 ASSI {  737}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HB2 ))
      2.900     1.200     1.200 peak   737 spectrum    1 weight  0.10000E+01 volume  0.26555E-02 ppm1      4.947 ppm2      2.429 CV     1
 ASSI {  738}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HB3 ))
      6.000     4.700     0.000 peak   738 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.946 ppm2      2.276 CV     1
 ASSI {  740}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 66   and name HN  ))
      6.000     4.700     0.000 peak   740 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.427 ppm2      8.920 CV     1
 ASSI {  741}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 66   and name HN  ))
      6.000     4.700     0.000 peak   741 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.277 ppm2      8.920 CV     1
 ASSI {  742}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
      3.400     1.600     1.600 peak   742 spectrum    1 weight  0.10000E+01 volume  0.10805E-02 ppm1      5.544 ppm2      8.921 CV     1
 ASSI {  743}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 66   and name HN  ))
      3.300     1.500     1.500 peak   743 spectrum    1 weight  0.10000E+01 volume  0.12431E-02 ppm1      4.159 ppm2      8.919 CV     1
 ASSI {  744}
   (( segid "    " and resid 66   and name HG2%)))
   (( segid "    " and resid 66   and name HN  ))
      2.300     0.800     0.800 peak   744 spectrum    1 weight  0.10000E+01 volume  0.11263E-01 ppm1      1.134 ppm2      8.922 CV     1
 ASSI {  745}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB  ))
      6.000     4.700     0.000 peak   745 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.541 ppm2      4.159 CV     1
 ASSI {  746}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HG2%)))
      3.000     1.300     1.300 peak   746 spectrum    1 weight  0.10000E+01 volume  0.21748E-02 ppm1      5.545 ppm2      1.132 CV     1
 ASSI {  747}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 66   and name HG2%)))
      6.000     4.700     0.000 peak   747 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.158 ppm2      1.136 CV     1
 ASSI {  748}
   (( segid "    " and resid 66   and name HG2%)))
   (( segid "    " and resid 67   and name HN  ))
      3.000     1.400     1.400 peak   748 spectrum    1 weight  0.10000E+01 volume  0.19390E-02 ppm1      1.126 ppm2      7.767 CV     1
 ASSI {  749}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 67   and name HN  ))
      6.000     4.700     0.000 peak   749 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.168 ppm2      7.764 CV     1
 ASSI {  750}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      2.400     0.900     0.900 peak   750 spectrum    1 weight  0.10000E+01 volume  0.79437E-02 ppm1      5.542 ppm2      7.765 CV     1
 ASSI {  751}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      4.400     2.600     1.600 peak   751 spectrum    1 weight  0.10000E+01 volume  0.20833E-03 ppm1      7.773 ppm2      8.919 CV     1
 ASSI {  752}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
      3.200     1.500     1.500 peak   752 spectrum    1 weight  0.10000E+01 volume  0.13575E-02 ppm1      1.442 ppm2      7.767 CV     1
 ASSI {  753}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      3.200     1.400     1.400 peak   753 spectrum    1 weight  0.10000E+01 volume  0.15864E-02 ppm1      4.328 ppm2      7.769 CV     1
 ASSI {  754}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 67   and name HN  ))
      2.500     1.000     1.000 peak   754 spectrum    1 weight  0.10000E+01 volume  0.71654E-02 ppm1      1.065 ppm2      7.764 CV     1
 ASSI {  757}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 68   and name HN  ))
      2.600     1.100     1.100 peak   757 spectrum    1 weight  0.10000E+01 volume  0.45328E-02 ppm1      4.327 ppm2      9.245 CV     1
 ASSI {  758}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 68   and name HN  ))
      6.000     4.700     0.000 peak   758 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.445 ppm2      9.243 CV     1
 ASSI {  759}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 68   and name HN  ))
      6.000     4.700     0.000 peak   759 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.061 ppm2      9.244 CV     1
 ASSI {  760}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 68   and name HN  ))
      3.200     1.500     1.500 peak   760 spectrum    1 weight  0.10000E+01 volume  0.13644E-02 ppm1      0.660 ppm2      9.245 CV     1
 ASSI {  761}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      6.000     4.700     0.000 peak   761 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.774 ppm2      9.240 CV     1
 ASSI {  762}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HN  ))
      2.500     1.000     1.000 peak   762 spectrum    1 weight  0.10000E+01 volume  0.57231E-02 ppm1      4.036 ppm2      9.245 CV     1
 ASSI {  763}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HN  ))
      6.000     4.700     0.000 peak   763 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.268 ppm2      9.243 CV     1
 ASSI {  765}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 69   and name HN  ))
      6.000     4.700     0.000 peak   765 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.841 ppm2      8.795 CV     1
 ASSI {  766}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
      2.900     1.300     1.300 peak   766 spectrum    1 weight  0.10000E+01 volume  0.25182E-02 ppm1      4.038 ppm2      8.794 CV     1
 ASSI {  767}
   (( segid "    " and resid 69   and name HA1 ))
   (( segid "    " and resid 69   and name HN  ))
      6.000     4.700     0.000 peak   767 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.160 ppm2      8.797 CV     1
 ASSI {  768}
   (( segid "    " and resid 69   and name HA2 ))
   (( segid "    " and resid 69   and name HN  ))
      2.500     1.000     1.000 peak   768 spectrum    1 weight  0.10000E+01 volume  0.69594E-02 ppm1      3.593 ppm2      8.795 CV     1
 ASSI {  769}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.200     1.500     1.500 peak   769 spectrum    1 weight  0.10000E+01 volume  0.13942E-02 ppm1      8.797 ppm2      9.246 CV     1
 ASSI {  770}
   (( segid "    " and resid 69   and name HA1 ))
   (( segid "    " and resid 69   and name HA2 ))
      6.000     4.700     0.000 peak   770 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.166 ppm2      3.599 CV     1
 ASSI {  774}
   (( segid "    " and resid 70   and name HG3 ))
   (( segid "    " and resid 70   and name HN  ))
      3.300     1.600     1.600 peak   774 spectrum    1 weight  0.10000E+01 volume  0.11263E-02 ppm1      2.577 ppm2      7.994 CV     1
 ASSI {  775}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HN  ))
      3.100     1.400     1.400 peak   775 spectrum    1 weight  0.10000E+01 volume  0.18222E-02 ppm1      2.635 ppm2      7.994 CV     1
 ASSI {  776}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
      2.600     1.000     1.000 peak   776 spectrum    1 weight  0.10000E+01 volume  0.52424E-02 ppm1      2.341 ppm2      7.992 CV     1
 ASSI {  778}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB3 ))
      6.000     4.700     0.000 peak   778 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.649 ppm2      1.920 CV     1
 ASSI {  779}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
      6.000     4.700     0.000 peak   779 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.649 ppm2      2.346 CV     1
 ASSI {  780}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HG3 ))
      6.000     4.700     0.000 peak   780 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.649 ppm2      2.578 CV     1
 ASSI {  781}
   (( segid "    " and resid 70   and name HB3 ))
   (( segid "    " and resid 71   and name HN  ))
      6.000     4.700     0.000 peak   781 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.911 ppm2      8.444 CV     1
 ASSI {  782}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HN  ))
      6.000     4.700     0.000 peak   782 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.343 ppm2      8.444 CV     1
 ASSI {  783}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
      6.000     4.700     0.000 peak   783 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.649 ppm2      8.444 CV     1
 ASSI {  784}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
      6.000     4.700     0.000 peak   784 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.613 ppm2      8.444 CV     1
 ASSI {  785}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 71   and name HN  ))
      2.600     1.100     1.100 peak   785 spectrum    1 weight  0.10000E+01 volume  0.48761E-02 ppm1      1.683 ppm2      8.444 CV     1
 ASSI {  786}
   (( segid "    " and resid 71   and name HG13))))
   (( segid "    " and resid 71   and name HN  ))
      3.500     1.700     1.700 peak   786 spectrum    1 weight  0.10000E+01 volume  0.82413E-03 ppm1      0.929 ppm2      8.444 CV     1
 ASSI {  787}
   (( segid "    " and resid 71   and name HG2%)))
   (( segid "    " and resid 71   and name HN  ))
      6.000     4.700     0.000 peak   787 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.587 ppm2      8.444 CV     1
 ASSI {  788}
   (( segid "    " and resid 71   and name HD1%)))
   (( segid "    " and resid 71   and name HN  ))
      6.000     4.700     0.000 peak   788 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.641 ppm2      8.441 CV     1
 ASSI {  789}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HG2%)))
      2.700     1.100     1.100 peak   789 spectrum    1 weight  0.10000E+01 volume  0.41206E-02 ppm1      4.614 ppm2      0.582 CV     1
 ASSI {  790}
   (( segid "    " and resid 71   and name HG2%)))
   (( segid "    " and resid 72   and name HN  ))
      2.900     1.200     1.200 peak   790 spectrum    1 weight  0.10000E+01 volume  0.28616E-02 ppm1      0.582 ppm2      9.479 CV     1
 ASSI {  791}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 72   and name HN  ))
      6.000     4.700     0.000 peak   791 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.683 ppm2      9.479 CV     1
 ASSI {  792}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      2.400     0.900     0.900 peak   792 spectrum    1 weight  0.10000E+01 volume  0.73714E-02 ppm1      4.613 ppm2      9.479 CV     1
 ASSI {  793}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      4.200     2.400     1.800 peak   793 spectrum    1 weight  0.10000E+01 volume  0.28158E-03 ppm1      8.448 ppm2      9.475 CV     1
 ASSI {  794}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      3.200     1.500     1.500 peak   794 spectrum    1 weight  0.10000E+01 volume  0.14217E-02 ppm1      6.143 ppm2      9.478 CV     1
 ASSI {  796}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 72   and name HN  ))
      6.000     4.700     0.000 peak   796 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.683 ppm2      9.478 CV     1
 ASSI {  797}
   (( segid "    " and resid 72   and name HD1%)))
   (( segid "    " and resid 72   and name HN  ))
      3.000     1.300     1.300 peak   797 spectrum    1 weight  0.10000E+01 volume  0.22160E-02 ppm1      1.111 ppm2      9.478 CV     1
 ASSI {  798}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 72   and name HN  ))
      6.000     4.600     0.000 peak   798 spectrum    1 weight  0.10000E+01 volume  0.35025E-04 ppm1      1.111 ppm2      9.478 CV     1
 ASSI {  800}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HD1%)))
      2.500     1.000     1.000 peak   800 spectrum    1 weight  0.10000E+01 volume  0.60207E-02 ppm1      6.142 ppm2      1.102 CV     1
 ASSI {  801}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HD2%)))
      4.700     2.900     1.300 peak   801 spectrum    1 weight  0.10000E+01 volume  0.15109E-03 ppm1      6.142 ppm2      1.102 CV     1
 ASSI {  802}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      6.000     4.700     0.000 peak   802 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.986 ppm2      9.479 CV     1
 ASSI {  803}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      2.600     1.000     1.000 peak   803 spectrum    1 weight  0.10000E+01 volume  0.55629E-02 ppm1      6.141 ppm2      8.990 CV     1
 ASSI {  804}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.700     0.000 peak   804 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.683 ppm2      8.988 CV     1
 ASSI {  805}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.700     0.000 peak   805 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.566 ppm2      8.990 CV     1
 ASSI {  807}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.700     0.000 peak   807 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.940 ppm2      8.989 CV     1
 ASSI {  808}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HB3 ))
      2.100     0.800     0.800 peak   808 spectrum    1 weight  0.10000E+01 volume  0.15933E-01 ppm1      3.558 ppm2      2.894 CV     1
 ASSI {  809}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB3 ))
      2.700     1.100     1.100 peak   809 spectrum    1 weight  0.10000E+01 volume  0.41206E-02 ppm1      4.937 ppm2      2.895 CV     1
 ASSI {  810}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB2 ))
      2.600     1.100     1.100 peak   810 spectrum    1 weight  0.10000E+01 volume  0.47616E-02 ppm1      4.936 ppm2      3.559 CV     1
 ASSI {  811}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 74   and name HN  ))
      6.000     4.700     0.000 peak   811 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.898 ppm2      8.968 CV     1
 ASSI {  812}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HN  ))
      6.000     4.700     0.000 peak   812 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.082 ppm2      8.968 CV     1
 ASSI {  815}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 74   and name HN  ))
      6.000     4.700     0.000 peak   815 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.888 ppm2      8.968 CV     1
 ASSI {  816}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.700     0.000 peak   816 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.913 ppm2      8.521 CV     1
 ASSI {  817}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.700     0.000 peak   817 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.704 ppm2      8.520 CV     1
 ASSI {  818}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.700     0.000 peak   818 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.347 ppm2      8.521 CV     1
 ASSI {  819}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 75   and name HN  ))
      3.100     1.400     1.400 peak   819 spectrum    1 weight  0.10000E+01 volume  0.18749E-02 ppm1      1.901 ppm2      8.520 CV     1
 ASSI {  820}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
      2.900     1.300     1.300 peak   820 spectrum    1 weight  0.10000E+01 volume  0.24953E-02 ppm1      2.088 ppm2      8.516 CV     1
 ASSI {  821}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB3 ))
      2.300     0.900     0.900 peak   821 spectrum    1 weight  0.10000E+01 volume  0.10508E-01 ppm1      4.352 ppm2      2.696 CV     1
 ASSI {  822}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.700     1.100     1.100 peak   822 spectrum    1 weight  0.10000E+01 volume  0.38917E-02 ppm1      4.352 ppm2      2.914 CV     1
 ASSI {  823}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 76   and name HN  ))
      3.000     1.300     1.300 peak   823 spectrum    1 weight  0.10000E+01 volume  0.22778E-02 ppm1      2.706 ppm2      9.047 CV     1
 ASSI {  824}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 76   and name HN  ))
      2.700     1.100     1.100 peak   824 spectrum    1 weight  0.10000E+01 volume  0.38460E-02 ppm1      2.910 ppm2      9.046 CV     1
 ASSI {  825}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 76   and name HN  ))
      3.000     1.300     1.300 peak   825 spectrum    1 weight  0.10000E+01 volume  0.23579E-02 ppm1      2.543 ppm2      9.046 CV     1
 ASSI {  826}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HN  ))
      2.700     1.100     1.100 peak   826 spectrum    1 weight  0.10000E+01 volume  0.41664E-02 ppm1      3.088 ppm2      9.047 CV     1
 ASSI {  829}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HB3 ))
      2.300     0.800     0.800 peak   829 spectrum    1 weight  0.10000E+01 volume  0.11812E-01 ppm1      3.089 ppm2      2.542 CV     1
 ASSI {  830}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HB3 ))
      6.000     4.700     0.000 peak   830 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.754 ppm2      2.538 CV     1
 ASSI {  831}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HB2 ))
      6.000     4.700     0.000 peak   831 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.756 ppm2      3.091 CV     1
 ASSI {  832}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HN  ))
      3.300     1.600     1.600 peak   832 spectrum    1 weight  0.10000E+01 volume  0.11080E-02 ppm1      3.983 ppm2      8.960 CV     1
 ASSI {  833}
   (( segid "    " and resid 77   and name HB3 ))
   (( segid "    " and resid 77   and name HN  ))
      2.800     1.200     1.200 peak   833 spectrum    1 weight  0.10000E+01 volume  0.32050E-02 ppm1      2.708 ppm2      8.960 CV     1
 ASSI {  834}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 77   and name HN  ))
      6.000     4.700     0.000 peak   834 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.842 ppm2      8.960 CV     1
 ASSI {  835}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HB2 ))
      6.000     4.700     0.000 peak   835 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.987 ppm2      2.851 CV     1
 ASSI {  836}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HB3 ))
      6.000     4.700     0.000 peak   836 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.990 ppm2      2.709 CV     1
 ASSI {  837}
   (( segid "    " and resid 77   and name HB3 ))
   (( segid "    " and resid 78   and name HN  ))
      3.100     1.400     1.400 peak   837 spectrum    1 weight  0.10000E+01 volume  0.19184E-02 ppm1      2.710 ppm2      8.281 CV     1
 ASSI {  838}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 78   and name HN  ))
      3.200     1.400     1.400 peak   838 spectrum    1 weight  0.10000E+01 volume  0.15613E-02 ppm1      2.840 ppm2      8.279 CV     1
 ASSI {  839}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.000     1.300     1.300 peak   839 spectrum    1 weight  0.10000E+01 volume  0.21931E-02 ppm1      8.282 ppm2      8.960 CV     1
 ASSI {  840}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HN  ))
      3.100     1.400     1.400 peak   840 spectrum    1 weight  0.10000E+01 volume  0.16459E-02 ppm1      3.318 ppm2      8.280 CV     1
 ASSI {  841}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 78   and name HN  ))
      6.000     4.700     0.000 peak   841 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.851 ppm2      8.280 CV     1
 ASSI {  842}
   (( segid "    " and resid 78   and name HG12))))
   (( segid "    " and resid 78   and name HN  ))
      6.000     4.700     0.000 peak   842 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.734 ppm2      8.278 CV     1
 ASSI {  845}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HG2%)))
      2.300     0.900     0.900 peak   845 spectrum    1 weight  0.10000E+01 volume  0.10119E-01 ppm1      3.318 ppm2      0.825 CV     1
 ASSI {  846}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HG13))))
      3.000     1.300     1.300 peak   846 spectrum    1 weight  0.10000E+01 volume  0.23350E-02 ppm1      3.318 ppm2      1.198 CV     1
 ASSI {  847}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HG12))))
      3.000     1.300     1.300 peak   847 spectrum    1 weight  0.10000E+01 volume  0.22549E-02 ppm1      3.315 ppm2      1.725 CV     1
 ASSI {  848}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HB  ))
      3.000     1.300     1.300 peak   848 spectrum    1 weight  0.10000E+01 volume  0.21084E-02 ppm1      3.315 ppm2      1.850 CV     1
 ASSI {  849}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 78   and name HG2%)))
      6.000     4.700     0.000 peak   849 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.851 ppm2      0.825 CV     1
 ASSI {  850}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      6.000     4.700     0.000 peak   850 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.314 ppm2      7.816 CV     1
 ASSI {  851}
   (( segid "    " and resid 78   and name HG13))))
   (( segid "    " and resid 79   and name HN  ))
      6.000     4.700     0.000 peak   851 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.203 ppm2      7.813 CV     1
 ASSI {  852}
   (( segid "    " and resid 78   and name HG2%)))
   (( segid "    " and resid 79   and name HN  ))
      2.800     1.200     1.200 peak   852 spectrum    1 weight  0.10000E+01 volume  0.29074E-02 ppm1      0.831 ppm2      7.818 CV     1
 ASSI {  855}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 79   and name HN  ))
      6.000     4.700     0.000 peak   855 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.820 ppm2      7.814 CV     1
 ASSI {  857}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HN  ))
      6.000     4.700     0.000 peak   857 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.545 ppm2      7.818 CV     1
 ASSI {  858}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HG3 ))
      3.200     1.500     1.500 peak   858 spectrum    1 weight  0.10000E+01 volume  0.13438E-02 ppm1      3.861 ppm2      1.345 CV     1
 ASSI {  859}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HG2 ))
      2.800     1.200     1.200 peak   859 spectrum    1 weight  0.10000E+01 volume  0.32507E-02 ppm1      3.861 ppm2      1.543 CV     1
 ASSI {  860}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 80   and name HN  ))
      6.000     4.700     0.000 peak   860 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.870 ppm2      7.701 CV     1
 ASSI {  861}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 80   and name HN  ))
      6.000     4.700     0.000 peak   861 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.819 ppm2      7.698 CV     1
 ASSI {  862}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 80   and name HN  ))
      3.100     1.400     1.400 peak   862 spectrum    1 weight  0.10000E+01 volume  0.19115E-02 ppm1      1.909 ppm2      7.697 CV     1
 ASSI {  863}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HN  ))
      6.000     4.700     0.000 peak   863 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.912 ppm2      7.816 CV     1
 ASSI {  864}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HN  ))
      2.400     0.900     0.900 peak   864 spectrum    1 weight  0.10000E+01 volume  0.77377E-02 ppm1      3.813 ppm2      7.701 CV     1
 ASSI {  865}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 80   and name HN  ))
      3.000     1.300     1.300 peak   865 spectrum    1 weight  0.10000E+01 volume  0.22068E-02 ppm1      0.638 ppm2      7.697 CV     1
 ASSI {  866}
   (( segid "    " and resid 80   and name HD2%)))
   (( segid "    " and resid 80   and name HN  ))
      3.200     1.500     1.500 peak   866 spectrum    1 weight  0.10000E+01 volume  0.13919E-02 ppm1      0.560 ppm2      7.694 CV     1
 ASSI {  867}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HN  ))
      2.600     1.100     1.100 peak   867 spectrum    1 weight  0.10000E+01 volume  0.46472E-02 ppm1      1.195 ppm2      7.695 CV     1
 ASSI {  868}
   (( segid "    " and resid 80   and name HG  ))
   (( segid "    " and resid 80   and name HN  ))
      6.000     4.700     0.000 peak   868 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.410 ppm2      7.695 CV     1
 ASSI {  869}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 80   and name HN  ))
      2.800     1.200     1.200 peak   869 spectrum    1 weight  0.10000E+01 volume  0.29303E-02 ppm1      0.102 ppm2      7.695 CV     1
 ASSI {  870}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 80   and name HB3 ))
      6.000     4.700     0.000 peak   870 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.642 ppm2      0.116 CV     1
 ASSI {  871}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HB3 ))
      2.500     1.000     1.000 peak   871 spectrum    1 weight  0.10000E+01 volume  0.71883E-02 ppm1      1.190 ppm2      0.116 CV     1
 ASSI {  872}
   (( segid "    " and resid 80   and name HG  ))
   (( segid "    " and resid 80   and name HB3 ))
      2.900     1.300     1.300 peak   872 spectrum    1 weight  0.10000E+01 volume  0.25182E-02 ppm1      1.418 ppm2      0.116 CV     1
 ASSI {  873}
   (( segid "    " and resid 80   and name HG  ))
   (( segid "    " and resid 80   and name HD2%)))
      6.000     4.700     0.000 peak   873 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.413 ppm2      0.560 CV     1
 ASSI {  874}
   (( segid "    " and resid 80   and name HG  ))
   (( segid "    " and resid 80   and name HD1%)))
      6.000     4.700     0.000 peak   874 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.415 ppm2      0.639 CV     1
 ASSI {  875}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HG  ))
      2.800     1.100     1.100 peak   875 spectrum    1 weight  0.10000E+01 volume  0.35941E-02 ppm1      3.810 ppm2      1.411 CV     1
 ASSI {  876}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
      6.000     4.700     0.000 peak   876 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.815 ppm2      1.194 CV     1
 ASSI {  877}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HD1%)))
      6.000     4.700     0.000 peak   877 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.806 ppm2      0.641 CV     1
 ASSI {  878}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HD2%)))
      6.000     4.700     0.000 peak   878 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.808 ppm2      0.559 CV     1
 ASSI {  879}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB3 ))
      6.000     4.700     0.000 peak   879 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.812 ppm2      0.116 CV     1
 ASSI {  880}
   (( segid "    " and resid 80   and name HD2%)))
   (( segid "    " and resid 81   and name HN  ))
      3.300     1.600     1.600 peak   880 spectrum    1 weight  0.10000E+01 volume  0.11927E-02 ppm1      0.556 ppm2      8.112 CV     1
 ASSI {  881}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 81   and name HN  ))
      3.600     1.900     1.900 peak   881 spectrum    1 weight  0.10000E+01 volume  0.66388E-03 ppm1      0.638 ppm2      8.112 CV     1
 ASSI {  882}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 81   and name HN  ))
      3.200     1.400     1.400 peak   882 spectrum    1 weight  0.10000E+01 volume  0.15567E-02 ppm1      1.193 ppm2      8.112 CV     1
 ASSI {  883}
   (( segid "    " and resid 80   and name HG  ))
   (( segid "    " and resid 81   and name HN  ))
      6.000     4.700     0.000 peak   883 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.409 ppm2      8.112 CV     1
 ASSI {  884}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 81   and name HN  ))
      6.000     4.700     0.000 peak   884 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.812 ppm2      8.114 CV     1
 ASSI {  885}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      2.800     1.200     1.200 peak   885 spectrum    1 weight  0.10000E+01 volume  0.32278E-02 ppm1      7.696 ppm2      8.111 CV     1
 ASSI {  886}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HB2 ))
      2.500     1.000     1.000 peak   886 spectrum    1 weight  0.10000E+01 volume  0.58376E-02 ppm1      4.653 ppm2      2.932 CV     1
 ASSI {  887}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 82   and name HN  ))
      3.900     2.100     2.100 peak   887 spectrum    1 weight  0.10000E+01 volume  0.46014E-03 ppm1      2.929 ppm2      7.808 CV     1
 ASSI {  888}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 82   and name HN  ))
      3.400     1.700     1.700 peak   888 spectrum    1 weight  0.10000E+01 volume  0.98441E-03 ppm1      4.647 ppm2      7.809 CV     1
 ASSI {  889}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      2.400     0.900     0.900 peak   889 spectrum    1 weight  0.10000E+01 volume  0.72569E-02 ppm1      7.812 ppm2      8.111 CV     1
 ASSI {  890}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 82   and name HN  ))
      2.300     0.900     0.900 peak   890 spectrum    1 weight  0.10000E+01 volume  0.94089E-02 ppm1      3.610 ppm2      7.810 CV     1
 ASSI {  891}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 82   and name HN  ))
      6.000     4.700     0.000 peak   891 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.864 ppm2      7.808 CV     1
 ASSI {  892}
   (( segid "    " and resid 77   and name HE% ))
   (( segid "    " and resid 77   and name HD% ))
      2.100     0.700     0.700 peak   892 spectrum    1 weight  0.10000E+01 volume  0.20626E-01 ppm1      6.200 ppm2      6.466 CV     1
 ASSI {  893}
   (( segid "    " and resid 77   and name HB3 ))
   (( segid "    " and resid 77   and name HD% ))
      2.700     1.100     1.100 peak   893 spectrum    1 weight  0.10000E+01 volume  0.43038E-02 ppm1      2.708 ppm2      6.465 CV     1
 ASSI {  894}
   (( segid "    " and resid 77   and name HB3 ))
   (( segid "    " and resid 77   and name HE% ))
      4.800     3.100     1.200 peak   894 spectrum    1 weight  0.10000E+01 volume  0.12270E-03 ppm1      2.706 ppm2      6.196 CV     1
 ASSI {  895}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 77   and name HE% ))
      3.800     2.000     2.000 peak   895 spectrum    1 weight  0.10000E+01 volume  0.52653E-03 ppm1      2.841 ppm2      6.196 CV     1
 ASSI {  896}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 77   and name HD% ))
      2.600     1.000     1.000 peak   896 spectrum    1 weight  0.10000E+01 volume  0.51966E-02 ppm1      2.840 ppm2      6.465 CV     1
 ASSI {  897}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HE% ))
      3.700     2.000     2.000 peak   897 spectrum    1 weight  0.10000E+01 volume  0.56544E-03 ppm1      3.982 ppm2      6.197 CV     1
 ASSI {  898}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HD% ))
      2.700     1.100     1.100 peak   898 spectrum    1 weight  0.10000E+01 volume  0.41435E-02 ppm1      3.983 ppm2      6.464 CV     1
 ASSI {  899}
   (( segid "    " and resid 77   and name HD% ))
   (( segid "    " and resid 77   and name HN  ))
      6.000     4.700     0.000 peak   899 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.467 ppm2      8.960 CV     1
 ASSI {  900}
   (( segid "    " and resid 65   and name HE% ))
   (( segid "    " and resid 65   and name HN  ))
      6.000     4.700     0.000 peak   900 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.433 ppm2      8.931 CV     1
 ASSI {  901}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 65   and name HD% ))
      2.600     1.000     1.000 peak   901 spectrum    1 weight  0.10000E+01 volume  0.55400E-02 ppm1      2.275 ppm2      6.487 CV     1
 ASSI {  902}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 65   and name HE% ))
      6.000     4.700     0.000 peak   902 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.274 ppm2      6.435 CV     1
 ASSI {  903}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HD% ))
      2.600     1.000     1.000 peak   903 spectrum    1 weight  0.10000E+01 volume  0.53111E-02 ppm1      2.427 ppm2      6.489 CV     1
 ASSI {  904}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HE% ))
      6.000     4.700     0.000 peak   904 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.428 ppm2      6.434 CV     1
 ASSI {  905}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HD% ))
      2.700     1.100     1.100 peak   905 spectrum    1 weight  0.10000E+01 volume  0.44411E-02 ppm1      4.942 ppm2      6.490 CV     1
 ASSI {  906}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HE% ))
      3.400     1.700     1.700 peak   906 spectrum    1 weight  0.10000E+01 volume  0.94546E-03 ppm1      4.942 ppm2      6.428 CV     1
 ASSI {  908}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 41   and name HN  ))
      3.000     1.300     1.300 peak   908 spectrum    1 weight  0.10000E+01 volume  0.20786E-02 ppm1      3.523 ppm2      9.561 CV     1
 ASSI {  909}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 41   and name HN  ))
      6.000     4.700     0.000 peak   909 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.578 ppm2      9.561 CV     1
 ASSI {  910}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      6.000     4.700     0.000 peak   910 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.566 ppm2      9.561 CV     1
 ASSI {  911}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      4.800     3.100     1.200 peak   911 spectrum    1 weight  0.10000E+01 volume  0.12683E-03 ppm1      8.578 ppm2      9.561 CV     1
 ASSI {  912}
   (( segid "    " and resid 654  and name HG2 ))
   (( segid "    " and resid 654  and name HE21))))
      3.200     1.500     1.500 peak   912 spectrum    1 weight  0.10000E+01 volume  0.15086E-02 ppm1      2.196 ppm2      7.419 CV     1
 OR {  912}
   (( segid "    " and resid 654  and name HG3 ))
   (( segid "    " and resid 654  and name HE21))))
 ASSI {  913}
   (( segid "    " and resid 654  and name HG2 ))
   (( segid "    " and resid 654  and name HE22))))
      3.700     1.900     1.900 peak   913 spectrum    1 weight  0.10000E+01 volume  0.63641E-03 ppm1      2.197 ppm2      6.830 CV     1
 OR {  913}
   (( segid "    " and resid 654  and name HG3 ))
   (( segid "    " and resid 654  and name HE22))))
 ASSI {  914}
   (( segid "    " and resid 654  and name HE22))))
   (( segid "    " and resid 654  and name HE21))))
      1.900     0.700     0.700 peak   914 spectrum    1 weight  0.10000E+01 volume  0.28387E-01 ppm1      6.828 ppm2      7.418 CV     1
 ASSI {  917}
   (( segid "    " and resid 680  and name HE22))))
   (( segid "    " and resid 680  and name HE21))))
      1.700     0.600     0.600 peak   917 spectrum    1 weight  0.10000E+01 volume  0.62039E-01 ppm1      6.858 ppm2      7.533 CV     1
 ASSI {  918}
   (( segid "    " and resid 75   and name HD21))))
   (( segid "    " and resid 75   and name HD22))))
      2.000     0.700     0.700 peak   918 spectrum    1 weight  0.10000E+01 volume  0.24495E-01 ppm1      7.007 ppm2      7.717 CV     1
 ASSI {  919}
   (( segid "    " and resid 57   and name HD2%)))
   (( segid "    " and resid 51   and name HN  ))
      3.500     1.700     1.700 peak   919 spectrum    1 weight  0.10000E+01 volume  0.84473E-03 ppm1      0.419 ppm2     10.074 CV     1
 ASSI {  920}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      3.400     1.700     1.700 peak   920 spectrum    1 weight  0.10000E+01 volume  0.99354E-03 ppm1      6.141 ppm2     10.076 CV     1
 ASSI {  921}
   (( segid "    " and resid 48   and name HD2%)))
   (( segid "    " and resid 43   and name HE1 ))
      4.000     2.200     2.000 peak   921 spectrum    1 weight  0.10000E+01 volume  0.35941E-03 ppm1     -0.815 ppm2      9.557 CV     1
 ASSI {  922}
   (( segid "    " and resid 24   and name HB% ))
   (( segid "    " and resid 41   and name HN  ))
      4.200     2.400     1.800 peak   922 spectrum    1 weight  0.10000E+01 volume  0.27471E-03 ppm1      0.219 ppm2      9.560 CV     1
 ASSI {  923}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      3.200     1.500     1.500 peak   923 spectrum    1 weight  0.10000E+01 volume  0.14194E-02 ppm1      8.893 ppm2      9.562 CV     1
 ASSI {  924}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HE3 ))
      2.600     1.000     1.000 peak   924 spectrum    1 weight  0.10000E+01 volume  0.55171E-02 ppm1      3.460 ppm2      7.139 CV     1
 ASSI {  925}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HE3 ))
      3.100     1.400     1.400 peak   925 spectrum    1 weight  0.10000E+01 volume  0.16780E-02 ppm1      5.705 ppm2      7.139 CV     1
 ASSI {  926}
   (( segid "    " and resid 43   and name HE3 ))
   (( segid "    " and resid 43   and name HN  ))
      6.000     4.700     0.000 peak   926 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.142 ppm2      9.123 CV     1
 ASSI {  927}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 48   and name HD2%)))
      3.000     1.300     1.300 peak   927 spectrum    1 weight  0.10000E+01 volume  0.22503E-02 ppm1      1.155 ppm2     -0.815 CV     1
 ASSI {  928}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 81   and name HN  ))
      3.300     1.500     1.500 peak   928 spectrum    1 weight  0.10000E+01 volume  0.13140E-02 ppm1      0.096 ppm2      8.112 CV     1
 ASSI {  929}
   (( segid "    " and resid 24   and name HB% ))
   (( segid "    " and resid 42   and name HN  ))
      3.400     1.600     1.600 peak   929 spectrum    1 weight  0.10000E+01 volume  0.10485E-02 ppm1      0.220 ppm2      8.572 CV     1
 ASSI {  930}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 58   and name HN  ))
      4.000     2.200     2.000 peak   930 spectrum    1 weight  0.10000E+01 volume  0.40520E-03 ppm1      0.119 ppm2      8.606 CV     1
 ASSI {  931}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 41   and name HN  ))
      2.900     1.300     1.300 peak   931 spectrum    1 weight  0.10000E+01 volume  0.24724E-02 ppm1      1.156 ppm2      9.561 CV     1
 ASSI {  932}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HD2 ))
      2.800     1.200     1.200 peak   932 spectrum    1 weight  0.10000E+01 volume  0.33881E-02 ppm1      3.570 ppm2      7.871 CV     1
 ASSI {  933}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HD2 ))
      6.000     4.700     0.000 peak   933 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.965 ppm2      7.872 CV     1
 ASSI {  934}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HD2 ))
      2.900     1.300     1.300 peak   934 spectrum    1 weight  0.10000E+01 volume  0.24953E-02 ppm1      5.043 ppm2      7.871 CV     1
 ASSI {  935}
   (( segid "    " and resid 81   and name HD% ))
   (( segid "    " and resid 81   and name HZ  ))
      6.000     4.700     0.000 peak   935 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.857 ppm2      7.033 CV     1
 ASSI {  937}
   (( segid "    " and resid 54   and name HG3 ))
   (( segid "    " and resid 54   and name HE21))))
      6.000     4.700     0.000 peak   937 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.211 ppm2      7.227 CV     1
 ASSI {  938}
   (( segid "    " and resid 648  and name HA  ))
   (( segid "    " and resid 648  and name HG2%)))
      6.000     4.700     0.000 peak   938 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.141 ppm2      0.845 CV     1
 ASSI {  939}
   (( segid "    " and resid 648  and name HB  ))
   (( segid "    " and resid 648  and name HG2%)))
      2.600     1.100     1.100 peak   939 spectrum    1 weight  0.10000E+01 volume  0.45099E-02 ppm1      2.072 ppm2      0.846 CV     1
 ASSI {  940}
   (( segid "    " and resid 648  and name HG2%)))
   (( segid "    " and resid 648  and name HN  ))
      6.000     4.700     0.000 peak   940 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.844 ppm2      8.058 CV     1
 ASSI {  942}
   (( segid "    " and resid 652  and name HB3 ))
   (( segid "    " and resid 652  and name HD22))))
      3.000     1.300     1.300 peak   942 spectrum    1 weight  0.10000E+01 volume  0.20878E-02 ppm1      2.680 ppm2      7.584 CV     1
 ASSI {  943}
   (( segid "    " and resid 652  and name HB2 ))
   (( segid "    " and resid 652  and name HD22))))
      6.000     4.700     0.000 peak   943 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.796 ppm2      7.584 CV     1
 ASSI {  944}
   (( segid "    " and resid 652  and name HB2 ))
   (( segid "    " and resid 652  and name HD21))))
      3.500     1.700     1.700 peak   944 spectrum    1 weight  0.10000E+01 volume  0.87219E-03 ppm1      2.788 ppm2      6.924 CV     1
 ASSI {  945}
   (( segid "    " and resid 652  and name HD21))))
   (( segid "    " and resid 652  and name HD22))))
      1.800     0.600     0.600 peak   945 spectrum    1 weight  0.10000E+01 volume  0.47388E-01 ppm1      6.932 ppm2      7.584 CV     1
 ASSI {  946}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HD22))))
      2.900     1.300     1.300 peak   946 spectrum    1 weight  0.10000E+01 volume  0.24037E-02 ppm1      2.914 ppm2      7.717 CV     1
 ASSI {  947}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HD21))))
      3.400     1.600     1.600 peak   947 spectrum    1 weight  0.10000E+01 volume  0.10508E-02 ppm1      2.913 ppm2      7.004 CV     1
 ASSI {  948}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 75   and name HD21))))
      3.500     1.800     1.800 peak   948 spectrum    1 weight  0.10000E+01 volume  0.79208E-03 ppm1      2.704 ppm2      7.004 CV     1
 ASSI {  949}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 75   and name HD22))))
      3.200     1.500     1.500 peak   949 spectrum    1 weight  0.10000E+01 volume  0.15544E-02 ppm1      2.704 ppm2      7.717 CV     1
 ASSI {  950}
   (( segid "    " and resid 75   and name HD21))))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.700     0.000 peak   950 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.011 ppm2      8.520 CV     1
 ASSI {  951}
   (( segid "    " and resid 75   and name HD22))))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.700     0.000 peak   951 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.715 ppm2      8.518 CV     1
 ASSI {  952}
   (( segid "    " and resid 34   and name HD% ))
   (( segid "    " and resid 35   and name HN  ))
      3.100     1.400     1.400 peak   952 spectrum    1 weight  0.10000E+01 volume  0.15933E-02 ppm1      7.283 ppm2      9.099 CV     1
 ASSI {  953}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 673  and name HN  ))
      3.300     1.500     1.500 peak   953 spectrum    1 weight  0.10000E+01 volume  0.12797E-02 ppm1      9.096 ppm2      9.508 CV     1
 ASSI {  954}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 673  and name HN  ))
      3.300     1.500     1.500 peak   954 spectrum    1 weight  0.10000E+01 volume  0.12477E-02 ppm1      5.610 ppm2      9.508 CV     1
 ASSI {  955}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 673  and name HN  ))
      4.000     2.200     2.000 peak   955 spectrum    1 weight  0.10000E+01 volume  0.38002E-03 ppm1      5.820 ppm2      9.509 CV     1
 ASSI {  956}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      6.000     4.700     0.000 peak   956 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.450 ppm2     10.080 CV     1
 ASSI {  957}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      3.400     1.600     1.600 peak   957 spectrum    1 weight  0.10000E+01 volume  0.10371E-02 ppm1      8.787 ppm2      9.125 CV     1
 ASSI {  958}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      2.900     1.300     1.300 peak   958 spectrum    1 weight  0.10000E+01 volume  0.24724E-02 ppm1      7.996 ppm2      8.794 CV     1
 ASSI {  959}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      3.300     1.600     1.600 peak   959 spectrum    1 weight  0.10000E+01 volume  0.11767E-02 ppm1      5.687 ppm2      9.558 CV     1
 ASSI {  960}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 675  and name HN  ))
      3.200     1.500     1.500 peak   960 spectrum    1 weight  0.10000E+01 volume  0.13804E-02 ppm1      5.824 ppm2      8.677 CV     1
 ASSI {  961}
   (( segid "    " and resid 34   and name HE% ))
   (( segid "    " and resid 675  and name HN  ))
      3.100     1.400     1.400 peak   961 spectrum    1 weight  0.10000E+01 volume  0.16116E-02 ppm1      7.341 ppm2      8.678 CV     1
 ASSI {  962}
   (( segid "    " and resid 34   and name HD% ))
   (( segid "    " and resid 675  and name HN  ))
      3.300     1.600     1.600 peak   962 spectrum    1 weight  0.10000E+01 volume  0.11538E-02 ppm1      7.285 ppm2      8.676 CV     1
 ASSI {  963}
   (( segid "    " and resid 665  and name HA  ))
   (( segid "    " and resid 665  and name HG2 ))
      2.900     1.200     1.200 peak   963 spectrum    1 weight  0.10000E+01 volume  0.28387E-02 ppm1      4.053 ppm2      1.844 CV     1
 ASSI {  964}
   (( segid "    " and resid 665  and name HG2 ))
   (( segid "    " and resid 665  and name HE22))))
      3.000     1.300     1.300 peak   964 spectrum    1 weight  0.10000E+01 volume  0.23350E-02 ppm1      1.843 ppm2      6.827 CV     1
 ASSI {  965}
   (( segid "    " and resid 665  and name HG2 ))
   (( segid "    " and resid 665  and name HE21))))
      3.100     1.400     1.400 peak   965 spectrum    1 weight  0.10000E+01 volume  0.16116E-02 ppm1      1.843 ppm2      7.389 CV     1
 ASSI {  966}
   (( segid "    " and resid 665  and name HE22))))
   (( segid "    " and resid 665  and name HE21))))
      1.900     0.700     0.700 peak   966 spectrum    1 weight  0.10000E+01 volume  0.29074E-01 ppm1      6.833 ppm2      7.389 CV     1
 ASSI {  967}
   (( segid "    " and resid 665  and name HG2 ))
   (( segid "    " and resid 665  and name HB3 ))
      6.000     4.700     0.000 peak   967 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.846 ppm2      1.625 CV     1
 ASSI {  968}
   (( segid "    " and resid 665  and name HB2 ))
   (( segid "    " and resid 665  and name HB3 ))
      6.000     4.700     0.000 peak   968 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.765 ppm2      1.625 CV     1
 ASSI {  969}
   (( segid "    " and resid 682  and name HA  ))
   (( segid "    " and resid 682  and name HB3 ))
      2.600     1.100     1.100 peak   969 spectrum    1 weight  0.10000E+01 volume  0.46930E-02 ppm1      4.368 ppm2      1.724 CV     1
 ASSI {  970}
   (( segid "    " and resid 682  and name HB2 ))
   (( segid "    " and resid 683  and name HN  ))
      6.000     4.700     0.000 peak   970 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.829 ppm2      8.194 CV     1
 ASSI {  971}
   (( segid "    " and resid 655  and name HZ3 ))
   (( segid "    " and resid 655  and name HE3 ))
      2.200     0.800     0.800 peak   971 spectrum    1 weight  0.10000E+01 volume  0.15658E-01 ppm1      7.095 ppm2      7.577 CV     1
 ASSI {  972}
   (( segid "    " and resid 655  and name HH2 ))
   (( segid "    " and resid 655  and name HE3 ))
      6.000     4.700     0.000 peak   972 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.177 ppm2      7.577 CV     1
 ASSI {  973}
   (( segid "    " and resid 655  and name HZ3 ))
   (( segid "    " and resid 655  and name HH2 ))
      6.000     4.700     0.000 peak   973 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.095 ppm2      7.169 CV     1
 ASSI {  974}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 44   and name HN  ))
      3.300     1.600     1.600 peak   974 spectrum    1 weight  0.10000E+01 volume  0.11102E-02 ppm1      0.421 ppm2      9.262 CV     1
 ASSI {  975}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 43   and name HN  ))
      3.300     1.600     1.600 peak   975 spectrum    1 weight  0.10000E+01 volume  0.11378E-02 ppm1      0.420 ppm2      9.128 CV     1
 ASSI {  976}
   (( segid "    " and resid 48   and name HD2%)))
   (( segid "    " and resid 43   and name HE3 ))
      3.200     1.500     1.500 peak   976 spectrum    1 weight  0.10000E+01 volume  0.15361E-02 ppm1     -0.816 ppm2      7.140 CV     1
 ASSI {  977}
   (( segid "    " and resid 24   and name HB% ))
   (( segid "    " and resid 43   and name HE3 ))
      3.600     1.800     1.800 peak   977 spectrum    1 weight  0.10000E+01 volume  0.73027E-03 ppm1      0.218 ppm2      7.140 CV     1
 ASSI {  978}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 43   and name HE3 ))
      3.500     1.700     1.700 peak   978 spectrum    1 weight  0.10000E+01 volume  0.89965E-03 ppm1      0.438 ppm2      7.141 CV     1
 ASSI {  979}
   (( segid "    " and resid 24   and name HB% ))
   (( segid "    " and resid 43   and name HZ2 ))
      2.700     1.100     1.100 peak   979 spectrum    1 weight  0.10000E+01 volume  0.40977E-02 ppm1      0.218 ppm2      7.059 CV     1
 ASSI {  980}
   (( segid "    " and resid 24   and name HB% ))
   (( segid "    " and resid 43   and name HZ3 ))
      3.400     1.600     1.600 peak   980 spectrum    1 weight  0.10000E+01 volume  0.10714E-02 ppm1      0.218 ppm2      6.940 CV     1
 ASSI {  981}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 43   and name HE3 ))
      2.900     1.200     1.200 peak   981 spectrum    1 weight  0.10000E+01 volume  0.26555E-02 ppm1      3.918 ppm2      7.140 CV     1
 ASSI {  982}
   (( segid "    " and resid 48   and name HD2%)))
   (( segid "    " and resid 43   and name HZ3 ))
      6.000     4.700     0.000 peak   982 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     -0.815 ppm2      6.940 CV     1
 ASSI {  983}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HG  ))
      3.000     1.300     1.300 peak   983 spectrum    1 weight  0.10000E+01 volume  0.21564E-02 ppm1      3.919 ppm2      0.585 CV     1
 ASSI {  984}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.700     0.000 peak   984 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.585 ppm2      7.035 CV     1
 ASSI {  985}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 48   and name HD1%)))
      6.000     4.700     0.000 peak   985 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.439 ppm2      0.115 CV     1
 ASSI {  986}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 48   and name HD2%)))
      2.200     0.800     0.800 peak   986 spectrum    1 weight  0.10000E+01 volume  0.14514E-01 ppm1      0.588 ppm2     -0.815 CV     1
 ASSI {  987}
   (( segid "    " and resid 48   and name HD2%)))
   (( segid "    " and resid 43   and name HD1 ))
      6.000     4.700     0.000 peak   987 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     -0.815 ppm2      6.956 CV     1
 ASSI {  988}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 48   and name HB2 ))
      3.100     1.400     1.400 peak   988 spectrum    1 weight  0.10000E+01 volume  0.18222E-02 ppm1      3.464 ppm2      1.581 CV     1
 ASSI {  990}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 74   and name HG2 ))
      6.000     4.700     0.000 peak   990 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.803 ppm2      1.581 CV     1
 ASSI {  993}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 55   and name HB% ))
      4.200     2.400     1.800 peak   993 spectrum    1 weight  0.10000E+01 volume  0.27929E-03 ppm1      3.566 ppm2      1.420 CV     1
 ASSI {  994}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HD2%)))
      2.100     0.800     0.800 peak   994 spectrum    1 weight  0.10000E+01 volume  0.16987E-01 ppm1      1.422 ppm2      0.421 CV     1
 ASSI {  995}
   (( segid "    " and resid 665  and name HG3 ))
   (( segid "    " and resid 665  and name HE21))))
      3.200     1.500     1.500 peak   995 spectrum    1 weight  0.10000E+01 volume  0.14010E-02 ppm1      1.761 ppm2      7.390 CV     1
 ASSI {  996}
   (( segid "    " and resid 665  and name HB3 ))
   (( segid "    " and resid 665  and name HE21))))
      6.000     4.700     0.000 peak   996 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.625 ppm2      7.390 CV     1
 ASSI {  997}
   (( segid "    " and resid 661  and name HN  ))
   (( segid "    " and resid 662  and name HN  ))
      3.700     1.900     1.900 peak   997 spectrum    1 weight  0.10000E+01 volume  0.59978E-03 ppm1      7.926 ppm2      8.396 CV     1
 ASSI { 1000}
   (( segid "    " and resid 33   and name HD3 ))
   (( segid "    " and resid 33   and name HE  ))
      3.100     1.400     1.400 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.16688E-02 ppm1      2.701 ppm2      8.058 CV     1
 ASSI { 1005}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 54   and name HN  ))
      3.200     1.500     1.500 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.14376E-02 ppm1      3.411 ppm2      7.964 CV     1
 ASSI { 1006}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 655  and name HN  ))
      6.000     4.700     0.000 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.021 ppm2      8.049 CV     1
 ASSI { 1007}
   (( segid "    " and resid 654  and name HG3 ))
   (( segid "    " and resid 655  and name HN  ))
      3.800     2.000     2.000 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.54255E-03 ppm1      2.197 ppm2      8.048 CV     1
 OR { 1007}
   (( segid "    " and resid 654  and name HG2 ))
   (( segid "    " and resid 655  and name HN  ))
 ASSI { 1011}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 42   and name HD% ))
      3.600     1.800     1.800 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.67761E-03 ppm1      0.417 ppm2      7.229 CV     1
 ASSI { 1012}
   (( segid "    " and resid 653  and name HB  ))
   (( segid "    " and resid 655  and name HE1 ))
      6.000     4.700     0.000 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.720 ppm2     10.106 CV     1
 ASSI { 1013}
   (( segid "    " and resid 653  and name HD1%)))
   (( segid "    " and resid 655  and name HE1 ))
      6.000     4.700     0.000 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.786 ppm2     10.107 CV     1
 ASSI { 1014}
   (( segid "    " and resid 653  and name HG2%)))
   (( segid "    " and resid 655  and name HE1 ))
      4.800     3.100     1.200 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.12041E-03 ppm1      0.629 ppm2     10.107 CV     1
 ASSI { 1015}
   (( segid "    " and resid 656  and name HA  ))
   (( segid "    " and resid 655  and name HE3 ))
      4.100     2.300     1.900 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.31592E-03 ppm1      4.398 ppm2      7.577 CV     1
 ASSI { 1017}
   (( segid "    " and resid 655  and name HE3 ))
   (( segid "    " and resid 656  and name HN  ))
      4.100     2.300     1.900 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.32965E-03 ppm1      7.575 ppm2      8.141 CV     1
 ASSI { 1018}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 40   and name HN  ))
      4.200     2.400     1.800 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.28158E-03 ppm1      2.113 ppm2      8.567 CV     1
 ASSI { 1019}
   (( segid "    " and resid 658  and name HB2 ))
   (( segid "    " and resid 661  and name HN  ))
      3.600     1.800     1.800 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.69822E-03 ppm1      2.770 ppm2      7.926 CV     1
 ASSI { 1020}
   (( segid "    " and resid 677  and name HN  ))
   (( segid "    " and resid 676  and name HN  ))
      2.900     1.300     1.300 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.24037E-02 ppm1      7.618 ppm2      8.344 CV     1
 ASSI { 1021}
   (( segid "    " and resid 667  and name HN  ))
   (( segid "    " and resid 666  and name HN  ))
      2.600     1.100     1.100 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.46472E-02 ppm1      7.192 ppm2      7.789 CV     1
 ASSI { 1023}
   (( segid "    " and resid 77   and name HE% ))
   (( segid "    " and resid 666  and name HD% ))
      3.400     1.600     1.600 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.10416E-02 ppm1      6.202 ppm2      7.255 CV     1
 ASSI { 1025}
   (( segid "    " and resid 665  and name HB2 ))
   (( segid "    " and resid 666  and name HD% ))
      3.300     1.600     1.600 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.11653E-02 ppm1      1.766 ppm2      7.255 CV     1
 OR { 1025}
   (( segid "    " and resid 665  and name HG3 ))
   (( segid "    " and resid 666  and name HD% ))
 ASSI { 1027}
   (( segid "    " and resid 663  and name HD2%)))
   (( segid "    " and resid 666  and name HD% ))
      3.200     1.400     1.400 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.15773E-02 ppm1      0.703 ppm2      7.254 CV     1
 ASSI { 1028}
   (( segid "    " and resid 663  and name HD1%)))
   (( segid "    " and resid 666  and name HD% ))
      6.000     4.700     0.000 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.643 ppm2      7.254 CV     1
 ASSI { 1030}
   (( segid "    " and resid 65   and name HD% ))
   (( segid "    " and resid 667  and name HN  ))
      3.800     2.000     2.000 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.50821E-03 ppm1      6.486 ppm2      7.190 CV     1
 ASSI { 1031}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 20   and name HD1 ))
      4.100     2.300     1.900 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.33652E-03 ppm1      3.716 ppm2      7.194 CV     1
 OR { 1031}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 20   and name HD1 ))
 ASSI { 1033}
   (( segid "    " and resid 65   and name HD% ))
   (( segid "    " and resid 668  and name HN  ))
      3.300     1.600     1.600 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.11812E-02 ppm1      6.490 ppm2      8.644 CV     1
 ASSI { 1034}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 668  and name HN  ))
      2.700     1.100     1.100 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.43953E-02 ppm1      4.943 ppm2      8.646 CV     1
 ASSI { 1036}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      4.400     2.700     1.600 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.20054E-03 ppm1      7.818 ppm2      8.965 CV     1
 ASSI { 1037}
   (( segid "    " and resid 671  and name HG2%)))
   (( segid "    " and resid 672  and name HN  ))
      2.700     1.100     1.100 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.41664E-02 ppm1      1.269 ppm2      8.965 CV     1
 ASSI { 1039}
   (( segid "    " and resid 673  and name HG2%)))
   (( segid "    " and resid 674  and name HN  ))
      2.600     1.100     1.100 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.49219E-02 ppm1      0.767 ppm2      8.681 CV     1
 ASSI { 1042}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      3.500     1.700     1.700 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.90887E-03 ppm1      4.127 ppm2      8.193 CV     1
 ASSI { 1043}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      4.200     2.400     1.800 peak  1043 spectrum    1 weight  0.10000E+01 volume  0.29532E-03 ppm1      1.505 ppm2      7.639 CV     1
 OR { 1043}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI { 1044}
   (( segid "    " and resid 20   and name HE3 ))
   (( segid "    " and resid 21   and name HN  ))
      3.800     2.000     2.000 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.53340E-03 ppm1      7.381 ppm2      8.750 CV     1
 ASSI { 1045}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 24   and name HN  ))
      6.000     4.700     0.000 peak  1045 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.420 ppm2      8.817 CV     1
 ASSI { 1046}
   (( segid "    " and resid 43   and name HZ3 ))
   (( segid "    " and resid 25   and name HN  ))
      3.000     1.300     1.300 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.20123E-02 ppm1      6.943 ppm2      9.059 CV     1
 ASSI { 1047}
   (( segid "    " and resid 43   and name HE3 ))
   (( segid "    " and resid 25   and name HN  ))
      3.200     1.500     1.500 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.14789E-02 ppm1      7.141 ppm2      9.059 CV     1
 ASSI { 1048}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      3.700     1.900     1.900 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.65472E-03 ppm1      8.096 ppm2      9.059 CV     1
 ASSI { 1049}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 27   and name HN  ))
      4.200     2.400     1.800 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.29532E-03 ppm1      2.266 ppm2      8.094 CV     1
 ASSI { 1050}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      4.300     2.500     1.700 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.25411E-03 ppm1      5.098 ppm2      9.138 CV     1
 ASSI { 1056}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      4.300     2.500     1.700 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.24037E-03 ppm1      7.970 ppm2      8.666 CV     1
 ASSI { 1057}
   (( segid "    " and resid 57   and name HD2%)))
   (( segid "    " and resid 50   and name HN  ))
      3.000     1.400     1.400 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.19642E-02 ppm1      0.417 ppm2      8.667 CV     1
 ASSI { 1059}
   (( segid "    " and resid 57   and name HD1%)))
   (( segid "    " and resid 50   and name HN  ))
      3.400     1.600     1.600 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.10759E-02 ppm1      0.673 ppm2      8.665 CV     1
 ASSI { 1062}
   (( segid "    " and resid 72   and name HD1%)))
   (( segid "    " and resid 51   and name HN  ))
      3.200     1.400     1.400 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.15635E-02 ppm1      1.101 ppm2     10.074 CV     1
 ASSI { 1063}
   (( segid "    " and resid 71   and name HD1%)))
   (( segid "    " and resid 51   and name HN  ))
      4.500     2.700     1.500 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.19619E-03 ppm1      0.645 ppm2     10.074 CV     1
 ASSI { 1064}
   (( segid "    " and resid 71   and name HG2%)))
   (( segid "    " and resid 51   and name HN  ))
      6.000     4.700     0.000 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.579 ppm2     10.074 CV     1
 ASSI { 1065}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      3.700     1.900     1.900 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.64328E-03 ppm1      3.992 ppm2      6.774 CV     1
 ASSI { 1066}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 32   and name HN  ))
      4.300     2.500     1.700 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.25639E-03 ppm1      1.565 ppm2      6.772 CV     1
 ASSI { 1067}
   (( segid "    " and resid 30   and name HG2%)))
   (( segid "    " and resid 32   and name HN  ))
      2.400     0.900     0.900 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.74171E-02 ppm1      0.897 ppm2      6.775 CV     1
 ASSI { 1068}
   (( segid "    " and resid 35   and name HD2%)))
   (( segid "    " and resid 32   and name HN  ))
      4.000     2.200     2.000 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.40520E-03 ppm1      0.753 ppm2      6.775 CV     1
 ASSI { 1069}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 29   and name HN  ))
      2.800     1.200     1.200 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.31363E-02 ppm1      1.252 ppm2      8.534 CV     1
 ASSI { 1070}
   (( segid "    " and resid 32   and name HB3 ))
   (( segid "    " and resid 34   and name HN  ))
      3.700     1.900     1.900 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.60894E-03 ppm1      2.503 ppm2      8.205 CV     1
 ASSI { 1071}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 34   and name HN  ))
      3.800     2.000     2.000 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.50363E-03 ppm1      0.365 ppm2      8.206 CV     1
 ASSI { 1073}
   (( segid "    " and resid 674  and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      6.000     4.700     0.000 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.772 ppm2      9.096 CV     1
 ASSI { 1077}
   (( segid "    " and resid 671  and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      3.300     1.500     1.500 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.12636E-02 ppm1      8.952 ppm2      9.307 CV     1
 ASSI { 1078}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      3.600     1.900     1.900 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.66388E-03 ppm1      4.552 ppm2      9.307 CV     1
 ASSI { 1079}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      6.000     4.700     0.000 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.452 ppm2      9.307 CV     1
 ASSI { 1080}
   (( segid "    " and resid 671  and name HB  ))
   (( segid "    " and resid 37   and name HN  ))
      3.500     1.800     1.800 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.78064E-03 ppm1      4.253 ppm2      9.307 CV     1
 ASSI { 1081}
   (( segid "    " and resid 670  and name HG1%)))
   (( segid "    " and resid 37   and name HN  ))
      3.300     1.600     1.600 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.11538E-02 ppm1      0.724 ppm2      9.307 CV     1
 ASSI { 1083}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 37   and name HD% ))
      4.100     2.300     1.900 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.33423E-03 ppm1      3.981 ppm2      6.705 CV     1
 ASSI { 1085}
   (( segid "    " and resid 673  and name HG13))))
   (( segid "    " and resid 37   and name HE% ))
      3.100     1.400     1.400 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.17582E-02 ppm1      1.268 ppm2      6.399 CV     1
 ASSI { 1088}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 42   and name HE% ))
      3.700     1.900     1.900 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.59520E-03 ppm1      0.549 ppm2      6.706 CV     1
 ASSI { 1090}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 37   and name HE% ))
      3.400     1.700     1.700 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.97520E-03 ppm1      4.569 ppm2      6.396 CV     1
 ASSI { 1092}
   (( segid "    " and resid 671  and name HB  ))
   (( segid "    " and resid 37   and name HE% ))
      3.000     1.300     1.300 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.20397E-02 ppm1      4.248 ppm2      6.397 CV     1
 ASSI { 1093}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 37   and name HE% ))
      2.700     1.100     1.100 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.39375E-02 ppm1      3.990 ppm2      6.397 CV     1
 ASSI { 1094}
   (( segid "    " and resid 37   and name HE% ))
   (( segid "    " and resid 38   and name HN  ))
      6.000     4.700     0.000 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.403 ppm2      8.897 CV     1
 ASSI { 1095}
   (( segid "    " and resid 43   and name HD1 ))
   (( segid "    " and resid 38   and name HN  ))
      2.700     1.100     1.100 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.40749E-02 ppm1      6.959 ppm2      8.897 CV     1
 ASSI { 1096}
   (( segid "    " and resid 43   and name HZ2 ))
   (( segid "    " and resid 41   and name HN  ))
      6.000     4.700     0.000 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.061 ppm2      9.561 CV     1
 ASSI { 1097}
   (( segid "    " and resid 43   and name HD1 ))
   (( segid "    " and resid 41   and name HN  ))
      6.000     4.700     0.000 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.960 ppm2      9.561 CV     1
 ASSI { 1101}
   (( segid "    " and resid 37   and name HE% ))
   (( segid "    " and resid 42   and name HD% ))
      2.700     1.100     1.100 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.40749E-02 ppm1      6.402 ppm2      7.229 CV     1
 ASSI { 1104}
   (( segid "    " and resid 35   and name HD2%)))
   (( segid "    " and resid 42   and name HD% ))
      6.000     4.700     0.000 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.764 ppm2      7.232 CV     1
 ASSI { 1107}
   (( segid "    " and resid 671  and name HB  ))
   (( segid "    " and resid 37   and name HD% ))
      4.000     2.200     2.000 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.38231E-03 ppm1      4.253 ppm2      6.703 CV     1
 ASSI { 1108}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 54   and name HE22))))
      6.000     4.700     0.000 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.061 ppm2      6.705 CV     1
 OR { 1108}
   (( segid "    " and resid 49   and name HE3 ))
   (( segid "    " and resid 54   and name HE22))))
 ASSI { 1110}
   (( segid "    " and resid 21   and name HE2 ))
   (( segid "    " and resid 42   and name HE% ))
      3.200     1.500     1.500 peak  1110 spectrum    1 weight  0.10000E+01 volume  0.14399E-02 ppm1      2.461 ppm2      6.705 CV     1
 OR { 1110}
   (( segid "    " and resid 21   and name HE3 ))
   (( segid "    " and resid 42   and name HE% ))
 ASSI { 1111}
   (( segid "    " and resid 673  and name HG12))))
   (( segid "    " and resid 37   and name HD% ))
      3.300     1.600     1.600 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.11080E-02 ppm1      1.485 ppm2      6.705 CV     1
 ASSI { 1112}
   (( segid "    " and resid 37   and name HE% ))
   (( segid "    " and resid 43   and name HN  ))
      4.400     2.600     1.600 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.21519E-03 ppm1      6.399 ppm2      9.127 CV     1
 ASSI { 1113}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 43   and name HN  ))
      3.400     1.700     1.700 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.98898E-03 ppm1      2.611 ppm2      9.127 CV     1
 ASSI { 1114}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      3.400     1.600     1.600 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.10279E-02 ppm1      8.187 ppm2      9.134 CV     1
 ASSI { 1115}
   (( segid "    " and resid 43   and name HE3 ))
   (( segid "    " and resid 44   and name HN  ))
      3.700     1.900     1.900 peak  1115 spectrum    1 weight  0.10000E+01 volume  0.57231E-03 ppm1      7.138 ppm2      9.263 CV     1
 ASSI { 1116}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 44   and name HN  ))
      6.000     4.700     0.000 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.860 ppm2      9.263 CV     1
 ASSI { 1118}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 44   and name HN  ))
      3.200     1.500     1.500 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.13873E-02 ppm1      3.302 ppm2      9.263 CV     1
 ASSI { 1119}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 44   and name HN  ))
      6.000     4.700     0.000 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.613 ppm2      9.263 CV     1
 ASSI { 1120}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 44   and name HN  ))
      4.200     2.400     1.800 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.28387E-03 ppm1      2.262 ppm2      9.263 CV     1
 ASSI { 1121}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 45   and name HN  ))
      3.600     1.800     1.800 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.77606E-03 ppm1      7.871 ppm2     10.031 CV     1
 ASSI { 1122}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
      3.900     2.100     2.100 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.44182E-03 ppm1      1.880 ppm2     10.031 CV     1
 OR { 1122}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 45   and name HN  ))
 OR { 1122}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI { 1124}
   (( segid "    " and resid 46   and name HG3 ))
   (( segid "    " and resid 46   and name HN  ))
      2.800     1.200     1.200 peak  1124 spectrum    1 weight  0.10000E+01 volume  0.29761E-02 ppm1      1.629 ppm2      7.984 CV     1
 ASSI { 1127}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.700     0.000 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.114 ppm2      7.033 CV     1
 ASSI { 1128}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 81   and name HZ  ))
      6.000     4.700     0.000 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.842 ppm2      7.033 CV     1
 ASSI { 1129}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 81   and name HZ  ))
      3.400     1.700     1.700 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.94774E-03 ppm1      4.261 ppm2      7.033 CV     1
 ASSI { 1130}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      6.000     4.700     0.000 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.308 ppm2      8.922 CV     1
 ASSI { 1131}
   (( segid "    " and resid 666  and name HB3 ))
   (( segid "    " and resid 66   and name HN  ))
      2.000     0.700     0.700 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.23808E-01 ppm1      2.535 ppm2      8.922 CV     1
 ASSI { 1132}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      2.700     1.100     1.100 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.37544E-02 ppm1      8.195 ppm2      8.920 CV     1
 ASSI { 1133}
   (( segid "    " and resid 43   and name HE3 ))
   (( segid "    " and resid 26   and name HN  ))
      4.100     2.300     1.900 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.31134E-03 ppm1      7.140 ppm2      8.191 CV     1
 ASSI { 1135}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 55   and name HN  ))
      2.700     1.100     1.100 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.40291E-02 ppm1      3.407 ppm2      8.866 CV     1
 ASSI { 1136}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 55   and name HN  ))
      2.800     1.200     1.200 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.32736E-02 ppm1      2.833 ppm2      8.867 CV     1
 ASSI { 1137}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 55   and name HN  ))
      6.000     4.700     0.000 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.261 ppm2      8.862 CV     1
 ASSI { 1138}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HE21))))
      3.400     1.600     1.600 peak  1138 spectrum    1 weight  0.10000E+01 volume  0.10462E-02 ppm1      4.082 ppm2      7.845 CV     1
 ASSI { 1140}
   (( segid "    " and resid 71   and name HD1%)))
   (( segid "    " and resid 43   and name HZ2 ))
      6.000     4.700     0.000 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.644 ppm2      7.064 CV     1
 ASSI { 1142}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 43   and name HZ2 ))
      3.100     1.400     1.400 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.15979E-02 ppm1      2.120 ppm2      7.060 CV     1
 ASSI { 1143}
   (( segid "    " and resid 43   and name HZ3 ))
   (( segid "    " and resid 43   and name HZ2 ))
      6.000     4.700     0.000 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.941 ppm2      7.064 CV     1
 OR { 1143}
   (( segid "    " and resid 43   and name HD1 ))
   (( segid "    " and resid 43   and name HZ2 ))
 ASSI { 1144}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      3.200     1.500     1.500 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.15269E-02 ppm1      3.930 ppm2      7.728 CV     1
 ASSI { 1145}
   (( segid "    " and resid 60   and name HG2%)))
   (( segid "    " and resid 62   and name HN  ))
      2.900     1.300     1.300 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.25411E-02 ppm1      0.923 ppm2      7.727 CV     1
 ASSI { 1147}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      2.500     1.000     1.000 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.67075E-02 ppm1      7.966 ppm2      8.917 CV     1
 ASSI { 1149}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 68   and name HN  ))
      3.100     1.400     1.400 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.15979E-02 ppm1      0.880 ppm2      9.246 CV     1
 ASSI { 1150}
   (( segid "    " and resid 67   and name HD3 ))
   (( segid "    " and resid 68   and name HN  ))
      6.000     4.700     0.000 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.278 ppm2      9.246 CV     1
 ASSI { 1151}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 71   and name HN  ))
      3.700     1.900     1.900 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.63870E-03 ppm1      1.108 ppm2      8.446 CV     1
 OR { 1151}
   (( segid "    " and resid 72   and name HD1%)))
   (( segid "    " and resid 71   and name HN  ))
 ASSI { 1153}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      4.000     2.200     2.000 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.40749E-03 ppm1      5.542 ppm2      9.479 CV     1
 ASSI { 1154}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 72   and name HN  ))
      4.300     2.500     1.700 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.24724E-03 ppm1      4.157 ppm2      9.479 CV     1
 ASSI { 1155}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 72   and name HN  ))
      3.100     1.400     1.400 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.19000E-02 ppm1      1.576 ppm2      9.478 CV     1
 ASSI { 1156}
   (( segid "    " and resid 673  and name HD1%)))
   (( segid "    " and resid 673  and name HN  ))
      6.000     4.700     0.000 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.838 ppm2      9.509 CV     1
 ASSI { 1157}
   (( segid "    " and resid 673  and name HG2%)))
   (( segid "    " and resid 673  and name HN  ))
      3.100     1.400     1.400 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.18474E-02 ppm1      0.767 ppm2      9.509 CV     1
 ASSI { 1158}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.700     0.000 peak  1158 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.090 ppm2      8.990 CV     1
 ASSI { 1159}
   (( segid "    " and resid 57   and name HD2%)))
   (( segid "    " and resid 73   and name HN  ))
      3.600     1.800     1.800 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.76461E-03 ppm1      0.419 ppm2      8.989 CV     1
 ASSI { 1160}
   (( segid "    " and resid 65   and name HE% ))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.700     0.000 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.423 ppm2      8.521 CV     1
 ASSI { 1161}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.700     0.000 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.567 ppm2      8.522 CV     1
 ASSI { 1163}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      3.000     1.300     1.300 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.20626E-02 ppm1      8.278 ppm2      9.046 CV     1
 ASSI { 1171}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 77   and name HE% ))
      3.600     1.800     1.800 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.75545E-03 ppm1      3.879 ppm2      6.199 CV     1
 ASSI { 1172}
   (( segid "    " and resid 666  and name HB2 ))
   (( segid "    " and resid 77   and name HE% ))
      3.400     1.600     1.600 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.10782E-02 ppm1      3.653 ppm2      6.199 CV     1
 ASSI { 1173}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 77   and name HE% ))
      3.600     1.800     1.800 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.70280E-03 ppm1      3.316 ppm2      6.199 CV     1
 ASSI { 1174}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 77   and name HD% ))
      2.900     1.200     1.200 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.27242E-02 ppm1      3.315 ppm2      6.465 CV     1
 ASSI { 1175}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 77   and name HE% ))
      2.800     1.200     1.200 peak  1175 spectrum    1 weight  0.10000E+01 volume  0.35254E-02 ppm1      2.927 ppm2      6.199 CV     1
 ASSI { 1176}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 77   and name HD% ))
      6.000     4.700     0.000 peak  1176 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.927 ppm2      6.466 CV     1
 ASSI { 1177}
   (( segid "    " and resid 666  and name HB3 ))
   (( segid "    " and resid 77   and name HE% ))
      3.700     1.900     1.900 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.60665E-03 ppm1      2.531 ppm2      6.199 CV     1
 ASSI { 1178}
   (( segid "    " and resid 67   and name HE3 ))
   (( segid "    " and resid 77   and name HE% ))
      3.700     1.900     1.900 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.63412E-03 ppm1      2.382 ppm2      6.199 CV     1
 OR { 1178}
   (( segid "    " and resid 67   and name HE2 ))
   (( segid "    " and resid 77   and name HE% ))
 ASSI { 1179}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 77   and name HE% ))
      4.200     2.400     1.800 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.29303E-03 ppm1      2.275 ppm2      6.199 CV     1
 ASSI { 1181}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 77   and name HD% ))
      6.000     4.700     0.000 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.447 ppm2      6.466 CV     1
 ASSI { 1183}
   (( segid "    " and resid 663  and name HB2 ))
   (( segid "    " and resid 77   and name HE% ))
      6.000     4.700     0.000 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.611 ppm2      6.199 CV     1
 OR { 1183}
   (( segid "    " and resid 663  and name HB3 ))
   (( segid "    " and resid 77   and name HE% ))
 ASSI { 1185}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 77   and name HD% ))
      2.400     0.900     0.900 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.76003E-02 ppm1      1.116 ppm2      6.466 CV     1
 ASSI { 1186}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 77   and name HD% ))
      2.900     1.200     1.200 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.28158E-02 ppm1      1.190 ppm2      6.466 CV     1
 ASSI { 1188}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 77   and name HE% ))
      6.000     4.700     0.000 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.190 ppm2      6.199 CV     1
 ASSI { 1190}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 77   and name HD% ))
      6.000     4.700     0.000 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.059 ppm2      6.466 CV     1
 ASSI { 1191}
   (( segid "    " and resid 663  and name HD1%)))
   (( segid "    " and resid 77   and name HE% ))
      2.000     0.700     0.700 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.23122E-01 ppm1      0.645 ppm2      6.198 CV     1
 ASSI { 1192}
   (( segid "    " and resid 663  and name HD2%)))
   (( segid "    " and resid 77   and name HE% ))
      2.500     1.000     1.000 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.70509E-02 ppm1      0.696 ppm2      6.199 CV     1
 ASSI { 1193}
   (( segid "    " and resid 663  and name HD2%)))
   (( segid "    " and resid 77   and name HD% ))
      2.900     1.200     1.200 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.28158E-02 ppm1      0.699 ppm2      6.466 CV     1
 ASSI { 1194}
   (( segid "    " and resid 663  and name HD1%)))
   (( segid "    " and resid 77   and name HD% ))
      2.500     1.000     1.000 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.70509E-02 ppm1      0.644 ppm2      6.466 CV     1
 ASSI { 1195}
   (( segid "    " and resid 67   and name HD3 ))
   (( segid "    " and resid 77   and name HE% ))
      3.200     1.500     1.500 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.14537E-02 ppm1      0.273 ppm2      6.199 CV     1
 ASSI { 1196}
   (( segid "    " and resid 67   and name HD3 ))
   (( segid "    " and resid 77   and name HD% ))
      6.000     4.700     0.000 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.272 ppm2      6.466 CV     1
 ASSI { 1197}
   (( segid "    " and resid 77   and name HE% ))
   (( segid "    " and resid 78   and name HN  ))
      4.100     2.300     1.900 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.35025E-03 ppm1      6.200 ppm2      8.280 CV     1
 ASSI { 1198}
   (( segid "    " and resid 77   and name HD% ))
   (( segid "    " and resid 78   and name HN  ))
      3.100     1.400     1.400 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.16048E-02 ppm1      6.465 ppm2      8.280 CV     1
 ASSI { 1204}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 80   and name HN  ))
      3.600     1.800     1.800 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.74171E-03 ppm1      1.108 ppm2      7.697 CV     1
 OR { 1204}
   (( segid "    " and resid 72   and name HD1%)))
   (( segid "    " and resid 80   and name HN  ))
 ASSI { 1205}
   (( segid "    " and resid 77   and name HD% ))
   (( segid "    " and resid 81   and name HN  ))
      4.800     3.100     1.200 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.13026E-03 ppm1      6.463 ppm2      8.109 CV     1
 ASSI { 1207}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 81   and name HN  ))
      3.600     1.800     1.800 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.72111E-03 ppm1      3.614 ppm2      8.109 CV     1
 ASSI { 1208}
   (( segid "    " and resid 81   and name HB3 ))
   (( segid "    " and resid 81   and name HN  ))
      3.000     1.300     1.300 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.20397E-02 ppm1      1.755 ppm2      8.112 CV     1
 ASSI { 1209}
   (( segid "    " and resid 77   and name HE% ))
   (( segid "    " and resid 81   and name HN  ))
      3.700     1.900     1.900 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.64786E-03 ppm1      6.199 ppm2      8.109 CV     1
 ASSI { 1211}
   (( segid "    " and resid 77   and name HE% ))
   (( segid "    " and resid 82   and name HN  ))
      6.000     4.700     0.000 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.200 ppm2      7.808 CV     1
 ASSI { 1213}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HD% ))
      2.800     1.100     1.100 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.35712E-02 ppm1      4.788 ppm2      6.488 CV     1
 ASSI { 1216}
   (( segid "    " and resid 667  and name HA  ))
   (( segid "    " and resid 65   and name HE% ))
      2.900     1.300     1.300 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.24266E-02 ppm1      3.835 ppm2      6.427 CV     1
 ASSI { 1217}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 65   and name HE% ))
      2.000     0.700     0.700 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.23579E-01 ppm1      3.771 ppm2      6.427 CV     1
 ASSI { 1218}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 65   and name HE% ))
      3.200     1.500     1.500 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.15429E-02 ppm1      3.697 ppm2      6.427 CV     1
 OR { 1218}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 65   and name HE% ))
 ASSI { 1219}
   (( segid "    " and resid 667  and name HA  ))
   (( segid "    " and resid 65   and name HD% ))
      2.600     1.000     1.000 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.55858E-02 ppm1      3.835 ppm2      6.488 CV     1
 ASSI { 1220}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 65   and name HD% ))
      2.400     0.900     0.900 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.76461E-02 ppm1      3.770 ppm2      6.487 CV     1
 ASSI { 1221}
   (( segid "    " and resid 666  and name HB2 ))
   (( segid "    " and resid 65   and name HD% ))
      3.000     1.300     1.300 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.21519E-02 ppm1      3.650 ppm2      6.488 CV     1
 ASSI { 1222}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 65   and name HE% ))
      3.700     1.900     1.900 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.59520E-03 ppm1      3.243 ppm2      6.427 CV     1
 OR { 1222}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 65   and name HE% ))
 ASSI { 1223}
   (( segid "    " and resid 666  and name HB3 ))
   (( segid "    " and resid 65   and name HD% ))
      2.900     1.200     1.200 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.26784E-02 ppm1      2.532 ppm2      6.488 CV     1
 ASSI { 1224}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 65   and name HE% ))
      2.800     1.200     1.200 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.31363E-02 ppm1      2.088 ppm2      6.426 CV     1
 ASSI { 1225}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 65   and name HD% ))
      3.400     1.700     1.700 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.97064E-03 ppm1      2.088 ppm2      6.489 CV     1
 ASSI { 1226}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 65   and name HE% ))
      3.300     1.600     1.600 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.12018E-02 ppm1      1.901 ppm2      6.426 CV     1
 ASSI { 1227}
   (( segid "    " and resid 663  and name HB3 ))
   (( segid "    " and resid 65   and name HE% ))
      2.400     0.900     0.900 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.82642E-02 ppm1      1.610 ppm2      6.426 CV     1
 OR { 1227}
   (( segid "    " and resid 663  and name HB2 ))
   (( segid "    " and resid 65   and name HE% ))
 ASSI { 1228}
   (( segid "    " and resid 667  and name HG2 ))
   (( segid "    " and resid 65   and name HE% ))
      2.900     1.300     1.300 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.24953E-02 ppm1      1.177 ppm2      6.427 CV     1
 OR { 1228}
   (( segid "    " and resid 667  and name HG3 ))
   (( segid "    " and resid 65   and name HE% ))
 ASSI { 1229}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 81   and name HE% ))
      6.000     4.700     0.000 peak  1229 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.259 ppm2      7.079 CV     1
 ASSI { 1230}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HE22))))
      4.600     2.900     1.400 peak  1230 spectrum    1 weight  0.10000E+01 volume  0.15727E-03 ppm1      4.126 ppm2      6.684 CV     1
 ASSI { 1231}
   (( segid "    " and resid 54   and name HG2 ))
   (( segid "    " and resid 54   and name HE22))))
      3.700     1.900     1.900 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.59978E-03 ppm1      2.312 ppm2      6.686 CV     1
 ASSI { 1232}
   (( segid "    " and resid 54   and name HG2 ))
   (( segid "    " and resid 54   and name HE21))))
      4.000     2.200     2.000 peak  1232 spectrum    1 weight  0.10000E+01 volume  0.40062E-03 ppm1      2.315 ppm2      7.226 CV     1
 ASSI { 1233}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 44   and name HD2 ))
      6.000     4.700     0.000 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.353 ppm2      7.871 CV     1
 ASSI { 1234}
   (( segid "    " and resid 30   and name HG2%)))
   (( segid "    " and resid 44   and name HD2 ))
      2.700     1.100     1.100 peak  1234 spectrum    1 weight  0.10000E+01 volume  0.43266E-02 ppm1      0.898 ppm2      7.871 CV     1
 ASSI { 1235}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 44   and name HD2 ))
      3.700     1.900     1.900 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.57689E-03 ppm1      0.422 ppm2      7.871 CV     1
 ASSI { 1236}
   (( segid "    " and resid 30   and name HG13))))
   (( segid "    " and resid 44   and name HD2 ))
      3.500     1.800     1.800 peak  1236 spectrum    1 weight  0.10000E+01 volume  0.78979E-03 ppm1     -0.610 ppm2      7.871 CV     1
 ASSI { 1237}
   (( segid "    " and resid 43   and name HZ3 ))
   (( segid "    " and resid 43   and name HE3 ))
      6.000     4.700     0.000 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.940 ppm2      7.139 CV     1
 ASSI { 1238}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 43   and name HE3 ))
      3.200     1.500     1.500 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.13781E-02 ppm1      4.444 ppm2      7.139 CV     1
 ASSI { 1239}
   (( segid "    " and resid 25   and name HA1 ))
   (( segid "    " and resid 43   and name HE3 ))
      3.800     2.000     2.000 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.54255E-03 ppm1      4.333 ppm2      7.139 CV     1
 ASSI { 1240}
   (( segid "    " and resid 25   and name HA2 ))
   (( segid "    " and resid 43   and name HE3 ))
      6.000     4.700     0.000 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.986 ppm2      7.139 CV     1
 ASSI { 1241}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 43   and name HE3 ))
      2.700     1.100     1.100 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.42351E-02 ppm1      3.513 ppm2      7.139 CV     1
 ASSI { 1242}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 43   and name HE3 ))
      3.000     1.400     1.400 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.19939E-02 ppm1      3.284 ppm2      7.139 CV     1
 ASSI { 1243}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 43   and name HE3 ))
      3.500     1.700     1.700 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.90194E-03 ppm1      2.613 ppm2      7.139 CV     1
 ASSI { 1244}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 43   and name HE3 ))
      3.600     1.900     1.900 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.66617E-03 ppm1      0.117 ppm2      7.138 CV     1
 ASSI { 1245}
   (( segid "    " and resid 37   and name HE% ))
   (( segid "    " and resid 43   and name HD1 ))
      6.000     4.700     0.000 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.402 ppm2      6.958 CV     1
 ASSI { 1247}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 43   and name HD1 ))
      6.000     4.700     0.000 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.760 ppm2      6.958 CV     1
 ASSI { 1248}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 43   and name HD1 ))
      6.000     4.700     0.000 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.614 ppm2      6.957 CV     1
 ASSI { 1254}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 43   and name HD1 ))
      4.300     2.500     1.700 peak  1254 spectrum    1 weight  0.10000E+01 volume  0.24495E-03 ppm1      0.116 ppm2      6.958 CV     1
 ASSI { 1255}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 43   and name HD1 ))
      3.900     2.100     2.100 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.42351E-03 ppm1      0.578 ppm2      6.942 CV     1
 ASSI { 1256}
   (( segid "    " and resid 71   and name HD1%)))
   (( segid "    " and resid 43   and name HZ3 ))
      2.600     1.100     1.100 peak  1256 spectrum    1 weight  0.10000E+01 volume  0.47388E-02 ppm1      0.643 ppm2      6.942 CV     1
 ASSI { 1257}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 20   and name HZ3 ))
      3.200     1.500     1.500 peak  1257 spectrum    1 weight  0.10000E+01 volume  0.13552E-02 ppm1      1.490 ppm2      6.944 CV     1
 OR { 1257}
   (( segid "    " and resid 29   and name HB3 ))
   (( segid "    " and resid 20   and name HZ3 ))
 ASSI { 1258}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 43   and name HZ3 ))
      3.600     1.800     1.800 peak  1258 spectrum    1 weight  0.10000E+01 volume  0.74171E-03 ppm1      3.926 ppm2      6.939 CV     1
 OR { 1258}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 43   and name HD1 ))
 ASSI { 1259}
   (( segid "    " and resid 25   and name HA2 ))
   (( segid "    " and resid 43   and name HZ3 ))
      2.700     1.100     1.100 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.39375E-02 ppm1      3.989 ppm2      6.939 CV     1
 ASSI { 1262}
   (( segid "    " and resid 34   and name HZ  ))
   (( segid "    " and resid 34   and name HE% ))
      2.300     0.900     0.900 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.10462E-01 ppm1      7.181 ppm2      7.342 CV     1
 ASSI { 1263}
   (( segid "    " and resid 34   and name HZ  ))
   (( segid "    " and resid 34   and name HD% ))
      6.000     4.700     0.000 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.180 ppm2      7.289 CV     1
 ASSI { 1264}
   (( segid "    " and resid 674  and name HA  ))
   (( segid "    " and resid 34   and name HE% ))
      3.100     1.400     1.400 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.18818E-02 ppm1      4.773 ppm2      7.340 CV     1
 ASSI { 1265}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 34   and name HE% ))
      4.700     3.000     1.300 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.13850E-03 ppm1      3.731 ppm2      7.339 CV     1
 ASSI { 1267}
   (( segid "    " and resid 674  and name HB2 ))
   (( segid "    " and resid 34   and name HE% ))
      2.900     1.300     1.300 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.26097E-02 ppm1      3.117 ppm2      7.339 CV     1
 ASSI { 1269}
   (( segid "    " and resid 33   and name HD3 ))
   (( segid "    " and resid 34   and name HD% ))
      2.900     1.200     1.200 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.26326E-02 ppm1      2.676 ppm2      7.285 CV     1
 ASSI { 1270}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 34   and name HD% ))
      6.000     4.700     0.000 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.819 ppm2      7.287 CV     1
 ASSI { 1271}
   (( segid "    " and resid 33   and name HB3 ))
   (( segid "    " and resid 34   and name HE% ))
      3.500     1.700     1.700 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.82642E-03 ppm1      1.479 ppm2      7.339 CV     1
 ASSI { 1273}
   (( segid "    " and resid 672  and name HG1%)))
   (( segid "    " and resid 34   and name HE% ))
      3.000     1.300     1.300 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.22458E-02 ppm1      0.974 ppm2      7.340 CV     1
 ASSI { 1274}
   (( segid "    " and resid 672  and name HG1%)))
   (( segid "    " and resid 34   and name HD% ))
      2.500     1.000     1.000 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.69822E-02 ppm1      0.975 ppm2      7.284 CV     1
 ASSI { 1275}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 34   and name HE% ))
      3.600     1.800     1.800 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.76919E-03 ppm1      0.371 ppm2      7.341 CV     1
 ASSI { 1276}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 34   and name HD% ))
      3.700     1.900     1.900 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.65472E-03 ppm1      0.371 ppm2      7.287 CV     1
 ASSI { 1277}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 20   and name HZ2 ))
      4.000     2.200     2.000 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.40749E-03 ppm1      2.466 ppm2      7.466 CV     1
 OR { 1277}
   (( segid "    " and resid 29   and name HE2 ))
   (( segid "    " and resid 20   and name HZ2 ))
 ASSI { 1278}
   (( segid "    " and resid 18   and name HD2%)))
   (( segid "    " and resid 20   and name HZ2 ))
      3.800     2.000     2.000 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.48074E-03 ppm1      0.747 ppm2      7.464 CV     1
 ASSI { 1279}
   (( segid "    " and resid 18   and name HD1%)))
   (( segid "    " and resid 20   and name HZ2 ))
      6.000     4.700     0.000 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.794 ppm2      7.462 CV     1
 ASSI { 1280}
   (( segid "    " and resid 673  and name HG2%)))
   (( segid "    " and resid 34   and name HZ  ))
      6.000     4.700     0.000 peak  1280 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.772 ppm2      7.175 CV     1
 ASSI { 1281}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 20   and name HE3 ))
      6.000     4.700     0.000 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.509 ppm2      7.382 CV     1
 ASSI { 1282}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 20   and name HE3 ))
      3.700     1.900     1.900 peak  1282 spectrum    1 weight  0.10000E+01 volume  0.57002E-03 ppm1      4.465 ppm2      7.382 CV     1
 ASSI { 1285}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 20   and name HE3 ))
      4.300     2.500     1.700 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.23579E-03 ppm1      3.719 ppm2      7.382 CV     1
 OR { 1285}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 20   and name HE3 ))
 ASSI { 1286}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 20   and name HE3 ))
      4.200     2.400     1.800 peak  1286 spectrum    1 weight  0.10000E+01 volume  0.30218E-03 ppm1      2.464 ppm2      7.382 CV     1
 OR { 1286}
   (( segid "    " and resid 29   and name HE2 ))
   (( segid "    " and resid 20   and name HE3 ))
 ASSI { 1287}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 20   and name HE3 ))
      3.100     1.400     1.400 peak  1287 spectrum    1 weight  0.10000E+01 volume  0.16620E-02 ppm1      1.508 ppm2      7.381 CV     1
 OR { 1287}
   (( segid "    " and resid 29   and name HB3 ))
   (( segid "    " and resid 20   and name HE3 ))
 ASSI { 1289}
   (( segid "    " and resid 29   and name HD2 ))
   (( segid "    " and resid 20   and name HE3 ))
      4.000     2.200     2.000 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.36170E-03 ppm1      1.165 ppm2      7.382 CV     1
 OR { 1289}
   (( segid "    " and resid 29   and name HD3 ))
   (( segid "    " and resid 20   and name HE3 ))
 ASSI { 1291}
   (( segid "    " and resid 29   and name HG3 ))
   (( segid "    " and resid 20   and name HE3 ))
      6.000     4.700     0.000 peak  1291 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.003 ppm2      7.382 CV     1
 ASSI { 1292}
   (( segid "    " and resid 20   and name HE3 ))
   (( segid "    " and resid 20   and name HE1 ))
      4.800     3.100     1.200 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.12041E-03 ppm1      7.381 ppm2     10.173 CV     1
 ASSI { 1293}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 20   and name HE1 ))
      6.000     4.700     0.000 peak  1293 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.249 ppm2     10.173 CV     1
 ASSI { 1294}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HE1 ))
      6.000     4.700     0.000 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.302 ppm2     10.172 CV     1
 ASSI { 1295}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 20   and name HE1 ))
      4.400     2.600     1.600 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.20833E-03 ppm1      2.469 ppm2     10.173 CV     1
 OR { 1295}
   (( segid "    " and resid 29   and name HE2 ))
   (( segid "    " and resid 20   and name HE1 ))
 ASSI { 1296}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 20   and name HE1 ))
      3.900     2.100     2.100 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.46014E-03 ppm1      1.503 ppm2     10.173 CV     1
 OR { 1296}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 20   and name HE1 ))
 ASSI { 1298}
   (( segid "    " and resid 18   and name HD2%)))
   (( segid "    " and resid 20   and name HE1 ))
      3.900     2.100     2.100 peak  1298 spectrum    1 weight  0.10000E+01 volume  0.46243E-03 ppm1      0.746 ppm2     10.173 CV     1
 ASSI { 1299}
   (( segid "    " and resid 18   and name HD1%)))
   (( segid "    " and resid 20   and name HE1 ))
      4.100     2.300     1.900 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.34110E-03 ppm1      0.797 ppm2     10.173 CV     1
 ASSI { 1302}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 666  and name HE% ))
      6.000     4.700     0.000 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.884 ppm2      6.819 CV     1
 ASSI { 1303}
   (( segid "    " and resid 663  and name HD2%)))
   (( segid "    " and resid 666  and name HE% ))
      3.000     1.300     1.300 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.22893E-02 ppm1      0.695 ppm2      6.819 CV     1
 ASSI { 1304}
   (( segid "    " and resid 663  and name HD1%)))
   (( segid "    " and resid 666  and name HE% ))
      6.000     4.700     0.000 peak  1304 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.645 ppm2      6.819 CV     1
 ASSI { 1305}
   (( segid "    " and resid 67   and name HD3 ))
   (( segid "    " and resid 666  and name HE% ))
      6.000     4.700     0.000 peak  1305 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.279 ppm2      6.820 CV     1
 ASSI { 1308}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      3.500     1.800     1.800 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.78979E-03 ppm1      4.454 ppm2      7.461 CV     1
 ASSI { 1310}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 49   and name HN  ))
      6.000     4.700     0.000 peak  1310 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.599 ppm2      7.456 CV     1
 ASSI { 1311}
   (( segid "    " and resid 680  and name HB2 ))
   (( segid "    " and resid 680  and name HE21))))
      3.700     1.900     1.900 peak  1311 spectrum    1 weight  0.10000E+01 volume  0.63641E-03 ppm1      2.138 ppm2      7.529 CV     1
 ASSI { 1312}
   (( segid "    " and resid 680  and name HB3 ))
   (( segid "    " and resid 680  and name HE21))))
      3.700     1.900     1.900 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.58605E-03 ppm1      1.971 ppm2      7.529 CV     1
 ASSI { 1313}
   (( segid "    " and resid 654  and name HB2 ))
   (( segid "    " and resid 654  and name HE21))))
      4.700     3.000     1.300 peak  1313 spectrum    1 weight  0.10000E+01 volume  0.13850E-03 ppm1      1.963 ppm2      7.420 CV     1
 ASSI { 1314}
   (( segid "    " and resid 77   and name HD% ))
   (( segid "    " and resid 81   and name HD% ))
      3.100     1.400     1.400 peak  1314 spectrum    1 weight  0.10000E+01 volume  0.16987E-02 ppm1      6.465 ppm2      6.851 CV     1
 ASSI { 1315}
   (( segid "    " and resid 77   and name HD% ))
   (( segid "    " and resid 81   and name HE% ))
      3.700     1.900     1.900 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.62497E-03 ppm1      6.465 ppm2      7.079 CV     1
 ASSI { 1316}
   (( segid "    " and resid 77   and name HE% ))
   (( segid "    " and resid 81   and name HD% ))
      3.500     1.700     1.700 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.91571E-03 ppm1      6.199 ppm2      6.850 CV     1
 ASSI { 1317}
   (( segid "    " and resid 77   and name HE% ))
   (( segid "    " and resid 81   and name HE% ))
      3.900     2.100     2.100 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.45785E-03 ppm1      6.196 ppm2      7.082 CV     1
 ASSI { 1318}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 81   and name HD% ))
      2.800     1.200     1.200 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.30676E-02 ppm1      3.981 ppm2      6.852 CV     1
 ASSI { 1319}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 81   and name HE% ))
      2.900     1.200     1.200 peak  1319 spectrum    1 weight  0.10000E+01 volume  0.27013E-02 ppm1      3.843 ppm2      7.081 CV     1
 ASSI { 1320}
   (( segid "    " and resid 81   and name HB3 ))
   (( segid "    " and resid 81   and name HD% ))
      2.400     0.900     0.900 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.81039E-02 ppm1      1.754 ppm2      6.852 CV     1
 ASSI { 1321}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HE  ))
      3.300     1.600     1.600 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.11057E-02 ppm1      1.899 ppm2      7.083 CV     1
 OR { 1321}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HE  ))
 ASSI { 1323}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 81   and name HD% ))
      2.900     1.300     1.300 peak  1323 spectrum    1 weight  0.10000E+01 volume  0.23808E-02 ppm1      1.114 ppm2      6.852 CV     1
 ASSI { 1324}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 81   and name HD% ))
      3.200     1.500     1.500 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.13438E-02 ppm1      1.188 ppm2      6.852 CV     1
 ASSI { 1325}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 81   and name HE% ))
      2.400     0.900     0.900 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.72340E-02 ppm1      1.114 ppm2      7.082 CV     1
 ASSI { 1326}
   (( segid "    " and resid 80   and name HD2%)))
   (( segid "    " and resid 81   and name HD% ))
      4.100     2.300     1.900 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.34796E-03 ppm1      0.560 ppm2      6.852 CV     1
 ASSI { 1327}
   (( segid "    " and resid 67   and name HD3 ))
   (( segid "    " and resid 81   and name HD% ))
      3.700     1.900     1.900 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.62726E-03 ppm1      0.272 ppm2      6.853 CV     1
 ASSI { 1328}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 81   and name HD% ))
      3.300     1.600     1.600 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.11469E-02 ppm1      0.099 ppm2      6.852 CV     1
 ASSI { 1329}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 81   and name HE% ))
      3.500     1.700     1.700 peak  1329 spectrum    1 weight  0.10000E+01 volume  0.88368E-03 ppm1      0.099 ppm2      7.083 CV     1
 ASSI { 1330}
   (( segid "    " and resid 650  and name HA  ))
   (( segid "    " and resid 650  and name HB2 ))
      2.800     1.200     1.200 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.33423E-02 ppm1      4.574 ppm2      3.164 CV     1
 ASSI { 1331}
   (( segid "    " and resid 650  and name HA  ))
   (( segid "    " and resid 650  and name HB3 ))
      6.000     4.700     0.000 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.574 ppm2      3.032 CV     1
 ASSI { 1332}
   (( segid "    " and resid 652  and name HB2 ))
   (( segid "    " and resid 652  and name HB3 ))
      6.000     4.700     0.000 peak  1332 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.797 ppm2      2.681 CV     1
 ASSI { 1333}
   (( segid "    " and resid 654  and name HG2 ))
   (( segid "    " and resid 654  and name HB3 ))
      1.500     0.500     0.700 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.13873E+00 ppm1      2.190 ppm2      1.870 CV     1
 OR { 1333}
   (( segid "    " and resid 654  and name HG3 ))
   (( segid "    " and resid 654  and name HB3 ))
 ASSI { 1334}
   (( segid "    " and resid 654  and name HG3 ))
   (( segid "    " and resid 654  and name HB2 ))
      6.000     4.700     0.000 peak  1334 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.190 ppm2      1.955 CV     1
 OR { 1334}
   (( segid "    " and resid 654  and name HG2 ))
   (( segid "    " and resid 654  and name HB2 ))
 ASSI { 1335}
   (( segid "    " and resid 654  and name HA  ))
   (( segid "    " and resid 654  and name HG3 ))
      6.000     4.700     0.000 peak  1335 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.262 ppm2      2.193 CV     1
 ASSI { 1336}
   (( segid "    " and resid 658  and name HB2 ))
   (( segid "    " and resid 658  and name HB3 ))
      6.000     4.700     0.000 peak  1336 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.766 ppm2      2.565 CV     1
 ASSI { 1339}
   (( segid "    " and resid 658  and name HB3 ))
   (( segid "    " and resid 661  and name HB% ))
      4.200     2.400     1.800 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.27471E-03 ppm1      2.564 ppm2      1.412 CV     1
 ASSI { 1341}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 666  and name HB2 ))
      6.000     4.700     0.000 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.760 ppm2      3.655 CV     1
 ASSI { 1343}
   (( segid "    " and resid 671  and name HA  ))
   (( segid "    " and resid 671  and name HG2%)))
      2.700     1.100     1.100 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.43038E-02 ppm1      4.700 ppm2      1.268 CV     1
 ASSI { 1344}
   (( segid "    " and resid 676  and name HE2 ))
   (( segid "    " and resid 676  and name HG3 ))
      6.000     4.700     0.000 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.910 ppm2      1.268 CV     1
 OR { 1344}
   (( segid "    " and resid 676  and name HE3 ))
   (( segid "    " and resid 676  and name HG3 ))
 ASSI { 1345}
   (( segid "    " and resid 671  and name HA  ))
   (( segid "    " and resid 672  and name HG1%)))
      6.000     4.700     0.000 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.697 ppm2      0.976 CV     1
 ASSI { 1346}
   (( segid "    " and resid 671  and name HA  ))
   (( segid "    " and resid 672  and name HG2%)))
      3.000     1.400     1.400 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.19687E-02 ppm1      4.700 ppm2      0.915 CV     1
 ASSI { 1347}
   (( segid "    " and resid 671  and name HA  ))
   (( segid "    " and resid 672  and name HB  ))
      3.400     1.700     1.700 peak  1347 spectrum    1 weight  0.10000E+01 volume  0.95458E-03 ppm1      4.700 ppm2      2.041 CV     1
 ASSI { 1348}
   (( segid "    " and resid 33   and name HD3 ))
   (( segid "    " and resid 33   and name HB3 ))
      3.500     1.800     1.800 peak  1348 spectrum    1 weight  0.10000E+01 volume  0.79666E-03 ppm1      2.680 ppm2      1.479 CV     1
 ASSI { 1350}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 675  and name HG2%)))
      3.200     1.500     1.500 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.15521E-02 ppm1      5.822 ppm2      1.227 CV     1
 ASSI { 1352}
   (( segid "    " and resid 677  and name HA  ))
   (( segid "    " and resid 677  and name HB3 ))
      2.300     0.800     0.800 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.11080E-01 ppm1      4.587 ppm2      2.768 CV     1
 OR { 1352}
   (( segid "    " and resid 677  and name HA  ))
   (( segid "    " and resid 677  and name HB2 ))
 ASSI { 1354}
   (( segid "    " and resid 907  and name HA  ))
   (( segid "    " and resid 907  and name HG3 ))
      3.300     1.600     1.600 peak  1354 spectrum    1 weight  0.10000E+01 volume  0.11560E-02 ppm1      4.422 ppm2      2.396 CV     1
 ASSI { 1355}
   (( segid "    " and resid 683  and name HB2 ))
   (( segid "    " and resid 683  and name HD1%)))
      6.000     4.700     0.000 peak  1355 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.549 ppm2      0.831 CV     1
 OR { 1355}
   (( segid "    " and resid 683  and name HB3 ))
   (( segid "    " and resid 683  and name HD1%)))
 ASSI { 1356}
   (( segid "    " and resid 683  and name HB3 ))
   (( segid "    " and resid 683  and name HD2%)))
      6.000     4.700     0.000 peak  1356 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.552 ppm2      0.786 CV     1
 OR { 1356}
   (( segid "    " and resid 683  and name HB2 ))
   (( segid "    " and resid 683  and name HD2%)))
 ASSI { 1357}
   (( segid "    " and resid 683  and name HA  ))
   (( segid "    " and resid 683  and name HD1%)))
      2.900     1.200     1.200 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.26784E-02 ppm1      4.272 ppm2      0.830 CV     1
 ASSI { 1358}
   (( segid "    " and resid 683  and name HA  ))
   (( segid "    " and resid 683  and name HD2%)))
      2.500     1.000     1.000 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.62497E-02 ppm1      4.272 ppm2      0.786 CV     1
 ASSI { 1359}
   (( segid "    " and resid 683  and name HA  ))
   (( segid "    " and resid 683  and name HG  ))
      2.700     1.100     1.100 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.37315E-02 ppm1      4.273 ppm2      1.546 CV     1
 ASSI { 1360}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HB3 ))
      6.000     4.700     0.000 peak  1360 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.508 ppm2      1.343 CV     1
 ASSI { 1361}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 35   and name HD2%)))
      3.800     2.000     2.000 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.54942E-03 ppm1      2.766 ppm2      0.749 CV     1
 ASSI { 1363}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      6.000     4.700     0.000 peak  1363 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.311 ppm2      3.717 CV     1
 OR { 1363}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB3 ))
 ASSI { 1367}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 24   and name HB% ))
      2.300     0.800     0.800 peak  1367 spectrum    1 weight  0.10000E+01 volume  0.11927E-01 ppm1      3.526 ppm2      0.219 CV     1
 ASSI { 1368}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 24   and name HB% ))
      2.600     1.100     1.100 peak  1368 spectrum    1 weight  0.10000E+01 volume  0.46243E-02 ppm1      3.579 ppm2      0.219 CV     1
 ASSI { 1369}
   (( segid "    " and resid 25   and name HA2 ))
   (( segid "    " and resid 24   and name HB% ))
      4.100     2.300     1.900 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.31134E-03 ppm1      3.982 ppm2      0.219 CV     1
 ASSI { 1370}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HB% ))
      3.100     1.400     1.400 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.16940E-02 ppm1      4.403 ppm2      0.219 CV     1
 ASSI { 1371}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 24   and name HB% ))
      3.600     1.800     1.800 peak  1371 spectrum    1 weight  0.10000E+01 volume  0.68448E-03 ppm1      4.569 ppm2      0.219 CV     1
 ASSI { 1372}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.300     0.800     0.800 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.11469E-01 ppm1      3.989 ppm2      2.963 CV     1
 ASSI { 1373}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB3 ))
      2.700     1.100     1.100 peak  1373 spectrum    1 weight  0.10000E+01 volume  0.42122E-02 ppm1      3.989 ppm2      2.679 CV     1
 ASSI { 1374}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 57   and name HD2%)))
      2.900     1.200     1.200 peak  1374 spectrum    1 weight  0.10000E+01 volume  0.26326E-02 ppm1      4.257 ppm2      0.419 CV     1
 ASSI { 1375}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 71   and name HG2%)))
      3.800     2.000     2.000 peak  1375 spectrum    1 weight  0.10000E+01 volume  0.54942E-03 ppm1      4.258 ppm2      0.581 CV     1
 ASSI { 1378}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 29   and name HB2 ))
      3.400     1.700     1.700 peak  1378 spectrum    1 weight  0.10000E+01 volume  0.93633E-03 ppm1      2.466 ppm2      1.514 CV     1
 OR { 1378}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 29   and name HB3 ))
 OR { 1378}
   (( segid "    " and resid 29   and name HE2 ))
   (( segid "    " and resid 29   and name HB2 ))
 ASSI { 1379}
   (( segid "    " and resid 29   and name HE3 ))
   (( segid "    " and resid 29   and name HG2 ))
      2.800     1.200     1.200 peak  1379 spectrum    1 weight  0.10000E+01 volume  0.35254E-02 ppm1      2.468 ppm2      1.253 CV     1
 OR { 1379}
   (( segid "    " and resid 29   and name HE2 ))
   (( segid "    " and resid 29   and name HG2 ))
 ASSI { 1380}
   (( segid "    " and resid 35   and name HD2%)))
   (( segid "    " and resid 30   and name HG13))))
      4.800     3.100     1.200 peak  1380 spectrum    1 weight  0.10000E+01 volume  0.13026E-03 ppm1      0.753 ppm2     -0.607 CV     1
 ASSI { 1381}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 30   and name HG13))))
      3.600     1.800     1.800 peak  1381 spectrum    1 weight  0.10000E+01 volume  0.74629E-03 ppm1      2.259 ppm2     -0.607 CV     1
 ASSI { 1382}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 30   and name HG13))))
      3.800     2.000     2.000 peak  1382 spectrum    1 weight  0.10000E+01 volume  0.49448E-03 ppm1      3.348 ppm2     -0.607 CV     1
 ASSI { 1383}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HG12))))
      3.000     1.300     1.300 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.21244E-02 ppm1      3.988 ppm2      1.278 CV     1
 ASSI { 1384}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 48   and name HB3 ))
      6.000     4.700     0.000 peak  1384 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.581 ppm2      0.420 CV     1
 ASSI { 1385}
   (( segid "    " and resid 57   and name HD1%)))
   (( segid "    " and resid 57   and name HD2%)))
      6.000     4.700     0.000 peak  1385 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.658 ppm2      0.420 CV     1
 ASSI { 1386}
   (( segid "    " and resid 30   and name HG2%)))
   (( segid "    " and resid 30   and name HD1%)))
      6.000     4.700     0.000 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.895 ppm2      0.420 CV     1
 ASSI { 1389}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 30   and name HD1%)))
      3.900     2.100     2.100 peak  1389 spectrum    1 weight  0.10000E+01 volume  0.43266E-03 ppm1      2.050 ppm2      0.420 CV     1
 ASSI { 1390}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 30   and name HD1%)))
      3.100     1.400     1.400 peak  1390 spectrum    1 weight  0.10000E+01 volume  0.16620E-02 ppm1      2.264 ppm2      0.420 CV     1
 ASSI { 1391}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 30   and name HD1%)))
      6.000     4.700     0.000 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.712 ppm2      0.420 CV     1
 ASSI { 1392}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 30   and name HD1%)))
      6.000     4.700     0.000 peak  1392 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.777 ppm2      0.420 CV     1
 ASSI { 1394}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 30   and name HD1%)))
      6.000     4.700     0.000 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.366 ppm2      0.420 CV     1
 ASSI { 1396}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 57   and name HD2%)))
      2.300     0.900     0.900 peak  1396 spectrum    1 weight  0.10000E+01 volume  0.11057E-01 ppm1      3.607 ppm2      0.420 CV     1
 ASSI { 1398}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 30   and name HD1%)))
      2.500     1.000     1.000 peak  1398 spectrum    1 weight  0.10000E+01 volume  0.60436E-02 ppm1      4.402 ppm2      0.420 CV     1
 ASSI { 1400}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 57   and name HD2%)))
      3.700     1.900     1.900 peak  1400 spectrum    1 weight  0.10000E+01 volume  0.57002E-03 ppm1      6.144 ppm2      0.421 CV     1
 ASSI { 1403}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 57   and name HD2%)))
      3.200     1.500     1.500 peak  1403 spectrum    1 weight  0.10000E+01 volume  0.14194E-02 ppm1      4.937 ppm2      0.418 CV     1
 ASSI { 1405}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 57   and name HD2%)))
      3.400     1.600     1.600 peak  1405 spectrum    1 weight  0.10000E+01 volume  0.10737E-02 ppm1      4.798 ppm2      0.418 CV     1
 ASSI { 1407}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 32   and name HB3 ))
      2.300     0.900     0.900 peak  1407 spectrum    1 weight  0.10000E+01 volume  0.10119E-01 ppm1      3.370 ppm2      2.498 CV     1
 ASSI { 1410}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HB3 ))
      6.000     4.700     0.000 peak  1410 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.610 ppm2      2.505 CV     1
 ASSI { 1411}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 672  and name HG1%)))
      2.600     1.000     1.000 peak  1411 spectrum    1 weight  0.10000E+01 volume  0.55171E-02 ppm1      2.986 ppm2      0.978 CV     1
 ASSI { 1412}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 672  and name HG1%)))
      3.200     1.500     1.500 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.14124E-02 ppm1      2.910 ppm2      0.976 CV     1
 ASSI { 1413}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HG  ))
      3.500     1.700     1.700 peak  1413 spectrum    1 weight  0.10000E+01 volume  0.90887E-03 ppm1      5.824 ppm2      1.708 CV     1
 ASSI { 1414}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 672  and name HG1%)))
      3.200     1.500     1.500 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.13255E-02 ppm1      5.824 ppm2      0.977 CV     1
 ASSI { 1416}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 33   and name HG3 ))
      4.100     2.300     1.900 peak  1416 spectrum    1 weight  0.10000E+01 volume  0.35254E-03 ppm1      5.824 ppm2      0.363 CV     1
 ASSI { 1417}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HB3 ))
      4.200     2.400     1.800 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.30218E-03 ppm1      5.824 ppm2      1.873 CV     1
 ASSI { 1418}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HD2%)))
      6.000     4.700     0.000 peak  1418 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.054 ppm2      0.755 CV     1
 ASSI { 1419}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HD2%)))
      3.200     1.500     1.500 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.13232E-02 ppm1      4.873 ppm2      0.755 CV     1
 ASSI { 1420}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HD1%)))
      6.000     4.700     0.000 peak  1420 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.873 ppm2      0.953 CV     1
 ASSI { 1421}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 670  and name HG1%)))
      6.000     4.700     0.000 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.607 ppm2      0.721 CV     1
 ASSI { 1422}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 672  and name HG1%)))
      6.000     4.700     0.000 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.607 ppm2      0.974 CV     1
 ASSI { 1423}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HB2 ))
      6.000     4.700     0.000 peak  1423 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.607 ppm2      2.878 CV     1
 ASSI { 1425}
   (( segid "    " and resid 671  and name HB  ))
   (( segid "    " and resid 37   and name HB3 ))
      6.000     4.700     0.000 peak  1425 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.249 ppm2      2.685 CV     1
 ASSI { 1426}
   (( segid "    " and resid 671  and name HB  ))
   (( segid "    " and resid 37   and name HB2 ))
      6.000     4.700     0.000 peak  1426 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.247 ppm2      2.877 CV     1
 ASSI { 1427}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HB% ))
      3.300     1.600     1.600 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.11927E-02 ppm1      5.685 ppm2      1.157 CV     1
 ASSI { 1429}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 80   and name HB3 ))
      6.000     4.700     0.000 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.977 ppm2      0.115 CV     1
 ASSI { 1430}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 72   and name HD2%)))
      2.500     1.000     1.000 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.67075E-02 ppm1      3.977 ppm2      1.115 CV     1
 OR { 1430}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 72   and name HD1%)))
 ASSI { 1431}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 668  and name HE% ))
      6.000     4.700     0.000 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.977 ppm2      2.001 CV     1
 ASSI { 1434}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB3 ))
      2.900     1.300     1.300 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.26097E-02 ppm1      5.704 ppm2      2.612 CV     1
 ASSI { 1439}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HB3 ))
      2.500     1.000     1.000 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.71425E-02 ppm1      3.455 ppm2      2.608 CV     1
 ASSI { 1441}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 36   and name HD1%)))
      3.500     1.700     1.700 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.86078E-03 ppm1      3.454 ppm2      0.889 CV     1
 OR { 1441}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 36   and name HD2%)))
 ASSI { 1442}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 48   and name HD1%)))
      4.400     2.600     1.600 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.22000E-03 ppm1      3.457 ppm2      0.117 CV     1
 ASSI { 1443}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 48   and name HD2%)))
      4.200     2.400     1.800 peak  1443 spectrum    1 weight  0.10000E+01 volume  0.27699E-03 ppm1      3.457 ppm2     -0.813 CV     1
 ASSI { 1445}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 72   and name HD1%)))
      6.000     4.700     0.000 peak  1445 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.566 ppm2      1.099 CV     1
 ASSI { 1447}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HD1%)))
      6.000     4.700     0.000 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.930 ppm2      0.863 CV     1
 ASSI { 1451}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 48   and name HD1%)))
      3.400     1.600     1.600 peak  1451 spectrum    1 weight  0.10000E+01 volume  0.10805E-02 ppm1      1.879 ppm2      0.116 CV     1
 ASSI { 1453}
   (( segid "    " and resid 36   and name HD1%)))
   (( segid "    " and resid 48   and name HD1%)))
      2.300     0.900     0.900 peak  1453 spectrum    1 weight  0.10000E+01 volume  0.99582E-02 ppm1      0.884 ppm2      0.116 CV     1
 OR { 1453}
   (( segid "    " and resid 36   and name HD2%)))
   (( segid "    " and resid 48   and name HD1%)))
 ASSI { 1455}
   (( segid "    " and resid 58   and name HA1 ))
   (( segid "    " and resid 48   and name HD1%)))
      6.000     4.700     0.000 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.730 ppm2      0.115 CV     1
 OR { 1455}
   (( segid "    " and resid 58   and name HA2 ))
   (( segid "    " and resid 48   and name HD1%)))
 ASSI { 1458}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 57   and name HG  ))
      2.900     1.200     1.200 peak  1458 spectrum    1 weight  0.10000E+01 volume  0.27929E-02 ppm1      5.044 ppm2      1.547 CV     1
 ASSI { 1459}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 57   and name HB3 ))
      6.000     4.700     0.000 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.044 ppm2      0.961 CV     1
 ASSI { 1461}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 66   and name HG2%)))
      3.300     1.600     1.600 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.11721E-02 ppm1      4.943 ppm2      1.135 CV     1
 ASSI { 1463}
   (( segid "    " and resid 49   and name HE3 ))
   (( segid "    " and resid 49   and name HG3 ))
      3.000     1.300     1.300 peak  1463 spectrum    1 weight  0.10000E+01 volume  0.20352E-02 ppm1      3.072 ppm2      1.022 CV     1
 OR { 1463}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 49   and name HG3 ))
 ASSI { 1465}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 57   and name HD1%)))
      2.500     1.000     1.000 peak  1465 spectrum    1 weight  0.10000E+01 volume  0.58833E-02 ppm1      3.408 ppm2      0.676 CV     1
 ASSI { 1466}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HD1%)))
      6.000     4.700     0.000 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.084 ppm2      0.677 CV     1
 ASSI { 1467}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
      2.200     0.800     0.800 peak  1467 spectrum    1 weight  0.10000E+01 volume  0.14880E-01 ppm1      4.522 ppm2      1.423 CV     1
 ASSI { 1473}
   (( segid "    " and resid 659  and name HD2 ))
   (( segid "    " and resid 658  and name HB3 ))
      3.600     1.800     1.800 peak  1473 spectrum    1 weight  0.10000E+01 volume  0.72798E-03 ppm1      3.800 ppm2      2.557 CV     1
 ASSI { 1474}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 29   and name HG3 ))
      6.000     4.700     0.000 peak  1474 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.257 ppm2      1.011 CV     1
 ASSI { 1475}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
      6.000     4.700     0.000 peak  1475 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.944 ppm2      2.090 CV     1
 ASSI { 1478}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 57   and name HD1%)))
      2.700     1.100     1.100 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.36399E-02 ppm1      4.937 ppm2      0.676 CV     1
 ASSI { 1480}
   (( segid "    " and resid 666  and name HA  ))
   (( segid "    " and resid 66   and name HG2%)))
      6.000     4.700     0.000 peak  1480 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.759 ppm2      1.135 CV     1
 ASSI { 1482}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 71   and name HG2%)))
      3.400     1.700     1.700 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.97064E-03 ppm1      4.164 ppm2      0.581 CV     1
 ASSI { 1483}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HB3 ))
      2.800     1.200     1.200 peak  1483 spectrum    1 weight  0.10000E+01 volume  0.34110E-02 ppm1      4.649 ppm2      1.747 CV     1
 ASSI { 1484}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HG13))))
      6.000     4.700     0.000 peak  1484 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.614 ppm2      0.928 CV     1
 ASSI { 1485}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HD1%)))
      6.000     4.700     0.000 peak  1485 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.614 ppm2      0.641 CV     1
 ASSI { 1487}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB  ))
      6.000     4.700     0.000 peak  1487 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.618 ppm2      1.689 CV     1
 ASSI { 1488}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 72   and name HD1%)))
      2.800     1.200     1.200 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.32736E-02 ppm1      2.544 ppm2      1.102 CV     1
 OR { 1488}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 72   and name HD2%)))
 ASSI { 1489}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 72   and name HD1%)))
      2.900     1.200     1.200 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.28845E-02 ppm1      3.784 ppm2      1.102 CV     1
 ASSI { 1491}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 57   and name HD1%)))
      2.800     1.200     1.200 peak  1491 spectrum    1 weight  0.10000E+01 volume  0.31363E-02 ppm1      2.894 ppm2      0.676 CV     1
 ASSI { 1493}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HB2 ))
      2.600     1.100     1.100 peak  1493 spectrum    1 weight  0.10000E+01 volume  0.45556E-02 ppm1      3.240 ppm2      2.088 CV     1
 OR { 1493}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name HB2 ))
 ASSI { 1494}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name HB3 ))
      2.500     1.000     1.000 peak  1494 spectrum    1 weight  0.10000E+01 volume  0.58147E-02 ppm1      3.240 ppm2      1.902 CV     1
 OR { 1494}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HB3 ))
 ASSI { 1495}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB3 ))
      6.000     4.700     0.000 peak  1495 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.771 ppm2      1.902 CV     1
 ASSI { 1496}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
      3.400     1.600     1.600 peak  1496 spectrum    1 weight  0.10000E+01 volume  0.10049E-02 ppm1      3.771 ppm2      2.089 CV     1
 ASSI { 1497}
   (( segid "    " and resid 42   and name HB3 ))
   (( segid "    " and resid 35   and name HD2%)))
      3.800     2.000     2.000 peak  1497 spectrum    1 weight  0.10000E+01 volume  0.53569E-03 ppm1      2.702 ppm2      0.764 CV     1
 ASSI { 1498}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 72   and name HD1%)))
      2.500     1.000     1.000 peak  1498 spectrum    1 weight  0.10000E+01 volume  0.61810E-02 ppm1      1.913 ppm2      1.106 CV     1
 ASSI { 1499}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HG3 ))
      2.900     1.300     1.300 peak  1499 spectrum    1 weight  0.10000E+01 volume  0.25182E-02 ppm1      3.341 ppm2      1.342 CV     1
 ASSI { 1500}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 80   and name HD1%)))
      2.900     1.200     1.200 peak  1500 spectrum    1 weight  0.10000E+01 volume  0.27013E-02 ppm1      2.195 ppm2      0.639 CV     1
 ASSI { 1501}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HB3 ))
      2.100     0.800     0.800 peak  1501 spectrum    1 weight  0.10000E+01 volume  0.15864E-01 ppm1      2.929 ppm2      1.747 CV     1
 ASSI { 1502}
   (( segid "    " and resid 676  and name HE3 ))
   (( segid "    " and resid 676  and name HD2 ))
      6.000     4.700     0.000 peak  1502 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.931 ppm2      1.558 CV     1
 OR { 1502}
   (( segid "    " and resid 676  and name HE2 ))
   (( segid "    " and resid 676  and name HD3 ))
 OR { 1502}
   (( segid "    " and resid 676  and name HE2 ))
   (( segid "    " and resid 676  and name HD2 ))
 OR { 1502}
   (( segid "    " and resid 676  and name HE3 ))
   (( segid "    " and resid 676  and name HD3 ))
 ASSI { 1503}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 78   and name HG2%)))
      3.500     1.700     1.700 peak  1503 spectrum    1 weight  0.10000E+01 volume  0.82642E-03 ppm1      3.610 ppm2      0.834 CV     1
 ASSI { 1504}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 71   and name HG2%)))
      6.000     4.700     0.000 peak  1504 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.610 ppm2      0.582 CV     1
 ASSI { 1506}
   (( segid "    " and resid 673  and name HG13))))
   (( segid "    " and resid 673  and name HG2%)))
      2.100     0.800     0.800 peak  1506 spectrum    1 weight  0.10000E+01 volume  0.15796E-01 ppm1      1.231 ppm2      0.761 CV     1
 ASSI { 1507}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 67   and name HD3 ))
      3.300     1.600     1.600 peak  1507 spectrum    1 weight  0.10000E+01 volume  0.11560E-02 ppm1      1.058 ppm2      0.276 CV     1
 ASSI { 1508}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name HD3 ))
      6.000     4.700     0.000 peak  1508 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.651 ppm2      0.274 CV     1
 ASSI { 1509}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HD3 ))
      6.000     4.700     0.000 peak  1509 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.435 ppm2      0.281 CV     1
 ASSI { 1510}
   (( segid "    " and resid 67   and name HE3 ))
   (( segid "    " and resid 67   and name HD3 ))
      2.700     1.100     1.100 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.38689E-02 ppm1      2.382 ppm2      0.272 CV     1
 OR { 1510}
   (( segid "    " and resid 67   and name HE2 ))
   (( segid "    " and resid 67   and name HD3 ))
 ASSI { 1511}
   (( segid "    " and resid 67   and name HE3 ))
   (( segid "    " and resid 67   and name HD2 ))
      2.600     1.000     1.000 peak  1511 spectrum    1 weight  0.10000E+01 volume  0.56087E-02 ppm1      2.378 ppm2      0.658 CV     1
 OR { 1511}
   (( segid "    " and resid 67   and name HE2 ))
   (( segid "    " and resid 67   and name HG3 ))
 OR { 1511}
   (( segid "    " and resid 67   and name HE2 ))
   (( segid "    " and resid 67   and name HD2 ))
 ASSI { 1512}
   (( segid "    " and resid 67   and name HE2 ))
   (( segid "    " and resid 67   and name HG2 ))
      3.400     1.700     1.700 peak  1512 spectrum    1 weight  0.10000E+01 volume  0.99354E-03 ppm1      2.379 ppm2      0.882 CV     1
 OR { 1512}
   (( segid "    " and resid 67   and name HE3 ))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI { 1513}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 71   and name HG2%)))
      4.000     2.200     2.000 peak  1513 spectrum    1 weight  0.10000E+01 volume  0.39604E-03 ppm1      6.142 ppm2      0.582 CV     1
 ASSI { 1514}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 71   and name HG2%)))
      3.900     2.100     2.100 peak  1514 spectrum    1 weight  0.10000E+01 volume  0.41893E-03 ppm1      5.539 ppm2      0.584 CV     1
 ASSI { 1516}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 48   and name HG  ))
      3.200     1.500     1.500 peak  1516 spectrum    1 weight  0.10000E+01 volume  0.15177E-02 ppm1      3.464 ppm2      0.584 CV     1
 ASSI { 1517}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 71   and name HG2%)))
      2.300     0.900     0.900 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.10737E-01 ppm1      1.692 ppm2      0.584 CV     1
 ASSI { 1518}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HG  ))
      2.200     0.800     0.800 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.14422E-01 ppm1      1.582 ppm2      0.584 CV     1
 ASSI { 1520}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 71   and name HD1%)))
      6.000     4.700     0.000 peak  1520 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.568 ppm2      0.645 CV     1
 ASSI { 1523}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 49   and name HE2 ))
      3.000     1.300     1.300 peak  1523 spectrum    1 weight  0.10000E+01 volume  0.22893E-02 ppm1      4.444 ppm2      3.067 CV     1
 OR { 1523}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 49   and name HE3 ))
 ASSI { 1524}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 79   and name HB3 ))
      2.900     1.300     1.300 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.26097E-02 ppm1      4.754 ppm2      1.815 CV     1
 ASSI { 1525}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
      2.800     1.200     1.200 peak  1525 spectrum    1 weight  0.10000E+01 volume  0.29761E-02 ppm1      4.752 ppm2      1.914 CV     1
 ASSI { 1527}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 60   and name HG13))))
      3.400     1.700     1.700 peak  1527 spectrum    1 weight  0.10000E+01 volume  0.93405E-03 ppm1      2.609 ppm2      1.255 CV     1
 ASSI { 1528}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 72   and name HD2%)))
      2.800     1.200     1.200 peak  1528 spectrum    1 weight  0.10000E+01 volume  0.29989E-02 ppm1      2.340 ppm2      1.109 CV     1
 ASSI { 1529}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 30   and name HG2%)))
      3.100     1.400     1.400 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.15979E-02 ppm1      3.366 ppm2      0.895 CV     1
 ASSI { 1534}
   (( segid "    " and resid 33   and name HD2 ))
   (( segid "    " and resid 33   and name HB2 ))
      6.000     4.700     0.000 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.923 ppm2      1.817 CV     1
 ASSI { 1536}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB2 ))
      6.000     4.700     0.000 peak  1536 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.405 ppm2      3.356 CV     1
 ASSI { 1538}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HD2 ))
      6.000     4.700     0.000 peak  1538 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.329 ppm2      0.704 CV     1
 ASSI { 1539}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 673  and name HD1%)))
      2.500     1.000     1.000 peak  1539 spectrum    1 weight  0.10000E+01 volume  0.57918E-02 ppm1      4.371 ppm2      0.815 CV     1
 ASSI { 1540}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 35   and name HD2%)))
      6.000     4.700     0.000 peak  1540 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.375 ppm2      0.769 CV     1
 ASSI { 1544}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 49   and name HD2 ))
      6.000     4.700     0.000 peak  1544 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.130 ppm2      1.678 CV     1
 OR { 1544}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 49   and name HD3 ))
 ASSI { 1545}
   (( segid "    " and resid 653  and name HA  ))
   (( segid "    " and resid 653  and name HB  ))
      6.000     4.700     0.000 peak  1545 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.026 ppm2      1.726 CV     1
 ASSI { 1548}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 54   and name HG3 ))
      6.000     4.700     0.000 peak  1548 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.963 ppm2      2.220 CV     1
 ASSI { 1549}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 57   and name HD1%)))
      2.700     1.100     1.100 peak  1549 spectrum    1 weight  0.10000E+01 volume  0.39604E-02 ppm1      3.466 ppm2      0.674 CV     1
 ASSI { 1553}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 80   and name HD2%)))
      3.400     1.600     1.600 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.10416E-02 ppm1      2.196 ppm2      0.561 CV     1
 ASSI { 1554}
   (( segid "    " and resid 37   and name HE% ))
   (( segid "    " and resid 40   and name HN  ))
      3.200     1.500     1.500 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.14308E-02 ppm1      6.400 ppm2      8.576 CV     1
 ASSI { 1555}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HN  ))
      6.000     4.700     0.000 peak  1555 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.960 ppm2      8.576 CV     1
 ASSI { 1556}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB3 ))
      6.000     4.700     0.000 peak  1556 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.122 ppm2      2.368 CV     1
 ASSI { 1557}
   (( segid "    " and resid 46   and name HD3 ))
   (( segid "    " and resid 46   and name HE  ))
      3.000     1.300     1.300 peak  1557 spectrum    1 weight  0.10000E+01 volume  0.20191E-02 ppm1      3.120 ppm2      7.104 CV     1
 OR { 1557}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HE  ))
 ASSI { 1559}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 81   and name HE% ))
      2.600     1.100     1.100 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.48532E-02 ppm1      2.197 ppm2      7.075 CV     1
 ASSI { 1560}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 81   and name HZ  ))
      2.700     1.100     1.100 peak  1560 spectrum    1 weight  0.10000E+01 volume  0.37315E-02 ppm1      2.197 ppm2      7.031 CV     1
 ASSI { 1561}
   (( segid "    " and resid 663  and name HG  ))
   (( segid "    " and resid 77   and name HE% ))
      6.000     4.700     0.000 peak  1561 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.550 ppm2      6.198 CV     1
 ASSI { 1562}
   (( segid "    " and resid 663  and name HB2 ))
   (( segid "    " and resid 65   and name HD% ))
      2.700     1.100     1.100 peak  1562 spectrum    1 weight  0.10000E+01 volume  0.40977E-02 ppm1      1.611 ppm2      6.487 CV     1
 OR { 1562}
   (( segid "    " and resid 663  and name HB3 ))
   (( segid "    " and resid 65   and name HD% ))
 ASSI { 1563}
   (( segid "    " and resid 663  and name HD2%)))
   (( segid "    " and resid 65   and name HE% ))
      6.000     4.700     0.000 peak  1563 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.697 ppm2      6.425 CV     1
 ASSI { 1564}
   (( segid "    " and resid 663  and name HD1%)))
   (( segid "    " and resid 65   and name HE% ))
      6.000     4.700     0.000 peak  1564 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.645 ppm2      6.425 CV     1
 ASSI { 1565}
   (( segid "    " and resid 30   and name HG13))))
   (( segid "    " and resid 44   and name HN  ))
      6.000     4.700     0.000 peak  1565 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     -0.608 ppm2      9.262 CV     1
 ASSI { 1567}
   (( segid "    " and resid 78   and name HG2%)))
   (( segid "    " and resid 77   and name HE% ))
      6.000     4.700     0.000 peak  1567 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.840 ppm2      6.198 CV     1
 ASSI { 1568}
   (( segid "    " and resid 78   and name HG2%)))
   (( segid "    " and resid 77   and name HD% ))
      6.000     4.700     0.000 peak  1568 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.828 ppm2      6.464 CV     1
 ASSI { 1569}
   (( segid "    " and resid 30   and name HG13))))
   (( segid "    " and resid 44   and name HE1 ))
      3.800     2.000     2.000 peak  1569 spectrum    1 weight  0.10000E+01 volume  0.55629E-03 ppm1     -0.613 ppm2      7.266 CV     1
 ASSI { 1570}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 44   and name HE1 ))
      6.000     4.700     0.000 peak  1570 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.352 ppm2      7.268 CV     1
 ASSI { 1571}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 44   and name HE1 ))
      6.000     4.700     0.000 peak  1571 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.265 ppm2      7.266 CV     1
 ASSI { 1572}
   (( segid "    " and resid 669  and name HB2 ))
   (( segid "    " and resid 669  and name HN  ))
      6.000     4.700     0.000 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.619 ppm2      8.511 CV     1
 ASSI { 1573}
   (( segid "    " and resid 669  and name HB2 ))
   (( segid "    " and resid 670  and name HN  ))
      6.000     4.700     0.000 peak  1573 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.619 ppm2      8.428 CV     1
 ASSI { 1574}
   (( segid "    " and resid 668  and name HA  ))
   (( segid "    " and resid 669  and name HB3 ))
      3.200     1.500     1.500 peak  1574 spectrum    1 weight  0.10000E+01 volume  0.13713E-02 ppm1      4.298 ppm2      2.501 CV     1
 ASSI { 1575}
   (( segid "    " and resid 668  and name HA  ))
   (( segid "    " and resid 669  and name HB2 ))
      6.000     4.700     0.000 peak  1575 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.297 ppm2      2.619 CV     1
 ASSI { 1576}
   (( segid "    " and resid 67   and name HE2 ))
   (( segid "    " and resid 666  and name HE% ))
      3.100     1.400     1.400 peak  1576 spectrum    1 weight  0.10000E+01 volume  0.19000E-02 ppm1      2.374 ppm2      6.819 CV     1
 OR { 1576}
   (( segid "    " and resid 67   and name HE3 ))
   (( segid "    " and resid 666  and name HE% ))
 ASSI { 1580}
   (( segid "    " and resid 44   and name HE1 ))
   (( segid "    " and resid 44   and name HD2 ))
      4.000     2.200     2.000 peak  1580 spectrum    1 weight  0.10000E+01 volume  0.37315E-03 ppm1      7.271 ppm2      7.872 CV     1
 ASSI { 1582}
   (( segid "    " and resid 658  and name HB3 ))
   (( segid "    " and resid 661  and name HN  ))
      6.000     4.700     0.000 peak  1582 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.554 ppm2      7.927 CV     1
 ASSI { 1583}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 43   and name HE1 ))
      6.000     4.700     0.000 peak  1583 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.114 ppm2      9.560 CV     1
 ASSI { 1584}
   (( segid "    " and resid 668  and name HG3 ))
   (( segid "    " and resid 66   and name HG2%)))
      6.000     4.700     0.000 peak  1584 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.196 ppm2      1.136 CV     1
 OR { 1584}
   (( segid "    " and resid 668  and name HG2 ))
   (( segid "    " and resid 66   and name HG2%)))
 ASSI { 1585}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 39   and name HB3 ))
      2.300     0.800     0.800 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.11950E-01 ppm1      2.496 ppm2      2.117 CV     1
 OR { 1585}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 39   and name HB3 ))
 ASSI { 1586}
   (( segid "    " and resid 67   and name HE3 ))
   (( segid "    " and resid 81   and name HD% ))
      2.700     1.100     1.100 peak  1586 spectrum    1 weight  0.10000E+01 volume  0.40977E-02 ppm1      2.374 ppm2      6.852 CV     1
 OR { 1586}
   (( segid "    " and resid 67   and name HE2 ))
   (( segid "    " and resid 81   and name HD% ))
 ASSI { 1587}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      6.000     4.700     0.000 peak  1587 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.702 ppm2      8.817 CV     1
 ASSI { 1588}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 32   and name HN  ))
      4.400     2.600     1.600 peak  1588 spectrum    1 weight  0.10000E+01 volume  0.22801E-03 ppm1      0.420 ppm2      6.775 CV     1
 ASSI { 1589}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 33   and name HE  ))
      3.000     1.300     1.300 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.20833E-02 ppm1      0.367 ppm2      8.058 CV     1
 ASSI { 1590}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 33   and name HE  ))
      6.000     4.700     0.000 peak  1590 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.133 ppm2      8.058 CV     1
 ASSI { 1591}
   (( segid "    " and resid 33   and name HD2 ))
   (( segid "    " and resid 33   and name HE  ))
      6.000     4.700     0.000 peak  1591 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.927 ppm2      8.058 CV     1
 ASSI { 1592}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 43   and name HH2 ))
      6.000     4.700     0.000 peak  1592 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.523 ppm2      7.202 CV     1
 ASSI { 1593}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 43   and name HZ2 ))
      6.000     4.700     0.000 peak  1593 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.523 ppm2      7.060 CV     1
 ASSI { 1594}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 43   and name HZ2 ))
      6.000     4.700     0.000 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.576 ppm2      7.060 CV     1
 ASSI { 1595}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 43   and name HH2 ))
      6.000     4.700     0.000 peak  1595 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.576 ppm2      7.204 CV     1
 ASSI { 1596}
   (( segid "    " and resid 43   and name HH2 ))
   (( segid "    " and resid 43   and name HE1 ))
      4.000     2.200     2.000 peak  1596 spectrum    1 weight  0.10000E+01 volume  0.38460E-03 ppm1      7.200 ppm2      9.560 CV     1
 ASSI { 1599}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HG  ))
      3.100     1.400     1.400 peak  1599 spectrum    1 weight  0.10000E+01 volume  0.16231E-02 ppm1      6.142 ppm2      1.568 CV     1
 ASSI { 1600}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 51   and name HN  ))
      6.000     4.700     0.000 peak  1600 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.569 ppm2     10.074 CV     1
 ASSI { 1601}
   (( segid "    " and resid 72   and name HD1%)))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.700     0.000 peak  1601 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.101 ppm2      8.996 CV     1
 OR { 1601}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 73   and name HN  ))
 ASSI { 1602}
   (( segid "    " and resid 57   and name HD2%)))
   (( segid "    " and resid 72   and name HN  ))
      6.000     4.700     0.000 peak  1602 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.419 ppm2      9.479 CV     1
 ASSI { 1603}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      2.900     1.200     1.200 peak  1603 spectrum    1 weight  0.10000E+01 volume  0.27699E-02 ppm1      4.146 ppm2     10.032 CV     1
 ASSI { 1604}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      2.500     1.000     1.000 peak  1604 spectrum    1 weight  0.10000E+01 volume  0.60894E-02 ppm1      5.042 ppm2     10.031 CV     1
 ASSI { 1605}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      3.500     1.800     1.800 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.79437E-03 ppm1      5.040 ppm2      7.981 CV     1
 ASSI { 1606}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.700     0.000 peak  1606 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.146 ppm2      7.033 CV     1
 ASSI { 1607}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 48   and name HD1%)))
      4.100     2.300     1.900 peak  1607 spectrum    1 weight  0.10000E+01 volume  0.32507E-03 ppm1      4.146 ppm2      0.115 CV     1
 ASSI { 1612}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 36   and name HN  ))
      3.000     1.300     1.300 peak  1612 spectrum    1 weight  0.10000E+01 volume  0.21313E-02 ppm1      1.633 ppm2      8.784 CV     1
 ASSI { 1613}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HG  ))
      3.200     1.500     1.500 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.14949E-02 ppm1      5.607 ppm2      1.638 CV     1
 ASSI { 1614}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 37   and name HN  ))
      6.000     4.700     0.000 peak  1614 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.633 ppm2      9.310 CV     1
 ASSI { 1615}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HD1%)))
      6.000     4.700     0.000 peak  1615 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      5.607 ppm2      0.894 CV     1
 ASSI { 1617}
   (( segid "    " and resid 37   and name HE% ))
   (( segid "    " and resid 37   and name HN  ))
      6.000     4.700     0.000 peak  1617 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.401 ppm2      9.309 CV     1
 ASSI { 1618}
   (( segid "    " and resid 680  and name HG2 ))
   (( segid "    " and resid 682  and name HN  ))
      4.100     2.300     1.900 peak  1618 spectrum    1 weight  0.10000E+01 volume  0.31134E-03 ppm1      2.335 ppm2      8.324 CV     1
 ASSI { 1619}
   (( segid "    " and resid 903  and name HB3 ))
   (( segid "    " and resid 903  and name HN  ))
      2.800     1.200     1.200 peak  1619 spectrum    1 weight  0.10000E+01 volume  0.35025E-02 ppm1      3.981 ppm2      7.194 CV     1
 ASSI { 1621}
   (( segid "    " and resid 907  and name HG2 ))
   (( segid "    " and resid 907  and name HB3 ))
      6.000     4.700     0.000 peak  1621 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.482 ppm2      1.926 CV     1
 ASSI { 1622}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 39   and name HE% ))
      3.300     1.600     1.600 peak  1622 spectrum    1 weight  0.10000E+01 volume  0.11149E-02 ppm1      2.496 ppm2      1.581 CV     1
 OR { 1622}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 39   and name HE% ))
 ASSI { 1623}
   (( segid "    " and resid 46   and name HD3 ))
   (( segid "    " and resid 46   and name HG3 ))
      6.000     4.700     0.000 peak  1623 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.122 ppm2      1.625 CV     1
 OR { 1623}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HG3 ))
 ASSI { 1624}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 49   and name HD2 ))
      6.000     4.700     0.000 peak  1624 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.073 ppm2      1.672 CV     1
 OR { 1624}
   (( segid "    " and resid 49   and name HE3 ))
   (( segid "    " and resid 49   and name HD3 ))
 OR { 1624}
   (( segid "    " and resid 49   and name HE3 ))
   (( segid "    " and resid 49   and name HD2 ))
 ASSI { 1626}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB3 ))
      2.600     1.000     1.000 peak  1626 spectrum    1 weight  0.10000E+01 volume  0.51508E-02 ppm1      3.859 ppm2      1.813 CV     1
 ASSI { 1627}
   (( segid "    " and resid 674  and name HA  ))
   (( segid "    " and resid 34   and name HA  ))
      6.000     4.700     0.000 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.775 ppm2      5.823 CV     1
 ASSI { 1628}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 66   and name HA  ))
      3.700     1.900     1.900 peak  1628 spectrum    1 weight  0.10000E+01 volume  0.63183E-03 ppm1      4.615 ppm2      5.543 CV     1
 ASSI { 1629}
   (( segid "    " and resid 672  and name HA  ))
   (( segid "    " and resid 36   and name HA  ))
      3.200     1.500     1.500 peak  1629 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      4.550 ppm2      5.607 CV     1
 ASSI { 1632}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     4.700     0.000 peak  1632 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.617 ppm2      6.141 CV     1
 ASSI { 1633}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 72   and name HA  ))
      3.000     1.300     1.300 peak  1633 spectrum    1 weight  0.10000E+01 volume  0.20260E-02 ppm1      4.257 ppm2      6.141 CV     1
 ASSI { 1635}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     4.700     0.000 peak  1635 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.407 ppm2      6.141 CV     1
 ASSI { 1637}
   (( segid "    " and resid 675  and name HA  ))
   (( segid "    " and resid 677  and name HN  ))
      4.200     2.400     1.800 peak  1637 spectrum    1 weight  0.10000E+01 volume  0.26784E-03 ppm1      4.049 ppm2      7.616 CV     1
 ASSI { 1639}
   (( segid "    " and resid 34   and name HE% ))
   (( segid "    " and resid 33   and name HE  ))
      3.800     2.000     2.000 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.49448E-03 ppm1      7.340 ppm2      8.061 CV     1
 ASSI { 1640}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 49   and name HN  ))
      4.200     2.400     1.800 peak  1640 spectrum    1 weight  0.10000E+01 volume  0.28387E-03 ppm1      0.117 ppm2      7.463 CV     1
 ASSI { 1641}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 42   and name HD% ))
      4.300     2.500     1.700 peak  1641 spectrum    1 weight  0.10000E+01 volume  0.25639E-03 ppm1      0.551 ppm2      7.224 CV     1
 ASSI { 1643}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 20   and name HH2 ))
      3.600     1.800     1.800 peak  1643 spectrum    1 weight  0.10000E+01 volume  0.75545E-03 ppm1      4.462 ppm2      7.192 CV     1
 ASSI { 1644}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 673  and name HD1%)))
      3.200     1.500     1.500 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.15406E-02 ppm1      2.881 ppm2      0.814 CV     1
 ASSI { 1645}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 673  and name HD1%)))
      3.100     1.400     1.400 peak  1645 spectrum    1 weight  0.10000E+01 volume  0.17811E-02 ppm1      2.678 ppm2      0.814 CV     1
 ASSI { 1647}
   (( segid "    " and resid 673  and name HD1%)))
   (( segid "    " and resid 674  and name HN  ))
      6.000     4.700     0.000 peak  1647 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.815 ppm2      8.681 CV     1
 ASSI { 1648}
   (( segid "    " and resid 673  and name HG12))))
   (( segid "    " and resid 674  and name HN  ))
      6.000     4.700     0.000 peak  1648 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.488 ppm2      8.681 CV     1
 ASSI { 1649}
   (( segid "    " and resid 673  and name HG13))))
   (( segid "    " and resid 674  and name HN  ))
      6.000     4.700     0.000 peak  1649 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.251 ppm2      8.681 CV     1
 ASSI { 1650}
   (( segid "    " and resid 673  and name HB  ))
   (( segid "    " and resid 674  and name HN  ))
      6.000     4.700     0.000 peak  1650 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.891 ppm2      8.681 CV     1
 ASSI { 1652}
   (( segid "    " and resid 673  and name HD1%)))
   (( segid "    " and resid 37   and name HD% ))
      2.400     0.900     0.900 peak  1652 spectrum    1 weight  0.10000E+01 volume  0.73943E-02 ppm1      0.815 ppm2      6.706 CV     1
 ASSI { 1653}
   (( segid "    " and resid 673  and name HD1%)))
   (( segid "    " and resid 37   and name HE% ))
      2.800     1.200     1.200 peak  1653 spectrum    1 weight  0.10000E+01 volume  0.32965E-02 ppm1      0.815 ppm2      6.399 CV     1
 ASSI { 1655}
   (( segid "    " and resid 673  and name HG12))))
   (( segid "    " and resid 37   and name HE% ))
      6.000     4.700     0.000 peak  1655 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.488 ppm2      6.399 CV     1
 ASSI { 1656}
   (( segid "    " and resid 673  and name HG13))))
   (( segid "    " and resid 673  and name HD1%)))
      6.000     4.700     0.000 peak  1656 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.251 ppm2      0.814 CV     1
 ASSI { 1657}
   (( segid "    " and resid 673  and name HB  ))
   (( segid "    " and resid 673  and name HD1%)))
      6.000     4.700     0.000 peak  1657 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.893 ppm2      0.816 CV     1
 ASSI { 1658}
   (( segid "    " and resid 673  and name HB  ))
   (( segid "    " and resid 673  and name HG12))))
      6.000     4.700     0.000 peak  1658 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.893 ppm2      1.486 CV     1
 ASSI { 1659}
   (( segid "    " and resid 673  and name HA  ))
   (( segid "    " and resid 673  and name HG13))))
      6.000     4.700     0.000 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.374 ppm2      1.254 CV     1
 ASSI { 1661}
   (( segid "    " and resid 903  and name HA  ))
   (( segid "    " and resid 903  and name HN  ))
      6.000     4.700     0.000 peak  1661 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.574 ppm2      7.199 CV     1
 ASSI { 1662}
   (( segid "    " and resid 903  and name HB2 ))
   (( segid "    " and resid 903  and name HN  ))
      6.000     4.700     0.000 peak  1662 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.541 ppm2      7.199 CV     1
 ASSI { 1663}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 65   and name HE% ))
      2.900     1.300     1.300 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.23808E-02 ppm1      1.465 ppm2      6.427 CV     1
 ASSI { 1664}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 77   and name HD% ))
      6.000     4.700     0.000 peak  1664 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.705 ppm2      6.466 CV     1
 ASSI { 1665}
   (( segid "    " and resid 664  and name HA  ))
   (( segid "    " and resid 65   and name HE% ))
      3.600     1.800     1.800 peak  1665 spectrum    1 weight  0.10000E+01 volume  0.77606E-03 ppm1      4.179 ppm2      6.426 CV     1
 ASSI { 1666}
   (( segid "    " and resid 657  and name HD1%)))
   (( segid "    " and resid 655  and name HE1 ))
      6.000     4.700     0.000 peak  1666 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.838 ppm2     10.105 CV     1
 ASSI { 1667}
   (( segid "    " and resid 676  and name HG3 ))
   (( segid "    " and resid 680  and name HE21))))
      6.000     4.700     0.000 peak  1667 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.268 ppm2      7.527 CV     1
 ASSI { 1668}
   (( segid "    " and resid 683  and name HD2%)))
   (( segid "    " and resid 680  and name HE21))))
      6.000     4.700     0.000 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.765 ppm2      7.529 CV     1
 ASSI { 1669}
   (( segid "    " and resid 36   and name HD1%)))
   (( segid "    " and resid 48   and name HD2%)))
      6.000     4.700     0.000 peak  1669 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.894 ppm2     -0.814 CV     1
 ASSI { 1670}
   (( segid "    " and resid 670  and name HG1%)))
   (( segid "    " and resid 48   and name HD2%)))
      6.000     4.700     0.000 peak  1670 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.716 ppm2     -0.813 CV     1
 ASSI { 1672}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 668  and name HE% ))
      6.000     4.700     0.000 peak  1672 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.492 ppm2      2.003 CV     1
 OR { 1672}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 668  and name HE% ))
 ASSI { 1673}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 668  and name HE% ))
      6.000     4.700     0.000 peak  1673 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.393 ppm2      2.000 CV     1
 ASSI { 1674}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 39   and name HB2 ))
      6.000     4.700     0.000 peak  1674 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.495 ppm2      2.397 CV     1
 OR { 1674}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 39   and name HB2 ))
 ASSI { 1676}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HE% ))
      6.000     4.700     0.000 peak  1676 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.636 ppm2      2.196 CV     1
 ASSI { 1677}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HE% ))
      6.000     4.700     0.000 peak  1677 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.647 ppm2      2.196 CV     1
 ASSI { 1678}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 70   and name HN  ))
      6.000     4.700     0.000 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.193 ppm2      7.995 CV     1
 ASSI { 1679}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HB3 ))
      6.000     4.700     0.000 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.636 ppm2      1.920 CV     1
 ASSI { 1680}
   (( segid "    " and resid 70   and name HG3 ))
   (( segid "    " and resid 70   and name HB3 ))
      6.000     4.700     0.000 peak  1680 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.577 ppm2      1.920 CV     1
 ASSI { 1681}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HB3 ))
      6.000     4.700     0.000 peak  1681 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.340 ppm2      1.920 CV     1
 ASSI { 1682}
   (( segid "    " and resid 668  and name HG2 ))
   (( segid "    " and resid 668  and name HB3 ))
      6.000     4.700     0.000 peak  1682 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.200 ppm2      1.402 CV     1
 OR { 1682}
   (( segid "    " and resid 668  and name HG3 ))
   (( segid "    " and resid 668  and name HB3 ))
 ASSI { 1683}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 72   and name HD2%)))
      6.000     4.700     0.000 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.197 ppm2      1.106 CV     1
 ASSI { 1684}
   (( segid "    " and resid 668  and name HG3 ))
   (( segid "    " and resid 39   and name HE% ))
      6.000     4.700     0.000 peak  1684 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.197 ppm2      1.580 CV     1
 OR { 1684}
   (( segid "    " and resid 668  and name HG2 ))
   (( segid "    " and resid 39   and name HE% ))
 ASSI { 1685}
   (( segid "    " and resid 668  and name HG3 ))
   (( segid "    " and resid 668  and name HB2 ))
      6.000     4.700     0.000 peak  1685 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.197 ppm2      1.809 CV     1
 OR { 1685}
   (( segid "    " and resid 668  and name HG2 ))
   (( segid "    " and resid 668  and name HB2 ))
 ASSI { 1686}
   (( segid "    " and resid 668  and name HE% ))
   (( segid "    " and resid 66   and name HG2%)))
      6.000     4.700     0.000 peak  1686 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.999 ppm2      1.136 CV     1
 ASSI { 1687}
   (( segid "    " and resid 668  and name HE% ))
   (( segid "    " and resid 71   and name HD1%)))
      6.000     4.700     0.000 peak  1687 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.999 ppm2      0.645 CV     1
 ASSI { 1688}
   (( segid "    " and resid 668  and name HE% ))
   (( segid "    " and resid 71   and name HG2%)))
      6.000     4.700     0.000 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.998 ppm2      0.583 CV     1
 ASSI { 1689}
   (( segid "    " and resid 668  and name HE% ))
   (( segid "    " and resid 39   and name HE% ))
      6.000     4.700     0.000 peak  1689 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.996 ppm2      1.579 CV     1
 ASSI { 1690}
   (( segid "    " and resid 668  and name HE% ))
   (( segid "    " and resid 43   and name HZ2 ))
      6.000     4.700     0.000 peak  1690 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.002 ppm2      7.060 CV     1
 ASSI { 1691}
   (( segid "    " and resid 668  and name HE% ))
   (( segid "    " and resid 39   and name HN  ))
      6.000     4.700     0.000 peak  1691 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.002 ppm2      9.862 CV     1
 ASSI { 1692}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 39   and name HN  ))
      6.000     4.700     0.000 peak  1692 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.579 ppm2      9.860 CV     1
 ASSI { 1693}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name HN  ))
      6.000     4.700     0.000 peak  1693 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.579 ppm2      8.951 CV     1
 ASSI { 1694}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HB3 ))
      6.000     4.700     0.000 peak  1694 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.395 ppm2      2.117 CV     1
 ASSI { 1695}
   (( segid "    " and resid 907  and name HA  ))
   (( segid "    " and resid 907  and name HB2 ))
      6.000     4.700     0.000 peak  1695 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.426 ppm2      2.016 CV     1
 ASSI { 1696}
   (( segid "    " and resid 907  and name HA  ))
   (( segid "    " and resid 907  and name HG2 ))
      6.000     4.700     0.000 peak  1696 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.426 ppm2      2.485 CV     1
 ASSI { 1697}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HG2 ))
      2.700     1.100     1.100 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.38460E-02 ppm1      2.086 ppm2      1.580 CV     1
 ASSI { 1698}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HG3 ))
      6.000     4.700     0.000 peak  1698 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.088 ppm2      1.463 CV     1
 ASSI { 1700}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HG2 ))
      6.000     4.700     0.000 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.246 ppm2      1.576 CV     1
 OR { 1700}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name HG2 ))
 ASSI { 1701}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name HG3 ))
      6.000     4.700     0.000 peak  1701 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.248 ppm2      1.468 CV     1
 OR { 1701}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HG3 ))
 ASSI { 1702}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HG3 ))
      6.000     4.700     0.000 peak  1702 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.768 ppm2      1.465 CV     1
 ASSI { 1703}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HG2 ))
      6.000     4.700     0.000 peak  1703 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.768 ppm2      1.582 CV     1
 ASSI { 1704}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 55   and name HN  ))
      6.000     4.700     0.000 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.217 ppm2      8.862 CV     1
 ASSI { 1705}
   (( segid "    " and resid 680  and name HG3 ))
   (( segid "    " and resid 680  and name HN  ))
      6.000     4.700     0.000 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.368 ppm2      8.382 CV     1
 ASSI { 1706}
   (( segid "    " and resid 680  and name HG3 ))
   (( segid "    " and resid 680  and name HE21))))
      6.000     4.700     0.000 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.368 ppm2      7.532 CV     1
 ASSI { 1707}
   (( segid "    " and resid 680  and name HA  ))
   (( segid "    " and resid 680  and name HG3 ))
      6.000     4.700     0.000 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.529 ppm2      2.373 CV     1
 ASSI { 1708}
   (( segid "    " and resid 680  and name HG3 ))
   (( segid "    " and resid 680  and name HG2 ))
      6.000     4.700     0.000 peak  1708 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.368 ppm2      2.317 CV     1
 ASSI { 1709}
   (( segid "    " and resid 54   and name HG2 ))
   (( segid "    " and resid 54   and name HN  ))
      6.000     4.700     0.000 peak  1709 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.312 ppm2      7.965 CV     1
 ASSI { 1710}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 54   and name HN  ))
      6.000     4.700     0.000 peak  1710 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.369 ppm2      7.964 CV     1
 ASSI { 1711}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 54   and name HG2 ))
      6.000     4.700     0.000 peak  1711 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.974 ppm2      2.314 CV     1
 ASSI { 1712}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HB3 ))
      6.000     4.700     0.000 peak  1712 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.232 ppm2      2.044 CV     1
 ASSI { 1713}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 79   and name HG3 ))
      6.000     4.700     0.000 peak  1713 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.818 ppm2      1.348 CV     1
 ASSI { 1714}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
      6.000     4.700     0.000 peak  1714 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.857 ppm2      1.914 CV     1
 ASSI { 1715}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HB2 ))
      2.700     1.100     1.100 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.38002E-02 ppm1      4.539 ppm2      3.701 CV     1
 OR { 1715}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HB3 ))
 ASSI { 1716}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 54   and name HE22))))
      6.000     4.700     0.000 peak  1716 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.311 ppm2      6.686 CV     1
 ASSI { 1717}
   (( segid "    " and resid 664  and name HA  ))
   (( segid "    " and resid 667  and name HN  ))
      6.000     4.700     0.000 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.184 ppm2      7.194 CV     1
 ASSI { 1718}
   (( segid "    " and resid 78   and name HD1%)))
   (( segid "    " and resid 77   and name HE% ))
      6.000     4.700     0.000 peak  1718 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.846 ppm2      6.197 CV     1
 ASSI { 1719}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HD2%)))
      6.000     4.700     0.000 peak  1719 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.184 ppm2      0.556 CV     1
 ASSI { 1720}
   (( segid "    " and resid 80   and name HG  ))
   (( segid "    " and resid 80   and name HB2 ))
      6.000     4.700     0.000 peak  1720 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.416 ppm2      1.184 CV     1
 ASSI { 1721}
   (( segid "    " and resid 667  and name HE3 ))
   (( segid "    " and resid 667  and name HD2 ))
      6.000     4.700     0.000 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.955 ppm2      1.183 CV     1
 OR { 1721}
   (( segid "    " and resid 667  and name HE2 ))
   (( segid "    " and resid 667  and name HD3 ))
 OR { 1721}
   (( segid "    " and resid 667  and name HE3 ))
   (( segid "    " and resid 667  and name HD3 ))
 OR { 1721}
   (( segid "    " and resid 667  and name HE2 ))
   (( segid "    " and resid 667  and name HD2 ))
 OR { 1721}
   (( segid "    " and resid 667  and name HE2 ))
   (( segid "    " and resid 667  and name HG2 ))
 OR { 1721}
   (( segid "    " and resid 667  and name HE2 ))
   (( segid "    " and resid 667  and name HG3 ))
 ASSI { 1722}
   (( segid "    " and resid 30   and name HG12))))
   (( segid "    " and resid 44   and name HD2 ))
      6.000     4.700     0.000 peak  1722 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.273 ppm2      7.871 CV     1
 ASSI { 1724}
   (( segid "    " and resid 30   and name HG12))))
   (( segid "    " and resid 44   and name HE1 ))
      6.000     4.700     0.000 peak  1724 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.258 ppm2      7.264 CV     1
 ASSI { 1725}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 44   and name HD2 ))
      6.000     4.700     0.000 peak  1725 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.776 ppm2      7.873 CV     1
 ASSI { 1727}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      3.200     1.500     1.500 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.14880E-02 ppm1      5.040 ppm2      8.405 CV     1
 ASSI { 1728}
   (( segid "    " and resid 57   and name HD2%)))
   (( segid "    " and resid 57   and name HN  ))
      6.000     4.700     0.000 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.420 ppm2      8.403 CV     1
 ASSI { 1729}
   (( segid "    " and resid 57   and name HD1%)))
   (( segid "    " and resid 57   and name HN  ))
      6.000     4.700     0.000 peak  1729 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.676 ppm2      8.404 CV     1
 ASSI { 1730}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      6.000     4.700     0.000 peak  1730 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.402 ppm2      8.606 CV     1
 ASSI { 1731}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 58   and name HN  ))
      6.000     4.700     0.000 peak  1731 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.081 ppm2      8.608 CV     1
 ASSI { 1732}
   (( segid "    " and resid 910  and name HA1 ))
   (( segid "    " and resid 910  and name HN  ))
      6.000     4.700     0.000 peak  1732 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.946 ppm2      8.537 CV     1
 OR { 1732}
   (( segid "    " and resid 910  and name HA2 ))
   (( segid "    " and resid 910  and name HN  ))
 ASSI { 1733}
   (( segid "    " and resid 909  and name HB3 ))
   (( segid "    " and resid 910  and name HN  ))
      6.000     4.700     0.000 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.872 ppm2      8.535 CV     1
 OR { 1733}
   (( segid "    " and resid 909  and name HB2 ))
   (( segid "    " and resid 910  and name HN  ))
 ASSI { 1734}
   (( segid "    " and resid 910  and name HA1 ))
   (( segid "    " and resid 911  and name HN  ))
      6.000     4.700     0.000 peak  1734 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.964 ppm2      8.230 CV     1
 OR { 1734}
   (( segid "    " and resid 910  and name HA2 ))
   (( segid "    " and resid 911  and name HN  ))
 ASSI { 1735}
   (( segid "    " and resid 911  and name HA1 ))
   (( segid "    " and resid 911  and name HN  ))
      6.000     4.700     0.000 peak  1735 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.863 ppm2      8.225 CV     1
 OR { 1735}
   (( segid "    " and resid 911  and name HA2 ))
   (( segid "    " and resid 911  and name HN  ))
 ASSI { 1738}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 667  and name HA  ))
      6.000     4.700     0.000 peak  1738 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.939 ppm2      3.834 CV     1
 ASSI { 1739}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.700     0.000 peak  1739 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.933 ppm2      8.528 CV     1
 ASSI { 1740}
   (( segid "    " and resid 666  and name HD% ))
   (( segid "    " and resid 66   and name HN  ))
      6.000     4.700     0.000 peak  1740 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.232 ppm2      8.897 CV     1
 ASSI {    3}
   (( segid "    " and resid 650  and name HN  ))
   (( segid "    " and resid 649  and name HA  ))
      6.000     4.700     0.000 peak     3 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.296 ppm2      4.409 CV     1
 ASSI {    4}
   (( segid "    " and resid 650  and name HN  ))
   (( segid "    " and resid 649  and name HB3 ))
      6.000     4.700     0.000 peak     4 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.296 ppm2      3.801 CV     1
 OR {    4}
   (( segid "    " and resid 650  and name HN  ))
   (( segid "    " and resid 649  and name HB2 ))
 ASSI {    5}
   (( segid "    " and resid 650  and name HN  ))
   (( segid "    " and resid 650  and name HA  ))
      6.000     4.700     0.000 peak     5 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.294 ppm2      4.596 CV     1
 ASSI {    8}
   (( segid "    " and resid 649  and name HN  ))
   (( segid "    " and resid 648  and name HB  ))
      3.300     1.600     1.600 peak     8 spectrum    1 weight  0.10000E+01 volume  0.22420E-02 ppm1      8.355 ppm2      2.071 CV     1
 ASSI {    9}
   (( segid "    " and resid 649  and name HN  ))
   (( segid "    " and resid 648  and name HA  ))
      6.000     4.700     0.000 peak     9 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.353 ppm2      4.134 CV     1
 ASSI {   13}
   (( segid "    " and resid 651  and name HN  ))
   (( segid "    " and resid 651  and name HB3 ))
      6.000     4.700     0.000 peak    13 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.328 ppm2      1.908 CV     1
 ASSI {   16}
   (( segid "    " and resid 651  and name HN  ))
   (( segid "    " and resid 650  and name HA  ))
      6.000     4.700     0.000 peak    16 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.328 ppm2      4.585 CV     1
 ASSI {   17}
   (( segid "    " and resid 653  and name HN  ))
   (( segid "    " and resid 652  and name HA  ))
      3.000     1.300     1.300 peak    17 spectrum    1 weight  0.10000E+01 volume  0.44188E-02 ppm1      7.968 ppm2      4.661 CV     1
 ASSI {   43}
   (( segid "    " and resid 660  and name HN  ))
   (( segid "    " and resid 659  and name HB3 ))
      3.400     1.600     1.600 peak    43 spectrum    1 weight  0.10000E+01 volume  0.19992E-02 ppm1      8.564 ppm2      1.986 CV     1
 ASSI {   44}
   (( segid "    " and resid 660  and name HN  ))
   (( segid "    " and resid 659  and name HB2 ))
      3.900     2.100     2.100 peak    44 spectrum    1 weight  0.10000E+01 volume  0.86974E-03 ppm1      8.563 ppm2      2.273 CV     1
 ASSI {   57}
   (( segid "    " and resid 662  and name HN  ))
   (( segid "    " and resid 661  and name HB% ))
      3.000     1.300     1.300 peak    57 spectrum    1 weight  0.10000E+01 volume  0.42132E-02 ppm1      8.387 ppm2      1.411 CV     1
 ASSI {   58}
   (( segid "    " and resid 662  and name HN  ))
   (( segid "    " and resid 661  and name HA  ))
      6.000     4.700     0.000 peak    58 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.389 ppm2      4.275 CV     1
 ASSI {   61}
   (( segid "    " and resid 663  and name HN  ))
   (( segid "    " and resid 662  and name HA  ))
      6.000     4.700     0.000 peak    61 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.384 ppm2      4.649 CV     1
 ASSI {   62}
   (( segid "    " and resid 663  and name HN  ))
   (( segid "    " and resid 662  and name HB3 ))
      6.000     4.700     0.000 peak    62 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.387 ppm2      2.723 CV     1
 ASSI {   63}
   (( segid "    " and resid 663  and name HN  ))
   (( segid "    " and resid 663  and name HA  ))
      3.300     1.500     1.500 peak    63 spectrum    1 weight  0.10000E+01 volume  0.23729E-02 ppm1      8.384 ppm2      4.322 CV     1
 ASSI {   65}
   (( segid "    " and resid 664  and name HN  ))
   (( segid "    " and resid 663  and name HB3 ))
      3.200     1.500     1.500 peak    65 spectrum    1 weight  0.10000E+01 volume  0.27279E-02 ppm1      8.334 ppm2      1.609 CV     1
 OR {   65}
   (( segid "    " and resid 664  and name HN  ))
   (( segid "    " and resid 663  and name HB2 ))
 ASSI {   66}
   (( segid "    " and resid 664  and name HN  ))
   (( segid "    " and resid 663  and name HA  ))
      4.300     2.500     1.700 peak    66 spectrum    1 weight  0.10000E+01 volume  0.48578E-03 ppm1      8.332 ppm2      4.322 CV     1
 ASSI {   67}
   (( segid "    " and resid 664  and name HN  ))
   (( segid "    " and resid 664  and name HB3 ))
      3.300     1.600     1.600 peak    67 spectrum    1 weight  0.10000E+01 volume  0.22047E-02 ppm1      8.332 ppm2      3.965 CV     1
 OR {   67}
   (( segid "    " and resid 664  and name HN  ))
   (( segid "    " and resid 664  and name HB2 ))
 ASSI {   68}
   (( segid "    " and resid 664  and name HN  ))
   (( segid "    " and resid 664  and name HA  ))
      3.700     1.900     1.900 peak    68 spectrum    1 weight  0.10000E+01 volume  0.12518E-02 ppm1      8.334 ppm2      4.175 CV     1
 ASSI {   72}
   (( segid "    " and resid 667  and name HN  ))
   (( segid "    " and resid 666  and name HA  ))
      3.000     1.400     1.400 peak    72 spectrum    1 weight  0.10000E+01 volume  0.38209E-02 ppm1      7.182 ppm2      4.760 CV     1
 ASSI {   73}
   (( segid "    " and resid 667  and name HN  ))
   (( segid "    " and resid 666  and name HB2 ))
      6.000     4.700     0.000 peak    73 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.186 ppm2      3.655 CV     1
 ASSI {   74}
   (( segid "    " and resid 667  and name HN  ))
   (( segid "    " and resid 666  and name HB3 ))
      6.000     4.700     0.000 peak    74 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.184 ppm2      2.527 CV     1
 ASSI {   82}
   (( segid "    " and resid 668  and name HN  ))
   (( segid "    " and resid 668  and name HA  ))
      3.400     1.700     1.700 peak    82 spectrum    1 weight  0.10000E+01 volume  0.18497E-02 ppm1      8.646 ppm2      4.292 CV     1
 ASSI {   83}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 668  and name HA  ))
      2.700     1.100     1.100 peak    83 spectrum    1 weight  0.10000E+01 volume  0.83611E-02 ppm1      8.508 ppm2      4.292 CV     1
 ASSI {   84}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 668  and name HB2 ))
      3.800     2.000     2.000 peak    84 spectrum    1 weight  0.10000E+01 volume  0.94351E-03 ppm1      8.508 ppm2      1.802 CV     1
 ASSI {   85}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 668  and name HB3 ))
      3.600     1.800     1.800 peak    85 spectrum    1 weight  0.10000E+01 volume  0.13546E-02 ppm1      8.509 ppm2      1.399 CV     1
 ASSI {   87}
   (( segid "    " and resid 669  and name HN  ))
   (( segid "    " and resid 669  and name HA  ))
      3.400     1.600     1.600 peak    87 spectrum    1 weight  0.10000E+01 volume  0.20085E-02 ppm1      8.510 ppm2      4.590 CV     1
 ASSI {   93}
   (( segid "    " and resid 671  and name HN  ))
   (( segid "    " and resid 671  and name HB  ))
      2.300     0.900     0.900 peak    93 spectrum    1 weight  0.10000E+01 volume  0.19711E-01 ppm1      8.939 ppm2      4.240 CV     1
 ASSI {  105}
   (( segid "    " and resid 674  and name HN  ))
   (( segid "    " and resid 674  and name HA  ))
      3.300     1.600     1.600 peak   105 spectrum    1 weight  0.10000E+01 volume  0.22701E-02 ppm1      8.679 ppm2      4.775 CV     1
 ASSI {  109}
   (( segid "    " and resid 675  and name HN  ))
   (( segid "    " and resid 674  and name HB3 ))
      4.400     2.600     1.600 peak   109 spectrum    1 weight  0.10000E+01 volume  0.41665E-03 ppm1      8.667 ppm2      2.700 CV     1
 ASSI {  110}
   (( segid "    " and resid 675  and name HN  ))
   (( segid "    " and resid 675  and name HA  ))
      3.500     1.800     1.800 peak   110 spectrum    1 weight  0.10000E+01 volume  0.14947E-02 ppm1      8.674 ppm2      4.056 CV     1
 ASSI {  111}
   (( segid "    " and resid 676  and name HN  ))
   (( segid "    " and resid 676  and name HA  ))
      6.000     4.700     0.000 peak   111 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.331 ppm2      4.208 CV     1
 ASSI {  112}
   (( segid "    " and resid 676  and name HN  ))
   (( segid "    " and resid 676  and name HB3 ))
      6.000     4.700     0.000 peak   112 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.335 ppm2      1.624 CV     1
 ASSI {  113}
   (( segid "    " and resid 676  and name HN  ))
   (( segid "    " and resid 676  and name HB2 ))
      6.000     4.700     0.000 peak   113 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.335 ppm2      1.826 CV     1
 ASSI {  117}
   (( segid "    " and resid 678  and name HN  ))
   (( segid "    " and resid 677  and name HB3 ))
      3.500     1.800     1.800 peak   117 spectrum    1 weight  0.10000E+01 volume  0.15508E-02 ppm1      8.500 ppm2      2.767 CV     1
 OR {  117}
   (( segid "    " and resid 678  and name HN  ))
   (( segid "    " and resid 677  and name HB2 ))
 ASSI {  118}
   (( segid "    " and resid 678  and name HN  ))
   (( segid "    " and resid 677  and name HA  ))
      2.000     0.700     0.700 peak   118 spectrum    1 weight  0.10000E+01 volume  0.52501E-01 ppm1      8.501 ppm2      4.579 CV     1
 ASSI {  121}
   (( segid "    " and resid 679  and name HN  ))
   (( segid "    " and resid 678  and name HA1 ))
      6.000     4.700     0.000 peak   121 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.401 ppm2      3.940 CV     1
 ASSI {  122}
   (( segid "    " and resid 679  and name HN  ))
   (( segid "    " and resid 679  and name HA  ))
      3.200     1.500     1.500 peak   122 spectrum    1 weight  0.10000E+01 volume  0.27185E-02 ppm1      8.400 ppm2      4.351 CV     1
 ASSI {  124}
   (( segid "    " and resid 680  and name HN  ))
   (( segid "    " and resid 679  and name HA  ))
      6.000     4.700     0.000 peak   124 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.389 ppm2      4.345 CV     1
 ASSI {  125}
   (( segid "    " and resid 680  and name HN  ))
   (( segid "    " and resid 679  and name HB3 ))
      6.000     4.700     0.000 peak   125 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.390 ppm2      3.957 CV     1
 OR {  125}
   (( segid "    " and resid 680  and name HN  ))
   (( segid "    " and resid 679  and name HB2 ))
 ASSI {  135}
   (( segid "    " and resid 682  and name HN  ))
   (( segid "    " and resid 681  and name HB3 ))
      6.000     4.700     0.000 peak   135 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.329 ppm2      3.865 CV     1
 OR {  135}
   (( segid "    " and resid 682  and name HN  ))
   (( segid "    " and resid 681  and name HB2 ))
 ASSI {  142}
   (( segid "    " and resid 684  and name HN  ))
   (( segid "    " and resid 683  and name HA  ))
      6.000     4.700     0.000 peak   142 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.426 ppm2      4.265 CV     1
 ASSI {  143}
   (( segid "    " and resid 684  and name HN  ))
   (( segid "    " and resid 683  and name HB3 ))
      3.400     1.600     1.600 peak   143 spectrum    1 weight  0.10000E+01 volume  0.19431E-02 ppm1      8.426 ppm2      1.555 CV     1
 OR {  143}
   (( segid "    " and resid 684  and name HN  ))
   (( segid "    " and resid 683  and name HB2 ))
 ASSI {  144}
   (( segid "    " and resid 684  and name HN  ))
   (( segid "    " and resid 683  and name HN  ))
      3.600     1.800     1.800 peak   144 spectrum    1 weight  0.10000E+01 volume  0.13732E-02 ppm1      8.424 ppm2      8.201 CV     1
 ASSI {  145}
   (( segid "    " and resid 906  and name HN  ))
   (( segid "    " and resid 905  and name HA1 ))
      6.000     4.700     0.000 peak   145 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.332 ppm2      3.882 CV     1
 OR {  145}
   (( segid "    " and resid 906  and name HN  ))
   (( segid "    " and resid 905  and name HA2 ))
 ASSI {  146}
   (( segid "    " and resid 906  and name HN  ))
   (( segid "    " and resid 906  and name HB2 ))
      6.000     4.700     0.000 peak   146 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.335 ppm2      3.115 CV     1
 ASSI {  147}
   (( segid "    " and resid 906  and name HN  ))
   (( segid "    " and resid 906  and name HA  ))
      6.000     4.700     0.000 peak   147 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.329 ppm2      4.657 CV     1
 ASSI {  148}
   (( segid "    " and resid 907  and name HN  ))
   (( segid "    " and resid 906  and name HA  ))
      3.600     1.900     1.900 peak   148 spectrum    1 weight  0.10000E+01 volume  0.12891E-02 ppm1      8.484 ppm2      4.649 CV     1
 ASSI {  149}
   (( segid "    " and resid 907  and name HN  ))
   (( segid "    " and resid 906  and name HB3 ))
      3.100     1.400     1.400 peak   149 spectrum    1 weight  0.10000E+01 volume  0.35499E-02 ppm1      8.482 ppm2      3.123 CV     1
 OR {  149}
   (( segid "    " and resid 907  and name HN  ))
   (( segid "    " and resid 906  and name HB2 ))
 ASSI {  150}
   (( segid "    " and resid 907  and name HN  ))
   (( segid "    " and resid 907  and name HA  ))
      4.100     2.300     1.900 peak   150 spectrum    1 weight  0.10000E+01 volume  0.66702E-03 ppm1      8.484 ppm2      4.416 CV     1
 ASSI {  151}
   (( segid "    " and resid 907  and name HN  ))
   (( segid "    " and resid 907  and name HB3 ))
      6.000     4.700     0.000 peak   151 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.482 ppm2      1.939 CV     1
 ASSI {  152}
   (( segid "    " and resid 908  and name HN  ))
   (( segid "    " and resid 907  and name HA  ))
      6.000     4.700     0.000 peak   152 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.369 ppm2      4.424 CV     1
 ASSI {  153}
   (( segid "    " and resid 908  and name HN  ))
   (( segid "    " and resid 907  and name HB3 ))
      6.000     4.700     0.000 peak   153 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.369 ppm2      1.930 CV     1
 ASSI {  154}
   (( segid "    " and resid 908  and name HN  ))
   (( segid "    " and resid 908  and name HA2 ))
      6.000     4.700     0.000 peak   154 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.370 ppm2      3.957 CV     1
 OR {  154}
   (( segid "    " and resid 908  and name HN  ))
   (( segid "    " and resid 908  and name HA1 ))
 ASSI {  155}
   (( segid "    " and resid 909  and name HN  ))
   (( segid "    " and resid 908  and name HA2 ))
      3.300     1.600     1.600 peak   155 spectrum    1 weight  0.10000E+01 volume  0.21580E-02 ppm1      8.320 ppm2      3.957 CV     1
 OR {  155}
   (( segid "    " and resid 909  and name HN  ))
   (( segid "    " and resid 908  and name HA1 ))
 ASSI {  156}
   (( segid "    " and resid 909  and name HN  ))
   (( segid "    " and resid 909  and name HA  ))
      6.000     4.700     0.000 peak   156 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.319 ppm2      4.432 CV     1
 ASSI {  157}
   (( segid "    " and resid 909  and name HN  ))
   (( segid "    " and resid 909  and name HB2 ))
      4.100     2.400     1.900 peak   157 spectrum    1 weight  0.10000E+01 volume  0.58668E-03 ppm1      8.322 ppm2      3.865 CV     1
 OR {  157}
   (( segid "    " and resid 909  and name HN  ))
   (( segid "    " and resid 909  and name HB3 ))
 ASSI {  160}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HB3 ))
      2.100     0.800     0.800 peak   160 spectrum    1 weight  0.10000E+01 volume  0.34098E-01 ppm1      8.062 ppm2      1.339 CV     1
 ASSI {  165}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      3.400     1.700     1.700 peak   165 spectrum    1 weight  0.10000E+01 volume  0.18591E-02 ppm1      7.628 ppm2      8.743 CV     1
 ASSI {  168}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      1.600     0.500     0.600 peak   168 spectrum    1 weight  0.10000E+01 volume  0.17189E+00 ppm1      8.611 ppm2      4.507 CV     1
 ASSI {  172}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HB3 ))
      3.400     1.700     1.700 peak   172 spectrum    1 weight  0.10000E+01 volume  0.18404E-02 ppm1      8.612 ppm2      2.264 CV     1
 ASSI {  181}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      3.200     1.500     1.500 peak   181 spectrum    1 weight  0.10000E+01 volume  0.29521E-02 ppm1      8.820 ppm2      3.865 CV     1
 ASSI {  191}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HA1 ))
      6.000     4.700     0.000 peak   191 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.526 ppm2      4.324 CV     1
 ASSI {  192}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      6.000     4.700     0.000 peak   192 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.526 ppm2      3.864 CV     1
 ASSI {  197}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HB2 ))
      6.000     4.700     0.000 peak   197 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.600 ppm2      1.502 CV     1
 OR {  197}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HB3 ))
 ASSI {  215}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB2 ))
      4.400     2.700     1.600 peak   215 spectrum    1 weight  0.10000E+01 volume  0.38675E-03 ppm1      8.200 ppm2      1.827 CV     1
 ASSI {  216}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB3 ))
      6.000     4.700     0.000 peak   216 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.200 ppm2      1.482 CV     1
 ASSI {  250}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      6.000     4.700     0.000 peak   250 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.122 ppm2      5.700 CV     1
 ASSI {  274}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      6.000     4.700     0.000 peak   274 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.030 ppm2      7.434 CV     1
 ASSI {  280}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB3 ))
      6.000     4.700     0.000 peak   280 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.670 ppm2      1.322 CV     1
 ASSI {  300}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HA1 ))
      6.000     4.700     0.000 peak   300 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.186 ppm2      4.343 CV     1
 ASSI {  307}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB3 ))
      4.300     2.500     1.700 peak   307 spectrum    1 weight  0.10000E+01 volume  0.48671E-03 ppm1      7.962 ppm2      3.209 CV     1
 ASSI {  308}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      3.100     1.400     1.400 peak   308 spectrum    1 weight  0.10000E+01 volume  0.36246E-02 ppm1      7.957 ppm2      4.957 CV     1
 ASSI {  310}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      3.600     1.800     1.800 peak   310 spectrum    1 weight  0.10000E+01 volume  0.13546E-02 ppm1      7.959 ppm2      2.514 CV     1
 ASSI {  319}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB% ))
      2.900     1.300     1.300 peak   319 spectrum    1 weight  0.10000E+01 volume  0.45308E-02 ppm1      8.647 ppm2      1.403 CV     1
 ASSI {  321}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      3.600     1.800     1.800 peak   321 spectrum    1 weight  0.10000E+01 volume  0.13920E-02 ppm1      8.597 ppm2      4.532 CV     1
 ASSI {  322}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HB2 ))
      6.000     4.700     0.000 peak   322 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.597 ppm2      1.434 CV     1
 ASSI {  323}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA2 ))
      1.600     0.500     0.600 peak   323 spectrum    1 weight  0.10000E+01 volume  0.17282E+00 ppm1      8.601 ppm2      3.765 CV     1
 OR {  323}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA1 ))
 ASSI {  324}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA2 ))
      3.100     1.400     1.400 peak   324 spectrum    1 weight  0.10000E+01 volume  0.34472E-02 ppm1      7.695 ppm2      3.773 CV     1
 ASSI {  335}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB  ))
      3.200     1.500     1.500 peak   335 spectrum    1 weight  0.10000E+01 volume  0.27279E-02 ppm1      8.764 ppm2      1.836 CV     1
 ASSI {  344}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB  ))
      2.700     1.100     1.100 peak   344 spectrum    1 weight  0.10000E+01 volume  0.78752E-02 ppm1      8.776 ppm2      4.180 CV     1
 ASSI {  349}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      2.800     1.200     1.200 peak   349 spectrum    1 weight  0.10000E+01 volume  0.65113E-02 ppm1      8.367 ppm2      4.533 CV     1
 ASSI {  355}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      6.000     4.700     0.000 peak   355 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.365 ppm2      4.774 CV     1
 ASSI {  359}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.000     1.400     1.400 peak   359 spectrum    1 weight  0.10000E+01 volume  0.37835E-02 ppm1      8.907 ppm2      4.951 CV     1
 ASSI {  372}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB3 ))
      3.700     1.900     1.900 peak   372 spectrum    1 weight  0.10000E+01 volume  0.12518E-02 ppm1      9.248 ppm2      3.832 CV     1
 ASSI {  376}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
      6.000     4.700     0.000 peak   376 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.806 ppm2      4.256 CV     1
 ASSI {  383}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA2 ))
      3.400     1.600     1.600 peak   383 spectrum    1 weight  0.10000E+01 volume  0.19151E-02 ppm1      8.004 ppm2      3.589 CV     1
 ASSI {  384}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA1 ))
      3.300     1.600     1.600 peak   384 spectrum    1 weight  0.10000E+01 volume  0.21580E-02 ppm1      8.002 ppm2      4.174 CV     1
 ASSI {  385}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      3.300     1.600     1.600 peak   385 spectrum    1 weight  0.10000E+01 volume  0.23448E-02 ppm1      8.002 ppm2      4.632 CV     1
 ASSI {  387}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB3 ))
      3.500     1.700     1.700 peak   387 spectrum    1 weight  0.10000E+01 volume  0.17656E-02 ppm1      8.000 ppm2      1.922 CV     1
 ASSI {  397}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.600     1.900     1.900 peak   397 spectrum    1 weight  0.10000E+01 volume  0.12891E-02 ppm1      9.466 ppm2      1.914 CV     1
 ASSI {  398}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      6.000     4.700     0.000 peak   398 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.980 ppm2      1.914 CV     1
 ASSI {  401}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB3 ))
      3.300     1.500     1.500 peak   401 spectrum    1 weight  0.10000E+01 volume  0.25223E-02 ppm1      8.978 ppm2      2.873 CV     1
 ASSI {  405}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.300     1.600     1.600 peak   405 spectrum    1 weight  0.10000E+01 volume  0.22047E-02 ppm1      8.958 ppm2      3.560 CV     1
 ASSI {  406}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.200     1.500     1.500 peak   406 spectrum    1 weight  0.10000E+01 volume  0.25503E-02 ppm1      8.958 ppm2      4.934 CV     1
 ASSI {  409}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      3.400     1.700     1.700 peak   409 spectrum    1 weight  0.10000E+01 volume  0.18123E-02 ppm1      8.954 ppm2      3.765 CV     1
 ASSI {  410}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      2.300     0.900     0.900 peak   410 spectrum    1 weight  0.10000E+01 volume  0.17750E-01 ppm1      8.958 ppm2      8.526 CV     1
 ASSI {  411}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      6.000     4.700     0.000 peak   411 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.518 ppm2      3.753 CV     1
 ASSI {  417}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.700     0.000 peak   417 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.516 ppm2      8.977 CV     1
 ASSI {  419}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.700     1.900     1.900 peak   419 spectrum    1 weight  0.10000E+01 volume  0.11117E-02 ppm1      9.040 ppm2      4.343 CV     1
 ASSI {  422}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      3.500     1.700     1.700 peak   422 spectrum    1 weight  0.10000E+01 volume  0.16722E-02 ppm1      9.039 ppm2      4.749 CV     1
 ASSI {  425}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      2.600     1.000     1.000 peak   425 spectrum    1 weight  0.10000E+01 volume  0.99025E-02 ppm1      9.039 ppm2      8.526 CV     1
 ASSI {  426}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      3.500     1.700     1.700 peak   426 spectrum    1 weight  0.10000E+01 volume  0.17469E-02 ppm1      8.958 ppm2      3.098 CV     1
 ASSI {  427}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HB3 ))
      6.000     4.700     0.000 peak   427 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.960 ppm2      2.543 CV     1
 ASSI {  428}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      2.700     1.100     1.100 peak   428 spectrum    1 weight  0.10000E+01 volume  0.84264E-02 ppm1      8.963 ppm2      4.741 CV     1
 ASSI {  434}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.100     1.400     1.400 peak   434 spectrum    1 weight  0.10000E+01 volume  0.31856E-02 ppm1      8.288 ppm2      3.963 CV     1
 ASSI {  438}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
      3.200     1.500     1.500 peak   438 spectrum    1 weight  0.10000E+01 volume  0.28586E-02 ppm1      8.277 ppm2      7.801 CV     1
 ASSI {  441}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      6.000     4.700     0.000 peak   441 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.814 ppm2      1.857 CV     1
 ASSI {  442}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      3.100     1.400     1.400 peak   442 spectrum    1 weight  0.10000E+01 volume  0.30829E-02 ppm1      7.815 ppm2      3.857 CV     1
 ASSI {  451}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      3.400     1.600     1.600 peak   451 spectrum    1 weight  0.10000E+01 volume  0.19245E-02 ppm1      8.120 ppm2      4.641 CV     1
 ASSI {  461}
   (( segid "    " and resid 647  and name HN  ))
   (( segid "    " and resid 646  and name HA  ))
      6.000     4.700     0.000 peak   461 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.362 ppm2      4.299 CV     1
 ASSI {  463}
   (( segid "    " and resid 646  and name HN  ))
   (( segid "    " and resid 645  and name HB3 ))
      6.000     4.700     0.000 peak   463 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.388 ppm2      2.748 CV     1
 ASSI {  465}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      6.000     4.700     0.000 peak   465 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.359 ppm2      4.174 CV     1
 ASSI {  466}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB3 ))
      6.000     4.700     0.000 peak   466 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.364 ppm2      1.272 CV     1
 ASSI {  467}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
      6.000     4.700     0.000 peak   467 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.360 ppm2      1.389 CV     1
 ASSI {  470}
   (( segid "    " and resid 658  and name HN  ))
   (( segid "    " and resid 658  and name HA  ))
      3.600     1.800     1.800 peak   470 spectrum    1 weight  0.10000E+01 volume  0.13172E-02 ppm1      8.400 ppm2      4.824 CV     1
 ASSI {  478}
   (( segid "    " and resid 666  and name HN  ))
   (( segid "    " and resid 666  and name HA  ))
      2.600     1.000     1.000 peak   478 spectrum    1 weight  0.10000E+01 volume  0.10649E-01 ppm1      7.790 ppm2      4.749 CV     1
 ASSI {  481}
   (( segid "    " and resid 910  and name HN  ))
   (( segid "    " and resid 909  and name HA  ))
      2.000     0.700     0.700 peak   481 spectrum    1 weight  0.10000E+01 volume  0.42693E-01 ppm1      8.538 ppm2      4.463 CV     1
 ASSI {  484}
   (( segid "    " and resid 649  and name HN  ))
   (( segid "    " and resid 648  and name HG1%)))
      2.800     1.200     1.200 peak   484 spectrum    1 weight  0.10000E+01 volume  0.65487E-02 ppm1      8.355 ppm2      0.874 CV     1
 ASSI {  485}
   (( segid "    " and resid 652  and name HN  ))
   (( segid "    " and resid 651  and name HA  ))
      6.000     4.700     0.000 peak   485 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.317 ppm2      4.170 CV     1
 ASSI {  486}
   (( segid "    " and resid 652  and name HN  ))
   (( segid "    " and resid 651  and name HB3 ))
      6.000     4.700     0.000 peak   486 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.317 ppm2      1.918 CV     1
 ASSI {  492}
   (( segid "    " and resid 658  and name HN  ))
   (( segid "    " and resid 657  and name HG13))))
      3.200     1.500     1.500 peak   492 spectrum    1 weight  0.10000E+01 volume  0.28774E-02 ppm1      8.403 ppm2      1.141 CV     1
 ASSI {  495}
   (( segid "    " and resid 668  and name HN  ))
   (( segid "    " and resid 667  and name HG2 ))
      3.500     1.700     1.700 peak   495 spectrum    1 weight  0.10000E+01 volume  0.17656E-02 ppm1      8.646 ppm2      1.161 CV     1
 OR {  495}
   (( segid "    " and resid 668  and name HN  ))
   (( segid "    " and resid 667  and name HG3 ))
 ASSI {  496}
   (( segid "    " and resid 670  and name HN  ))
   (( segid "    " and resid 670  and name HG2%)))
      1.700     0.600     0.600 peak   496 spectrum    1 weight  0.10000E+01 volume  0.11584E+00 ppm1      8.419 ppm2      0.657 CV     1
 ASSI {  503}
   (( segid "    " and resid 681  and name HN  ))
   (( segid "    " and resid 680  and name HG2 ))
      6.000     4.700     0.000 peak   503 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.280 ppm2      2.345 CV     1
 ASSI {  505}
   (( segid "    " and resid 684  and name HN  ))
   (( segid "    " and resid 683  and name HD1%)))
      3.400     1.700     1.700 peak   505 spectrum    1 weight  0.10000E+01 volume  0.18404E-02 ppm1      8.426 ppm2      0.809 CV     1
 ASSI {  512}
   (( segid "    " and resid 653  and name HN  ))
   (( segid "    " and resid 653  and name HG13))))
      1.800     0.600     0.600 peak   512 spectrum    1 weight  0.10000E+01 volume  0.98087E-01 ppm1      7.967 ppm2      1.078 CV     1
 ASSI {  515}
   (( segid "    " and resid 658  and name HN  ))
   (( segid "    " and resid 657  and name HG2%)))
      6.000     6.000     0.000 peak   515 spectrum    1 weight  0.10000E+01 volume  0.25878E-04 ppm1      8.400 ppm2      0.851 CV     1
 ASSI {  519}
   (( segid "    " and resid 675  and name HN  ))
   (( segid "    " and resid 675  and name HG2%)))
      3.300     1.500     1.500 peak   519 spectrum    1 weight  0.10000E+01 volume  0.25130E-02 ppm1      8.673 ppm2      1.224 CV     1
 ASSI {  520}
   (( segid "    " and resid 675  and name HN  ))
   (( segid "    " and resid 675  and name HB  ))
      3.800     2.000     2.000 peak   520 spectrum    1 weight  0.10000E+01 volume  0.98087E-03 ppm1      8.671 ppm2      4.308 CV     1
 ASSI {  522}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HG13))))
      2.900     1.300     1.300 peak   522 spectrum    1 weight  0.10000E+01 volume  0.49326E-02 ppm1      8.278 ppm2      1.226 CV     1
 ASSI {  523}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HG2%)))
      3.200     1.400     1.400 peak   523 spectrum    1 weight  0.10000E+01 volume  0.30081E-02 ppm1      8.278 ppm2      0.827 CV     1
 ASSI {  530}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HD1%)))
      6.000     4.700     0.000 peak   530 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.782 ppm2      0.897 CV     1
 ASSI {  533}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HD2 ))
      6.000     4.700     0.000 peak   533 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.364 ppm2      0.972 CV     1
 OR {  533}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HD3 ))
 ASSI {  544}
   (( segid "    " and resid 907  and name HN  ))
   (( segid "    " and resid 907  and name HB2 ))
      6.000     4.700     0.000 peak   544 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.482 ppm2      2.022 CV     1
 ASSI {  552}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      6.000     4.700     0.000 peak   552 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.743 ppm2      2.327 CV     1
 ASSI {  553}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HD2 ))
      6.000     4.700     0.000 peak   553 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.743 ppm2      0.680 CV     1
 ASSI {  558}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HG12))))
      6.000     4.700     0.000 peak   558 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.441 ppm2      1.647 CV     1
 ASSI {  560}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HG3 ))
      3.400     1.700     1.700 peak   560 spectrum    1 weight  0.10000E+01 volume  0.18871E-02 ppm1      7.813 ppm2      1.364 CV     1
 ASSI {  564}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HG  ))
      6.000     4.700     0.000 peak   564 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.596 ppm2      1.530 CV     1
 ASSI {  568}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HD2%)))
      6.000     4.700     0.000 peak   568 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.977 ppm2      1.097 CV     1
 ASSI {  569}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HD1%)))
      3.300     1.500     1.500 peak   569 spectrum    1 weight  0.10000E+01 volume  0.25316E-02 ppm1      8.977 ppm2      1.099 CV     1
 ASSI {  576}
   (( segid "    " and resid 56   and name HE22))))
   (( segid "    " and resid 56   and name HB2 ))
      3.500     1.800     1.800 peak   576 spectrum    1 weight  0.10000E+01 volume  0.15134E-02 ppm1      7.076 ppm2      2.227 CV     1
 ASSI {  578}
   (( segid "    " and resid 56   and name HE22))))
   (( segid "    " and resid 56   and name HA  ))
      4.000     2.200     2.000 peak   578 spectrum    1 weight  0.10000E+01 volume  0.77445E-03 ppm1      7.076 ppm2      4.088 CV     1
 ASSI {  579}
   (( segid "    " and resid 56   and name HE22))))
   (( segid "    " and resid 56   and name HG3 ))
      3.800     2.000     2.000 peak   579 spectrum    1 weight  0.10000E+01 volume  0.99963E-03 ppm1      7.075 ppm2      2.469 CV     1
 ASSI {  583}
   (( segid "    " and resid 54   and name HE21))))
   (( segid "    " and resid 54   and name HB3 ))
      6.000     4.700     0.000 peak   583 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.224 ppm2      2.360 CV     1
 ASSI {  584}
   (( segid "    " and resid 54   and name HE22))))
   (( segid "    " and resid 54   and name HG3 ))
      3.300     1.600     1.600 peak   584 spectrum    1 weight  0.10000E+01 volume  0.21393E-02 ppm1      6.679 ppm2      2.235 CV     1
 ASSI {  585}
   (( segid "    " and resid 54   and name HE21))))
   (( segid "    " and resid 54   and name HE22))))
      2.300     0.900     0.900 peak   585 spectrum    1 weight  0.10000E+01 volume  0.20833E-01 ppm1      7.224 ppm2      6.671 CV     1
 ASSI {  588}
   (( segid "    " and resid 680  and name HE21))))
   (( segid "    " and resid 680  and name HG2 ))
      3.400     1.700     1.700 peak   588 spectrum    1 weight  0.10000E+01 volume  0.18964E-02 ppm1      7.522 ppm2      2.343 CV     1
 ASSI {  589}
   (( segid "    " and resid 680  and name HE22))))
   (( segid "    " and resid 680  and name HG2 ))
      3.600     1.800     1.800 peak   589 spectrum    1 weight  0.10000E+01 volume  0.13266E-02 ppm1      6.849 ppm2      2.343 CV     1
 ASSI {  599}
   (( segid "    " and resid 653  and name HN  ))
   (( segid "    " and resid 653  and name HG12))))
      3.600     1.800     1.800 peak   599 spectrum    1 weight  0.10000E+01 volume  0.14013E-02 ppm1      7.967 ppm2      1.369 CV     1
 ASSI {  602}
   (( segid "    " and resid 663  and name HN  ))
   (( segid "    " and resid 662  and name HB2 ))
      6.000     4.700     0.000 peak   602 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.388 ppm2      2.842 CV     1
 ASSI {  614}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HB3 ))
      2.900     1.200     1.200 peak   614 spectrum    1 weight  0.10000E+01 volume  0.52689E-02 ppm1      8.090 ppm2      1.333 CV     1
 ASSI {  615}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HB2 ))
      3.100     1.400     1.400 peak   615 spectrum    1 weight  0.10000E+01 volume  0.36714E-02 ppm1      8.091 ppm2      1.502 CV     1
 ASSI {  616}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HD2%)))
      3.700     1.900     1.900 peak   616 spectrum    1 weight  0.10000E+01 volume  0.12331E-02 ppm1      8.089 ppm2      0.768 CV     1
 ASSI {  626}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
      6.000     4.700     0.000 peak   626 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.363 ppm2      1.491 CV     1
 OR {  626}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HB3 ))
 ASSI {  627}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HG3 ))
      6.000     4.700     0.000 peak   627 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.361 ppm2      1.273 CV     1
 ASSI {  641}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      6.000     4.700     0.000 peak   641 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.574 ppm2      3.980 CV     1
 ASSI {  648}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HG3 ))
      6.000     4.700     0.000 peak   648 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.443 ppm2      2.579 CV     1
 ASSI {  649}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HG2 ))
      6.000     4.700     0.000 peak   649 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.442 ppm2      2.633 CV     1
 ASSI {  655}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HD3 ))
      6.000     4.700     0.000 peak   655 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.956 ppm2      3.252 CV     1
 OR {  655}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HD2 ))
 ASSI {  656}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HD3 ))
      6.000     4.700     0.000 peak   656 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.516 ppm2      3.252 CV     1
 OR {  656}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HD2 ))
 ASSI {  659}
   (( segid "    " and resid 652  and name HD21))))
   (( segid "    " and resid 652  and name HB3 ))
      3.300     1.500     1.500 peak   659 spectrum    1 weight  0.10000E+01 volume  0.24756E-02 ppm1      6.922 ppm2      2.681 CV     1
 ASSI {  663}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HD3 ))
      6.000     4.700     0.000 peak   663 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.259 ppm2      3.255 CV     1
 OR {  663}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HD2 ))
 ASSI {  664}
   (( segid "    " and resid 22   and name HE  ))
   (( segid "    " and resid 22   and name HD3 ))
      6.000     4.700     0.000 peak   664 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.241 ppm2      3.069 CV     1
 ASSI {  677}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      3.600     1.800     1.800 peak   677 spectrum    1 weight  0.10000E+01 volume  0.14107E-02 ppm1      8.859 ppm2      8.660 CV     1
 ASSI {  686}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HG3 ))
      6.000     4.700     0.000 peak   686 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.524 ppm2      0.378 CV     1
 ASSI {  689}
   (( segid "    " and resid 665  and name HE22))))
   (( segid "    " and resid 665  and name HG3 ))
      6.000     4.700     0.000 peak   689 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.827 ppm2      1.762 CV     1
 ASSI {  690}
   (( segid "    " and resid 907  and name HN  ))
   (( segid "    " and resid 907  and name HG3 ))
      6.000     4.700     0.000 peak   690 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.482 ppm2      2.404 CV     1
 ASSI {  691}
   (( segid "    " and resid 907  and name HN  ))
   (( segid "    " and resid 907  and name HG2 ))
      6.000     4.700     0.000 peak   691 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.482 ppm2      2.487 CV     1
 ASSI {  692}
   (( segid "    " and resid 908  and name HN  ))
   (( segid "    " and resid 907  and name HB2 ))
      6.000     4.700     0.000 peak   692 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.369 ppm2      2.016 CV     1
 ASSI {  693}
   (( segid "    " and resid 908  and name HN  ))
   (( segid "    " and resid 907  and name HG2 ))
      6.000     4.700     0.000 peak   693 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.369 ppm2      2.487 CV     1
 ASSI {  694}
   (( segid "    " and resid 908  and name HN  ))
   (( segid "    " and resid 907  and name HG3 ))
      6.000     4.700     0.000 peak   694 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.369 ppm2      2.404 CV     1
 ASSI {  696}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HG3 ))
      6.000     4.700     0.000 peak   696 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.954 ppm2      1.441 CV     1
 ASSI {  697}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HD3 ))
      6.000     4.700     0.000 peak   697 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.813 ppm2      3.071 CV     1
 ASSI {  698}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HD2 ))
      6.000     4.700     0.000 peak   698 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.813 ppm2      3.359 CV     1
 ASSI {  699}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HD2%)))
      6.000     4.700     0.000 peak   699 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.596 ppm2      0.419 CV     1
 ASSI {  702}
   (( segid "    " and resid 651  and name HN  ))
   (( segid "    " and resid 654  and name HG3 ))
      6.000     4.700     0.000 peak   702 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.326 ppm2      2.175 CV     1
 OR {  702}
   (( segid "    " and resid 651  and name HN  ))
   (( segid "    " and resid 654  and name HG2 ))
 ASSI {  704}
   (( segid "    " and resid 654  and name HN  ))
   (( segid "    " and resid 653  and name HN  ))
      3.300     1.500     1.500 peak   704 spectrum    1 weight  0.10000E+01 volume  0.24476E-02 ppm1      8.316 ppm2      7.989 CV     1
 ASSI {  707}
   (( segid "    " and resid 655  and name HN  ))
   (( segid "    " and resid 653  and name HG2%)))
      3.500     1.700     1.700 peak   707 spectrum    1 weight  0.10000E+01 volume  0.17656E-02 ppm1      8.046 ppm2      0.626 CV     1
 ASSI {  709}
   (( segid "    " and resid 658  and name HN  ))
   (( segid "    " and resid 659  and name HD3 ))
      3.600     1.800     1.800 peak   709 spectrum    1 weight  0.10000E+01 volume  0.12985E-02 ppm1      8.400 ppm2      3.794 CV     1
 OR {  709}
   (( segid "    " and resid 658  and name HN  ))
   (( segid "    " and resid 659  and name HD2 ))
 ASSI {  711}
   (( segid "    " and resid 663  and name HN  ))
   (( segid "    " and resid 663  and name HD2%)))
      6.000     4.700     0.000 peak   711 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.384 ppm2      0.689 CV     1
 ASSI {  712}
   (( segid "    " and resid 665  and name HN  ))
   (( segid "    " and resid 666  and name HN  ))
      3.700     1.900     1.900 peak   712 spectrum    1 weight  0.10000E+01 volume  0.11024E-02 ppm1      8.266 ppm2      7.793 CV     1
 ASSI {  715}
   (( segid "    " and resid 667  and name HN  ))
   (( segid "    " and resid 65   and name HE% ))
      6.000     4.700     0.000 peak   715 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.182 ppm2      6.433 CV     1
 ASSI {  723}
   (( segid "    " and resid 675  and name HN  ))
   (( segid "    " and resid 35   and name HD2%)))
      3.700     1.900     1.900 peak   723 spectrum    1 weight  0.10000E+01 volume  0.11117E-02 ppm1      8.673 ppm2      0.755 CV     1
 ASSI {  724}
   (( segid "    " and resid 675  and name HN  ))
   (( segid "    " and resid 676  and name HN  ))
      3.300     1.600     1.600 peak   724 spectrum    1 weight  0.10000E+01 volume  0.21673E-02 ppm1      8.671 ppm2      8.326 CV     1
 ASSI {  725}
   (( segid "    " and resid 677  and name HN  ))
   (( segid "    " and resid 676  and name HG3 ))
      3.200     1.500     1.500 peak   725 spectrum    1 weight  0.10000E+01 volume  0.28026E-02 ppm1      7.614 ppm2      1.280 CV     1
 ASSI {  729}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 911  and name HA2 ))
      2.700     1.100     1.100 peak   729 spectrum    1 weight  0.10000E+01 volume  0.76043E-02 ppm1      8.064 ppm2      3.849 CV     1
 OR {  729}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 911  and name HA1 ))
 ASSI {  730}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      1.600     0.500     0.600 peak   730 spectrum    1 weight  0.10000E+01 volume  0.15414E+00 ppm1      8.093 ppm2      7.634 CV     1
 ASSI {  733}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 30   and name HD1%)))
      3.300     1.600     1.600 peak   733 spectrum    1 weight  0.10000E+01 volume  0.22794E-02 ppm1      8.610 ppm2      0.405 CV     1
 ASSI {  734}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HB3 ))
      4.000     2.200     2.000 peak   734 spectrum    1 weight  0.10000E+01 volume  0.78192E-03 ppm1      8.183 ppm2      2.831 CV     1
 ASSI {  735}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 23   and name HB3 ))
      5.500     4.000     0.500 peak   735 spectrum    1 weight  0.10000E+01 volume  0.10370E-03 ppm1      8.183 ppm2      2.256 CV     1
 ASSI {  739}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 50   and name HB3 ))
      3.700     1.900     1.900 peak   739 spectrum    1 weight  0.10000E+01 volume  0.11584E-02 ppm1      7.959 ppm2      2.815 CV     1
 ASSI {  740}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      6.000     4.700     0.000 peak   740 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.959 ppm2      1.377 CV     1
 ASSI {  741}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      3.500     1.700     1.700 peak   741 spectrum    1 weight  0.10000E+01 volume  0.16255E-02 ppm1      8.858 ppm2      8.184 CV     1
 ASSI {  744}
   (( segid "    " and resid 56   and name HE21))))
   (( segid "    " and resid 46   and name HA  ))
      5.400     3.800     0.600 peak   744 spectrum    1 weight  0.10000E+01 volume  0.12144E-03 ppm1      7.844 ppm2      4.361 CV     1
 ASSI {  745}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HB3 ))
      3.300     1.500     1.500 peak   745 spectrum    1 weight  0.10000E+01 volume  0.24569E-02 ppm1      8.596 ppm2      0.947 CV     1
 ASSI {  746}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      3.600     1.800     1.800 peak   746 spectrum    1 weight  0.10000E+01 volume  0.14573E-02 ppm1      7.693 ppm2      4.157 CV     1
 ASSI {  747}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 60   and name HG13))))
      3.700     1.900     1.900 peak   747 spectrum    1 weight  0.10000E+01 volume  0.10930E-02 ppm1      7.693 ppm2      1.264 CV     1
 ASSI {  748}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 36   and name HD2%)))
      3.700     1.900     1.900 peak   748 spectrum    1 weight  0.10000E+01 volume  0.11211E-02 ppm1      7.691 ppm2      0.871 CV     1
 ASSI {  749}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      5.400     3.800     0.600 peak   749 spectrum    1 weight  0.10000E+01 volume  0.12331E-03 ppm1      8.764 ppm2      4.590 CV     1
 ASSI {  750}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HG12))))
      4.800     3.000     1.200 peak   750 spectrum    1 weight  0.10000E+01 volume  0.25410E-03 ppm1      8.765 ppm2      1.539 CV     1
 ASSI {  754}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 60   and name HG12))))
      5.100     3.500     0.900 peak   754 spectrum    1 weight  0.10000E+01 volume  0.16815E-03 ppm1      7.728 ppm2      1.531 CV     1
 ASSI {  756}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HG2%)))
      3.600     1.800     1.800 peak   756 spectrum    1 weight  0.10000E+01 volume  0.13639E-02 ppm1      8.775 ppm2      1.255 CV     1
 ASSI {  757}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HD% ))
      3.100     1.400     1.400 peak   757 spectrum    1 weight  0.10000E+01 volume  0.30922E-02 ppm1      8.930 ppm2      6.475 CV     1
 ASSI {  758}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      3.500     1.700     1.700 peak   758 spectrum    1 weight  0.10000E+01 volume  0.16349E-02 ppm1      8.930 ppm2      9.469 CV     1
 ASSI {  759}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 667  and name HA  ))
      3.800     2.000     2.000 peak   759 spectrum    1 weight  0.10000E+01 volume  0.10276E-02 ppm1      8.912 ppm2      3.832 CV     1
 ASSI {  760}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 666  and name HB2 ))
      3.500     1.800     1.800 peak   760 spectrum    1 weight  0.10000E+01 volume  0.15227E-02 ppm1      8.912 ppm2      3.657 CV     1
 ASSI {  761}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HD% ))
      3.600     1.800     1.800 peak   761 spectrum    1 weight  0.10000E+01 volume  0.13546E-02 ppm1      8.912 ppm2      6.483 CV     1
 ASSI {  762}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      3.300     1.600     1.600 peak   762 spectrum    1 weight  0.10000E+01 volume  0.22047E-02 ppm1      7.746 ppm2      8.001 CV     1
 ASSI {  763}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HG3 ))
      3.500     1.800     1.800 peak   763 spectrum    1 weight  0.10000E+01 volume  0.15601E-02 ppm1      9.247 ppm2      0.647 CV     1
 ASSI {  769}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 65   and name HE% ))
      3.300     1.600     1.600 peak   769 spectrum    1 weight  0.10000E+01 volume  0.22234E-02 ppm1      8.957 ppm2      6.442 CV     1
 ASSI {  771}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 72   and name HD1%)))
      3.600     1.900     1.900 peak   771 spectrum    1 weight  0.10000E+01 volume  0.12891E-02 ppm1      9.042 ppm2      1.105 CV     1
 OR {  771}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 72   and name HD2%)))
 ASSI {  772}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      6.000     4.700     0.000 peak   772 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.958 ppm2      3.773 CV     1
 ASSI {  774}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 72   and name HB3 ))
      4.900     3.200     1.100 peak   774 spectrum    1 weight  0.10000E+01 volume  0.21860E-03 ppm1      8.958 ppm2      1.689 CV     1
 ASSI {  775}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 72   and name HD2%)))
      3.600     1.800     1.800 peak   775 spectrum    1 weight  0.10000E+01 volume  0.14200E-02 ppm1      8.960 ppm2      1.113 CV     1
 OR {  775}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 72   and name HD1%)))
 ASSI {  778}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      3.300     1.500     1.500 peak   778 spectrum    1 weight  0.10000E+01 volume  0.24569E-02 ppm1      7.814 ppm2      4.732 CV     1
 ASSI {  782}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HD% ))
      2.100     0.700     0.700 peak   782 spectrum    1 weight  0.10000E+01 volume  0.39983E-01 ppm1      8.121 ppm2      6.845 CV     1
 ASSI {  783}
   (( segid "    " and resid 79   and name HE  ))
   (( segid "    " and resid 79   and name HD3 ))
      6.000     4.700     0.000 peak   783 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.210 ppm2      3.048 CV     1
 ASSI {  784}
   (( segid "    " and resid 647  and name HN  ))
   (( segid "    " and resid 647  and name HB2 ))
      6.000     4.700     0.000 peak   784 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.364 ppm2      2.709 CV     1
 ASSI {  786}
   (( segid "    " and resid 666  and name HN  ))
   (( segid "    " and resid 65   and name HD% ))
      6.000     4.700     0.000 peak   786 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.789 ppm2      6.501 CV     1
 ASSI {  787}
   (( segid "    " and resid 667  and name HN  ))
   (( segid "    " and resid 665  and name HA  ))
      6.000     4.700     0.000 peak   787 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.183 ppm2      4.040 CV     1
 ASSI {  794}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      6.000     4.700     0.000 peak   794 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.603 ppm2      4.501 CV     1
 ASSI {  796}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 23   and name HB3 ))
      6.000     4.700     0.000 peak   796 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.131 ppm2      2.264 CV     1
 ASSI {  797}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 22   and name HD3 ))
      6.000     4.700     0.000 peak   797 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.600 ppm2      3.098 CV     1
 OR {  797}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 22   and name HD2 ))
 ASSI {  801}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      6.000     4.700     0.000 peak   801 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.196 ppm2      3.363 CV     1
 ASSI {  802}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      4.800     3.000     1.200 peak   802 spectrum    1 weight  0.10000E+01 volume  0.25223E-03 ppm1      8.196 ppm2      4.524 CV     1
 ASSI {  805}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 43   and name HB3 ))
      3.700     1.900     1.900 peak   805 spectrum    1 weight  0.10000E+01 volume  0.11490E-02 ppm1      8.779 ppm2      2.602 CV     1
 ASSI {  810}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 43   and name HE1 ))
      6.000     4.700     0.000 peak   810 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.887 ppm2      9.556 CV     1
 ASSI {  812}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      6.000     4.700     0.000 peak   812 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.574 ppm2      4.449 CV     1
 ASSI {  817}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HD% ))
      6.000     4.700     0.000 peak   817 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.118 ppm2      7.240 CV     1
 ASSI {  818}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 35   and name HB3 ))
      6.000     4.700     0.000 peak   818 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.122 ppm2      1.864 CV     1
 ASSI {  819}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 35   and name HD1%)))
      6.000     4.700     0.000 peak   819 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.120 ppm2      0.951 CV     1
 ASSI {  821}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 23   and name HA  ))
      6.000     4.700     0.000 peak   821 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.246 ppm2      4.399 CV     1
 ASSI {  824}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 36   and name HD1%)))
      6.000     4.700     0.000 peak   824 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     10.025 ppm2      0.868 CV     1
 ASSI {  825}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      6.000     4.700     0.000 peak   825 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     10.026 ppm2      7.843 CV     1
 ASSI {  826}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 44   and name HB3 ))
      6.000     4.700     0.000 peak   826 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.986 ppm2      3.552 CV     1
 ASSI {  828}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      6.000     4.700     0.000 peak   828 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.826 ppm2      3.957 CV     1
 ASSI {  829}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 36   and name HD1%)))
      6.000     4.700     0.000 peak   829 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.030 ppm2      0.893 CV     1
 ASSI {  834}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      6.000     4.700     0.000 peak   834 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.668 ppm2      4.117 CV     1
 ASSI {  835}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 57   and name HG  ))
      6.000     4.700     0.000 peak   835 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.669 ppm2      1.539 CV     1
 ASSI {  836}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HG2 ))
      6.000     4.700     0.000 peak   836 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.668 ppm2      1.105 CV     1
 ASSI {  839}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      6.000     4.700     0.000 peak   839 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.667 ppm2      8.872 CV     1
 ASSI {  842}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      6.000     4.700     0.000 peak   842 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     10.072 ppm2      8.176 CV     1
 ASSI {  847}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 72   and name HD1%)))
      6.000     4.700     0.000 peak   847 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.912 ppm2      1.093 CV     1
 ASSI {  848}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     4.700     0.000 peak   848 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.912 ppm2      6.154 CV     1
 ASSI {  849}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 57   and name HD1%)))
      6.000     4.700     0.000 peak   849 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.976 ppm2      0.659 CV     1
 ASSI {  850}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 57   and name HD1%)))
      6.000     4.700     0.000 peak   850 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.954 ppm2      0.663 CV     1
 ASSI {  852}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      6.000     4.700     0.000 peak   852 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.120 ppm2      3.323 CV     1
 ASSI {  855}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 78   and name HG2%)))
      4.400     2.600     1.600 peak   855 spectrum    1 weight  0.10000E+01 volume  0.41665E-03 ppm1      7.798 ppm2      0.826 CV     1
 ASSI {  856}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HB3 ))
      6.000     4.700     0.000 peak   856 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.798 ppm2      1.747 CV     1
 ASSI {  857}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      6.000     4.700     0.000 peak   857 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.795 ppm2      3.315 CV     1
 ASSI {  858}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 48   and name HB3 ))
      6.000     4.700     0.000 peak   858 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.249 ppm2      0.415 CV     1
 ASSI {  859}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HB3 ))
      6.000     4.700     0.000 peak   859 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.574 ppm2      2.662 CV     1
 ASSI {  861}
   (( segid "    " and resid 664  and name HN  ))
   (( segid "    " and resid 663  and name HD2%)))
      6.000     4.700     0.000 peak   861 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.335 ppm2      0.697 CV     1
 ASSI {  862}
   (( segid "    " and resid 46   and name HE  ))
   (( segid "    " and resid 46   and name HB2 ))
      6.000     4.700     0.000 peak   862 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.091 ppm2      1.893 CV     1
 OR {  862}
   (( segid "    " and resid 46   and name HE  ))
   (( segid "    " and resid 46   and name HB3 ))
 ASSI {  863}
   (( segid "    " and resid 46   and name HE  ))
   (( segid "    " and resid 46   and name HG3 ))
      6.000     4.700     0.000 peak   863 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.090 ppm2      1.626 CV     1
 ASSI {  867}
   (( segid "    " and resid 79   and name HE  ))
   (( segid "    " and resid 79   and name HD2 ))
      6.000     4.700     0.000 peak   867 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.211 ppm2      3.352 CV     1
 ASSI {  868}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      6.000     4.700     0.000 peak   868 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.670 ppm2      1.370 CV     1
 ASSI {  879}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name HB2 ))
      6.000     4.700     0.000 peak   879 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.049 ppm2      1.835 CV     1
 ASSI {  882}
   (( segid "    " and resid 664  and name HN  ))
   (( segid "    " and resid 662  and name HA  ))
      6.000     4.700     0.000 peak   882 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.335 ppm2      4.653 CV     1
 ASSI {  883}
   (( segid "    " and resid 22   and name HE  ))
   (( segid "    " and resid 22   and name HB3 ))
      6.000     4.700     0.000 peak   883 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.248 ppm2      1.491 CV     1
 OR {  883}
   (( segid "    " and resid 22   and name HE  ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI {  884}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 49   and name HB3 ))
      6.000     4.700     0.000 peak   884 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.959 ppm2      1.309 CV     1
 ASSI {  885}
   (( segid "    " and resid 54   and name HE22))))
   (( segid "    " and resid 46   and name HA  ))
      6.000     4.700     0.000 peak   885 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.678 ppm2      4.341 CV     1
 ASSI {  886}
   (( segid "    " and resid 54   and name HE21))))
   (( segid "    " and resid 46   and name HA  ))
      6.000     4.700     0.000 peak   886 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.223 ppm2      4.358 CV     1
 ASSI {  887}
   (( segid "    " and resid 56   and name HE22))))
   (( segid "    " and resid 46   and name HA  ))
      4.600     2.900     1.400 peak   887 spectrum    1 weight  0.10000E+01 volume  0.31295E-03 ppm1      7.074 ppm2      4.346 CV     1
 ASSI {  888}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      3.300     1.600     1.600 peak   888 spectrum    1 weight  0.10000E+01 volume  0.21487E-02 ppm1      8.404 ppm2      4.076 CV     1
 ASSI {  890}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
      6.000     4.700     0.000 peak   890 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.404 ppm2      2.232 CV     1
 ASSI {  891}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HB3 ))
      6.000     4.700     0.000 peak   891 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.404 ppm2      2.035 CV     1
 ASSI {  892}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HB2 ))
      6.000     4.700     0.000 peak   892 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.404 ppm2      1.433 CV     1
 ASSI {  893}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HB3 ))
      6.000     4.700     0.000 peak   893 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.404 ppm2      0.964 CV     1
 ASSI {  896}
   (( segid "    " and resid 910  and name HN  ))
   (( segid "    " and resid 911  and name HN  ))
      6.000     4.700     0.000 peak   896 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.537 ppm2      8.210 CV     1
 ASSI {  900}
   (( segid "    " and resid 20   and name HE1 ))
   (( segid "    " and resid 909  and name HB3 ))
      6.000     4.700     0.000 peak   900 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     10.167 ppm2      3.894 CV     1
 OR {  900}
   (( segid "    " and resid 20   and name HE1 ))
   (( segid "    " and resid 909  and name HB2 ))
 ASSI {  903}
   (( segid "    " and resid 20   and name HE1 ))
   (( segid "    " and resid 29   and name HE3 ))
      6.000     4.700     0.000 peak   903 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     10.169 ppm2      2.451 CV     1
 ASSI {  910}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 43   and name HH2 ))
      6.000     4.700     0.000 peak   910 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.548 ppm2      7.198 CV     1
 ASSI {  911}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 48   and name HD2%)))
      6.000     4.700     0.000 peak   911 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.550 ppm2     -0.826 CV     1
 ASSI {  913}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HG3 ))
      6.000     4.700     0.000 peak   913 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.550 ppm2      2.475 CV     1
 OR {  913}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HG2 ))
 ASSI {    6}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.400     0.900     0.900 peak     6 spectrum    1 weight  0.10000E+01 volume  0.52804E-01 ppm1      5.618 ppm2      1.858 CV     1
 ASSI {   10}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB3 ))
      2.700     1.100     1.100 peak    10 spectrum    1 weight  0.10000E+01 volume  0.28729E-01 ppm1      6.152 ppm2      1.712 CV     1
 ASSI {   11}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
      2.400     0.900     0.900 peak    11 spectrum    1 weight  0.10000E+01 volume  0.50220E-01 ppm1      6.152 ppm2      1.923 CV     1
 ASSI {   15}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HG3 ))
      2.900     1.300     1.300 peak    15 spectrum    1 weight  0.10000E+01 volume  0.16469E-01 ppm1      5.027 ppm2      1.044 CV     1
 ASSI {   16}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HD2 ))
      2.800     1.200     1.200 peak    16 spectrum    1 weight  0.10000E+01 volume  0.21639E-01 ppm1      5.039 ppm2      1.693 CV     1
 OR {   16}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HD3 ))
 ASSI {   21}
   (( segid "    " and resid 667  and name HA  ))
   (( segid "    " and resid 667  and name HG2 ))
      2.600     1.000     1.000 peak    21 spectrum    1 weight  0.10000E+01 volume  0.34415E-01 ppm1      3.828 ppm2      1.195 CV     1
 OR {   21}
   (( segid "    " and resid 667  and name HA  ))
   (( segid "    " and resid 667  and name HG3 ))
 ASSI {   24}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HG2 ))
      2.400     0.900     0.900 peak    24 spectrum    1 weight  0.10000E+01 volume  0.53912E-01 ppm1      4.338 ppm2      0.908 CV     1
 ASSI {   25}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB3 ))
      2.600     1.000     1.000 peak    25 spectrum    1 weight  0.10000E+01 volume  0.32790E-01 ppm1      4.339 ppm2      1.060 CV     1
 ASSI {   26}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HG3 ))
      2.200     0.800     0.800 peak    26 spectrum    1 weight  0.10000E+01 volume  0.80868E-01 ppm1      4.333 ppm2      0.673 CV     1
 ASSI {   27}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB2 ))
      3.800     2.000     2.000 peak    27 spectrum    1 weight  0.10000E+01 volume  0.33677E-02 ppm1      4.345 ppm2      1.453 CV     1
 ASSI {   31}
   (( segid "    " and resid 683  and name HA  ))
   (( segid "    " and resid 683  and name HB3 ))
      6.000     4.700     0.000 peak    31 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.280 ppm2      1.553 CV     1
 OR {   31}
   (( segid "    " and resid 683  and name HA  ))
   (( segid "    " and resid 683  and name HB2 ))
 ASSI {   36}
   (( segid "    " and resid 682  and name HA  ))
   (( segid "    " and resid 682  and name HD3 ))
      6.000     4.700     0.000 peak    36 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.362 ppm2      1.641 CV     1
 OR {   36}
   (( segid "    " and resid 682  and name HA  ))
   (( segid "    " and resid 682  and name HD2 ))
 ASSI {   40}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HG3 ))
      6.000     4.700     0.000 peak    40 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.332 ppm2      2.598 CV     1
 ASSI {   50}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HE% ))
      3.100     1.400     1.400 peak    50 spectrum    1 weight  0.10000E+01 volume  0.10709E-01 ppm1      5.684 ppm2      6.397 CV     1
 ASSI {   51}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HB3 ))
      2.300     0.800     0.800 peak    51 spectrum    1 weight  0.10000E+01 volume  0.76806E-01 ppm1      5.689 ppm2      2.696 CV     1
 ASSI {   52}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HB2 ))
      2.100     0.800     0.800 peak    52 spectrum    1 weight  0.10000E+01 volume  0.11853E+00 ppm1      5.689 ppm2      2.879 CV     1
 ASSI {   53}
   (( segid "    " and resid 676  and name HA  ))
   (( segid "    " and resid 676  and name HB3 ))
      3.300     1.600     1.600 peak    53 spectrum    1 weight  0.10000E+01 volume  0.76068E-02 ppm1      4.207 ppm2      1.634 CV     1
 ASSI {   55}
   (( segid "    " and resid 676  and name HA  ))
   (( segid "    " and resid 676  and name HD2 ))
      6.000     4.700     0.000 peak    55 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.210 ppm2      1.569 CV     1
 OR {   55}
   (( segid "    " and resid 676  and name HA  ))
   (( segid "    " and resid 676  and name HD3 ))
 ASSI {   62}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HG3 ))
      6.000     4.700     0.000 peak    62 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.458 ppm2      0.672 CV     1
 ASSI {   63}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HG2 ))
      6.000     4.700     0.000 peak    63 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.458 ppm2      0.914 CV     1
 ASSI {   65}
   (( segid "    " and resid 670  and name HB  ))
   (( segid "    " and resid 670  and name HG2%)))
      2.200     0.800     0.800 peak    65 spectrum    1 weight  0.10000E+01 volume  0.82345E-01 ppm1      1.895 ppm2      0.656 CV     1
 ASSI {   72}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HG  ))
      4.300     2.600     1.700 peak    72 spectrum    1 weight  0.10000E+01 volume  0.15214E-02 ppm1      4.520 ppm2      1.533 CV     1
 ASSI {   73}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB3 ))
      2.200     0.800     0.800 peak    73 spectrum    1 weight  0.10000E+01 volume  0.96008E-01 ppm1      4.881 ppm2      1.869 CV     1
 ASSI {   74}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
      2.900     1.200     1.200 peak    74 spectrum    1 weight  0.10000E+01 volume  0.17835E-01 ppm1      4.882 ppm2      2.051 CV     1
 ASSI {   79}
   (( segid "    " and resid 676  and name HB2 ))
   (( segid "    " and resid 676  and name HG3 ))
      6.000     4.700     0.000 peak    79 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.830 ppm2      1.277 CV     1
 ASSI {   80}
   (( segid "    " and resid 676  and name HB2 ))
   (( segid "    " and resid 676  and name HD3 ))
      6.000     4.700     0.000 peak    80 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.830 ppm2      1.575 CV     1
 OR {   80}
   (( segid "    " and resid 676  and name HB2 ))
   (( segid "    " and resid 676  and name HD2 ))
 ASSI {   81}
   (( segid "    " and resid 676  and name HB2 ))
   (( segid "    " and resid 676  and name HB3 ))
      6.000     4.700     0.000 peak    81 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.830 ppm2      1.638 CV     1
 ASSI {   83}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HG3 ))
      6.000     4.700     0.000 peak    83 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.496 ppm2      1.289 CV     1
 OR {   83}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HG3 ))
 ASSI {   84}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HB3 ))
      6.000     4.700     0.000 peak    84 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.343 ppm2      3.169 CV     1
 ASSI {   90}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HB3 ))
      6.000     4.700     0.000 peak    90 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.949 ppm2      3.572 CV     1
 ASSI {   98}
   (( segid "    " and resid 33   and name HB3 ))
   (( segid "    " and resid 33   and name HB2 ))
      6.000     4.700     0.000 peak    98 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.461 ppm2      1.803 CV     1
 ASSI {  102}
   (( segid "    " and resid 33   and name HB3 ))
   (( segid "    " and resid 33   and name HD2 ))
      6.000     4.700     0.000 peak   102 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.467 ppm2      2.936 CV     1
 ASSI {  104}
   (( segid "    " and resid 33   and name HB3 ))
   (( segid "    " and resid 33   and name HA  ))
      6.000     4.700     0.000 peak   104 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.467 ppm2      3.727 CV     1
 ASSI {  105}
   (( segid "    " and resid 33   and name HB3 ))
   (( segid "    " and resid 33   and name HG3 ))
      3.500     1.700     1.700 peak   105 spectrum    1 weight  0.10000E+01 volume  0.55758E-02 ppm1      1.467 ppm2      0.375 CV     1
 ASSI {  107}
   (( segid "    " and resid 29   and name HD3 ))
   (( segid "    " and resid 29   and name HE3 ))
      6.000     4.700     0.000 peak   107 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.156 ppm2      2.448 CV     1
 OR {  107}
   (( segid "    " and resid 29   and name HD2 ))
   (( segid "    " and resid 29   and name HE3 ))
 ASSI {  108}
   (( segid "    " and resid 676  and name HD3 ))
   (( segid "    " and resid 676  and name HG3 ))
      6.000     4.700     0.000 peak   108 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.568 ppm2      1.280 CV     1
 OR {  108}
   (( segid "    " and resid 676  and name HD2 ))
   (( segid "    " and resid 676  and name HG3 ))
 ASSI {  113}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 62   and name HA  ))
      2.700     1.100     1.100 peak   113 spectrum    1 weight  0.10000E+01 volume  0.25812E-01 ppm1      4.160 ppm2      4.511 CV     1
 ASSI {  116}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HG3 ))
      4.800     3.000     1.200 peak   116 spectrum    1 weight  0.10000E+01 volume  0.89357E-03 ppm1      2.218 ppm2      2.436 CV     1
 ASSI {  117}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HG2 ))
      4.800     3.000     1.200 peak   117 spectrum    1 weight  0.10000E+01 volume  0.88994E-03 ppm1      2.224 ppm2      2.507 CV     1
 ASSI {  118}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HG3 ))
      4.200     2.400     1.800 peak   118 spectrum    1 weight  0.10000E+01 volume  0.18352E-02 ppm1      2.036 ppm2      2.436 CV     1
 ASSI {  119}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HG2 ))
      4.700     3.000     1.300 peak   119 spectrum    1 weight  0.10000E+01 volume  0.94157E-03 ppm1      2.042 ppm2      2.504 CV     1
 ASSI {  125}
   (( segid "    " and resid 665  and name HB2 ))
   (( segid "    " and resid 665  and name HG2 ))
      6.000     4.700     0.000 peak   125 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.766 ppm2      1.835 CV     1
 ASSI {  128}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 67   and name HG2 ))
      6.000     4.700     0.000 peak   128 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.692 ppm2      0.911 CV     1
 ASSI {  131}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 67   and name HB3 ))
      6.000     4.700     0.000 peak   131 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.698 ppm2      1.054 CV     1
 ASSI {  133}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 67   and name HB2 ))
      6.000     4.700     0.000 peak   133 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.692 ppm2      1.453 CV     1
 ASSI {  134}
   (( segid "    " and resid 67   and name HD3 ))
   (( segid "    " and resid 67   and name HG2 ))
      6.000     4.700     0.000 peak   134 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.299 ppm2      0.913 CV     1
 ASSI {  135}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 67   and name HD3 ))
      6.000     4.700     0.000 peak   135 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.698 ppm2      0.312 CV     1
 ASSI {  137}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 67   and name HE3 ))
      3.200     1.500     1.500 peak   137 spectrum    1 weight  0.10000E+01 volume  0.97850E-02 ppm1      0.692 ppm2      2.401 CV     1
 OR {  137}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 67   and name HE2 ))
 ASSI {  138}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HE3 ))
      2.700     1.100     1.100 peak   138 spectrum    1 weight  0.10000E+01 volume  0.25368E-01 ppm1      0.964 ppm2      2.462 CV     1
 OR {  138}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 21   and name HE2 ))
 OR {  138}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HE2 ))
 ASSI {  139}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HA  ))
      2.100     0.700     0.700 peak   139 spectrum    1 weight  0.10000E+01 volume  0.13515E+00 ppm1      0.968 ppm2      4.168 CV     1
 OR {  139}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  141}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 21   and name HB3 ))
      6.000     4.700     0.000 peak   141 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.962 ppm2      1.270 CV     1
 OR {  141}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HB3 ))
 ASSI {  142}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HG3 ))
      6.000     4.700     0.000 peak   142 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.968 ppm2      0.519 CV     1
 OR {  142}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 21   and name HG3 ))
 ASSI {  143}
   (( segid "    " and resid 60   and name HG12))))
   (( segid "    " and resid 60   and name HG13))))
      6.000     4.700     0.000 peak   143 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.512 ppm2      1.257 CV     1
 ASSI {  144}
   (( segid "    " and resid 60   and name HG12))))
   (( segid "    " and resid 60   and name HG2%)))
      6.000     4.700     0.000 peak   144 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.508 ppm2      0.929 CV     1
 ASSI {  146}
   (( segid "    " and resid 60   and name HG13))))
   (( segid "    " and resid 60   and name HB  ))
      6.000     4.700     0.000 peak   146 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.244 ppm2      1.849 CV     1
 ASSI {  147}
   (( segid "    " and resid 60   and name HG13))))
   (( segid "    " and resid 60   and name HG2%)))
      6.000     4.700     0.000 peak   147 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.255 ppm2      0.927 CV     1
 ASSI {  150}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 79   and name HD3 ))
      2.000     0.700     0.700 peak   150 spectrum    1 weight  0.10000E+01 volume  0.17799E+00 ppm1      1.367 ppm2      3.058 CV     1
 ASSI {  151}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 79   and name HG2 ))
      6.000     4.700     0.000 peak   151 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.355 ppm2      1.570 CV     1
 ASSI {  153}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HD2 ))
      2.100     0.700     0.700 peak   153 spectrum    1 weight  0.10000E+01 volume  0.13367E+00 ppm1      1.566 ppm2      3.366 CV     1
 ASSI {  155}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HD3 ))
      6.000     4.700     0.000 peak   155 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.566 ppm2      3.061 CV     1
 ASSI {  158}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 33   and name HA  ))
      3.500     1.700     1.700 peak   158 spectrum    1 weight  0.10000E+01 volume  0.53912E-02 ppm1      1.134 ppm2      3.735 CV     1
 ASSI {  165}
   (( segid "    " and resid 30   and name HG12))))
   (( segid "    " and resid 30   and name HD1%)))
      2.200     0.800     0.800 peak   165 spectrum    1 weight  0.10000E+01 volume  0.95636E-01 ppm1      1.238 ppm2      0.422 CV     1
 ASSI {  167}
   (( segid "    " and resid 30   and name HG12))))
   (( segid "    " and resid 30   and name HG2%)))
      6.000     4.700     0.000 peak   167 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.250 ppm2      0.911 CV     1
 ASSI {  169}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HG3 ))
      6.000     4.700     0.000 peak   169 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.501 ppm2      2.211 CV     1
 ASSI {  170}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 54   and name HG3 ))
      6.000     4.700     0.000 peak   170 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.353 ppm2      2.213 CV     1
 ASSI {  171}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 54   and name HB2 ))
      6.000     4.700     0.000 peak   171 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.359 ppm2      2.511 CV     1
 ASSI {  174}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 80   and name HB2 ))
      6.000     4.700     0.000 peak   174 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.633 ppm2      1.213 CV     1
 ASSI {  176}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name HE2 ))
      6.000     4.700     0.000 peak   176 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.665 ppm2      2.401 CV     1
 OR {  176}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name HE3 ))
 ASSI {  178}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name HB3 ))
      6.000     4.700     0.000 peak   178 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.669 ppm2      1.045 CV     1
 ASSI {  180}
   (( segid "    " and resid 667  and name HG2 ))
   (( segid "    " and resid 667  and name HB3 ))
      6.000     4.700     0.000 peak   180 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.188 ppm2      1.633 CV     1
 OR {  180}
   (( segid "    " and resid 667  and name HG3 ))
   (( segid "    " and resid 667  and name HB3 ))
 ASSI {  181}
   (( segid "    " and resid 667  and name HG3 ))
   (( segid "    " and resid 667  and name HB2 ))
      6.000     4.700     0.000 peak   181 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.185 ppm2      1.692 CV     1
 OR {  181}
   (( segid "    " and resid 667  and name HG2 ))
   (( segid "    " and resid 667  and name HB2 ))
 ASSI {  182}
   (( segid "    " and resid 27   and name HA1 ))
   (( segid "    " and resid 27   and name HA2 ))
      6.000     4.700     0.000 peak   182 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.254 ppm2      3.882 CV     1
 ASSI {  184}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HB3 ))
      6.000     4.700     0.000 peak   184 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.528 ppm2      1.270 CV     1
 ASSI {  185}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HA  ))
      2.300     0.900     0.900 peak   185 spectrum    1 weight  0.10000E+01 volume  0.69421E-01 ppm1      0.528 ppm2      4.168 CV     1
 ASSI {  186}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HE3 ))
      2.200     0.800     0.800 peak   186 spectrum    1 weight  0.10000E+01 volume  0.97115E-01 ppm1      0.528 ppm2      2.464 CV     1
 OR {  186}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HE2 ))
 ASSI {  192}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HB3 ))
      6.000     4.700     0.000 peak   192 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.053 ppm2      1.878 CV     1
 ASSI {  194}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HG  ))
      6.000     4.700     0.000 peak   194 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.059 ppm2      1.709 CV     1
 ASSI {  195}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 35   and name HG  ))
      6.000     4.700     0.000 peak   195 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.860 ppm2      1.709 CV     1
 ASSI {  197}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 35   and name HD2%)))
      6.000     4.700     0.000 peak   197 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.860 ppm2      0.758 CV     1
 ASSI {  205}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 80   and name HD2%)))
      6.000     4.700     0.000 peak   205 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.091 ppm2      0.582 CV     1
 ASSI {  209}
   (( segid "    " and resid 33   and name HD3 ))
   (( segid "    " and resid 33   and name HG3 ))
      2.400     0.900     0.900 peak   209 spectrum    1 weight  0.10000E+01 volume  0.60928E-01 ppm1      2.699 ppm2      0.380 CV     1
 ASSI {  212}
   (( segid "    " and resid 33   and name HD3 ))
   (( segid "    " and resid 33   and name HB2 ))
      3.300     1.500     1.500 peak   212 spectrum    1 weight  0.10000E+01 volume  0.82345E-02 ppm1      2.687 ppm2      1.812 CV     1
 ASSI {  214}
   (( segid "    " and resid 33   and name HD2 ))
   (( segid "    " and resid 33   and name HD3 ))
      6.000     4.700     0.000 peak   214 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.922 ppm2      2.678 CV     1
 ASSI {  216}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HD3 ))
      6.000     4.700     0.000 peak   216 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.350 ppm2      3.065 CV     1
 ASSI {  218}
   (( segid "    " and resid 79   and name HD3 ))
   (( segid "    " and resid 79   and name HB2 ))
      6.000     4.700     0.000 peak   218 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.057 ppm2      1.925 CV     1
 ASSI {  219}
   (( segid "    " and resid 79   and name HD3 ))
   (( segid "    " and resid 79   and name HB3 ))
      6.000     4.700     0.000 peak   219 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.057 ppm2      1.838 CV     1
 ASSI {  227}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HB3 ))
      6.000     4.700     0.000 peak   227 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.784 ppm2      3.565 CV     1
 ASSI {  246}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 670  and name HG2%)))
      2.000     0.700     0.700 peak   246 spectrum    1 weight  0.10000E+01 volume  0.13847E+00 ppm1      4.442 ppm2      0.655 CV     1
 ASSI {  247}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 670  and name HB  ))
      2.900     1.300     1.300 peak   247 spectrum    1 weight  0.10000E+01 volume  0.16358E-01 ppm1      4.436 ppm2      1.899 CV     1
 ASSI {  248}
   (( segid "    " and resid 670  and name HA  ))
   (( segid "    " and resid 670  and name HG1%)))
      2.000     0.700     0.700 peak   248 spectrum    1 weight  0.10000E+01 volume  0.15250E+00 ppm1      4.436 ppm2      0.728 CV     1
 ASSI {  250}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HA  ))
      4.600     2.800     1.400 peak   250 spectrum    1 weight  0.10000E+01 volume  0.11299E-02 ppm1      1.613 ppm2      3.891 CV     1
 ASSI {  251}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HD1%)))
      3.300     1.600     1.600 peak   251 spectrum    1 weight  0.10000E+01 volume  0.75329E-02 ppm1      1.619 ppm2      0.129 CV     1
 ASSI {  256}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
      2.500     1.000     1.000 peak   256 spectrum    1 weight  0.10000E+01 volume  0.39511E-01 ppm1      4.418 ppm2      3.512 CV     1
 ASSI {  257}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB3 ))
      2.700     1.100     1.100 peak   257 spectrum    1 weight  0.10000E+01 volume  0.24187E-01 ppm1      4.418 ppm2      3.293 CV     1
 ASSI {  260}
   (( segid "    " and resid 673  and name HB  ))
   (( segid "    " and resid 673  and name HG13))))
      6.000     4.700     0.000 peak   260 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.901 ppm2      1.227 CV     1
 ASSI {  261}
   (( segid "    " and resid 71   and name HG2%)))
   (( segid "    " and resid 71   and name HD1%)))
      6.000     4.700     0.000 peak   261 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.575 ppm2      0.638 CV     1
 ASSI {  262}
   (( segid "    " and resid 71   and name HG2%)))
   (( segid "    " and resid 71   and name HG12))))
      6.000     4.700     0.000 peak   262 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.569 ppm2      1.634 CV     1
 ASSI {  264}
   (( segid "    " and resid 71   and name HG2%)))
   (( segid "    " and resid 71   and name HG13))))
      6.000     4.700     0.000 peak   264 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.569 ppm2      0.927 CV     1
 ASSI {  273}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 82   and name HA2 ))
      6.000     4.700     0.000 peak   273 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.872 ppm2      3.619 CV     1
 ASSI {  277}
   (( segid "    " and resid 682  and name HE2 ))
   (( segid "    " and resid 682  and name HD2 ))
      6.000     4.700     0.000 peak   277 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.975 ppm2      1.642 CV     1
 OR {  277}
   (( segid "    " and resid 682  and name HE3 ))
   (( segid "    " and resid 682  and name HD3 ))
 OR {  277}
   (( segid "    " and resid 682  and name HE3 ))
   (( segid "    " and resid 682  and name HD2 ))
 ASSI {  281}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 40   and name HB2 ))
      2.300     0.900     0.900 peak   281 spectrum    1 weight  0.10000E+01 volume  0.62035E-01 ppm1      2.692 ppm2      2.951 CV     1
 ASSI {  283}
   (( segid "    " and resid 35   and name HD2%)))
   (( segid "    " and resid 35   and name HG  ))
      6.000     4.700     0.000 peak   283 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.751 ppm2      1.710 CV     1
 ASSI {  286}
   (( segid "    " and resid 57   and name HG  ))
   (( segid "    " and resid 57   and name HD1%)))
      6.000     4.700     0.000 peak   286 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.561 ppm2      0.680 CV     1
 ASSI {  287}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 33   and name HG3 ))
      2.300     0.900     0.900 peak   287 spectrum    1 weight  0.10000E+01 volume  0.66098E-01 ppm1      1.132 ppm2      0.378 CV     1
 ASSI {  289}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 33   and name HB2 ))
      2.700     1.100     1.100 peak   289 spectrum    1 weight  0.10000E+01 volume  0.23854E-01 ppm1      0.358 ppm2      1.807 CV     1
 ASSI {  290}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 33   and name HB2 ))
      6.000     4.700     0.000 peak   290 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.132 ppm2      1.807 CV     1
 ASSI {  291}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 33   and name HD2 ))
      2.400     0.900     0.900 peak   291 spectrum    1 weight  0.10000E+01 volume  0.55020E-01 ppm1      0.358 ppm2      2.924 CV     1
 ASSI {  293}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 33   and name HA  ))
      3.000     1.400     1.400 peak   293 spectrum    1 weight  0.10000E+01 volume  0.12887E-01 ppm1      0.358 ppm2      3.730 CV     1
 ASSI {  295}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 48   and name HD1%)))
      2.700     1.100     1.100 peak   295 spectrum    1 weight  0.10000E+01 volume  0.28359E-01 ppm1      0.575 ppm2      0.131 CV     1
 ASSI {  301}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 80   and name HD2%)))
      6.000     4.700     0.000 peak   301 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.633 ppm2      0.577 CV     1
 ASSI {  302}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 71   and name HD1%)))
      6.000     4.700     0.000 peak   302 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.590 ppm2      0.650 CV     1
 ASSI {  303}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 71   and name HG2%)))
      6.000     4.700     0.000 peak   303 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.590 ppm2      0.577 CV     1
 ASSI {  304}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 48   and name HD2%)))
      6.000     4.900     0.000 peak   304 spectrum    1 weight  0.10000E+01 volume  0.19682E-03 ppm1      1.584 ppm2     -0.810 CV     1
 ASSI {  309}
   (( segid "    " and resid 78   and name HG2%)))
   (( segid "    " and resid 78   and name HG13))))
      6.000     4.700     0.000 peak   309 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.856 ppm2      1.211 CV     1
 ASSI {  310}
   (( segid "    " and resid 78   and name HG2%)))
   (( segid "    " and resid 78   and name HG12))))
      6.000     4.700     0.000 peak   310 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.856 ppm2      1.746 CV     1
 ASSI {  311}
   (( segid "    " and resid 71   and name HG2%)))
   (( segid "    " and resid 48   and name HD2%)))
      3.000     1.300     1.300 peak   311 spectrum    1 weight  0.10000E+01 volume  0.13294E-01 ppm1      0.575 ppm2     -0.807 CV     1
 ASSI {  312}
   (( segid "    " and resid 71   and name HG2%)))
   (( segid "    " and resid 48   and name HD1%)))
      5.300     3.800     0.700 peak   312 spectrum    1 weight  0.10000E+01 volume  0.44311E-03 ppm1      0.575 ppm2      0.127 CV     1
 ASSI {  316}
   (( segid "    " and resid 55   and name HB% ))
   (( segid "    " and resid 73   and name HB3 ))
      6.000     4.700     0.000 peak   316 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.408 ppm2      2.892 CV     1
 ASSI {  318}
   (( segid "    " and resid 55   and name HB% ))
   (( segid "    " and resid 57   and name HD2%)))
      4.900     3.200     1.100 peak   318 spectrum    1 weight  0.10000E+01 volume  0.77175E-03 ppm1      1.414 ppm2      0.425 CV     1
 ASSI {  320}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HD3 ))
      6.000     4.700     0.000 peak   320 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.495 ppm2      3.076 CV     1
 OR {  320}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HD3 ))
 ASSI {  321}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HG2 ))
      6.000     4.700     0.000 peak   321 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.496 ppm2      1.425 CV     1
 OR {  321}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HG2 ))
 ASSI {  324}
   (( segid "    " and resid 22   and name HG3 ))
   (( segid "    " and resid 22   and name HD3 ))
      6.000     4.700     0.000 peak   324 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.273 ppm2      3.077 CV     1
 ASSI {  325}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HD3 ))
      6.000     4.700     0.000 peak   325 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.426 ppm2      3.072 CV     1
 ASSI {  326}
   (( segid "    " and resid 35   and name HD1%)))
   (( segid "    " and resid 35   and name HB2 ))
      6.000     4.700     0.000 peak   326 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.933 ppm2      2.051 CV     1
 ASSI {  327}
   (( segid "    " and resid 35   and name HD1%)))
   (( segid "    " and resid 35   and name HB3 ))
      6.000     4.700     0.000 peak   327 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.933 ppm2      1.875 CV     1
 ASSI {  328}
   (( segid "    " and resid 35   and name HD1%)))
   (( segid "    " and resid 35   and name HG  ))
      6.000     4.700     0.000 peak   328 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.933 ppm2      1.711 CV     1
 ASSI {  329}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HD2 ))
      6.000     4.700     0.000 peak   329 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.514 ppm2      1.178 CV     1
 OR {  329}
   (( segid "    " and resid 29   and name HB3 ))
   (( segid "    " and resid 29   and name HD3 ))
 OR {  329}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HD3 ))
 ASSI {  330}
   (( segid "    " and resid 29   and name HB3 ))
   (( segid "    " and resid 29   and name HG3 ))
      6.000     4.700     0.000 peak   330 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.514 ppm2      1.014 CV     1
 OR {  330}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HG3 ))
 ASSI {  333}
   (( segid "    " and resid 29   and name HD2 ))
   (( segid "    " and resid 29   and name HE2 ))
      6.000     4.700     0.000 peak   333 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.156 ppm2      2.481 CV     1
 OR {  333}
   (( segid "    " and resid 29   and name HD3 ))
   (( segid "    " and resid 29   and name HE2 ))
 ASSI {  334}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 29   and name HB2 ))
      6.000     4.700     0.000 peak   334 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.267 ppm2      1.514 CV     1
 OR {  334}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 29   and name HB3 ))
 ASSI {  337}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 29   and name HD3 ))
      6.000     4.700     0.000 peak   337 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.267 ppm2      1.181 CV     1
 OR {  337}
   (( segid "    " and resid 29   and name HG2 ))
   (( segid "    " and resid 29   and name HD2 ))
 ASSI {  339}
   (( segid "    " and resid 676  and name HB3 ))
   (( segid "    " and resid 676  and name HG2 ))
      6.000     4.700     0.000 peak   339 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.625 ppm2      1.342 CV     1
 ASSI {  340}
   (( segid "    " and resid 676  and name HB2 ))
   (( segid "    " and resid 676  and name HG2 ))
      6.000     4.700     0.000 peak   340 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.830 ppm2      1.342 CV     1
 ASSI {  341}
   (( segid "    " and resid 676  and name HB3 ))
   (( segid "    " and resid 676  and name HG3 ))
      6.000     4.700     0.000 peak   341 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.619 ppm2      1.274 CV     1
 ASSI {  342}
   (( segid "    " and resid 676  and name HB3 ))
   (( segid "    " and resid 676  and name HD3 ))
      6.000     4.700     0.000 peak   342 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.625 ppm2      1.575 CV     1
 OR {  342}
   (( segid "    " and resid 676  and name HB3 ))
   (( segid "    " and resid 676  and name HD2 ))
 ASSI {  345}
   (( segid "    " and resid 676  and name HD2 ))
   (( segid "    " and resid 676  and name HG2 ))
      6.000     4.700     0.000 peak   345 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.572 ppm2      1.345 CV     1
 OR {  345}
   (( segid "    " and resid 676  and name HD3 ))
   (( segid "    " and resid 676  and name HG2 ))
 ASSI {  346}
   (( segid "    " and resid 676  and name HD2 ))
   (( segid "    " and resid 676  and name HE3 ))
      6.000     4.700     0.000 peak   346 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.566 ppm2      2.910 CV     1
 OR {  346}
   (( segid "    " and resid 676  and name HD3 ))
   (( segid "    " and resid 676  and name HE3 ))
 ASSI {  347}
   (( segid "    " and resid 676  and name HD3 ))
   (( segid "    " and resid 676  and name HE2 ))
      6.000     4.700     0.000 peak   347 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.566 ppm2      2.941 CV     1
 OR {  347}
   (( segid "    " and resid 676  and name HD2 ))
   (( segid "    " and resid 676  and name HE2 ))
 ASSI {  349}
   (( segid "    " and resid 676  and name HG3 ))
   (( segid "    " and resid 676  and name HG2 ))
      6.000     4.700     0.000 peak   349 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.267 ppm2      1.350 CV     1
 ASSI {  354}
   (( segid "    " and resid 676  and name HG3 ))
   (( segid "    " and resid 676  and name HE2 ))
      6.000     4.700     0.000 peak   354 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.273 ppm2      2.936 CV     1
 ASSI {  355}
   (( segid "    " and resid 676  and name HG3 ))
   (( segid "    " and resid 676  and name HA  ))
      6.000     4.700     0.000 peak   355 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.267 ppm2      4.215 CV     1
 ASSI {  356}
   (( segid "    " and resid 676  and name HG2 ))
   (( segid "    " and resid 676  and name HA  ))
      6.000     4.700     0.000 peak   356 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.343 ppm2      4.215 CV     1
 ASSI {  357}
   (( segid "    " and resid 676  and name HG2 ))
   (( segid "    " and resid 676  and name HE2 ))
      6.000     4.700     0.000 peak   357 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.349 ppm2      2.936 CV     1
 ASSI {  358}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HE2 ))
      2.300     0.900     0.900 peak   358 spectrum    1 weight  0.10000E+01 volume  0.62035E-01 ppm1      0.845 ppm2      2.464 CV     1
 OR {  358}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HE3 ))
 ASSI {  359}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HG3 ))
      6.000     4.700     0.000 peak   359 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.845 ppm2      0.519 CV     1
 ASSI {  363}
   (( segid "    " and resid 57   and name HD1%)))
   (( segid "    " and resid 57   and name HB2 ))
      6.000     4.700     0.000 peak   363 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.680 ppm2      1.429 CV     1
 ASSI {  368}
   (( segid "    " and resid 57   and name HG  ))
   (( segid "    " and resid 57   and name HD2%)))
      2.800     1.200     1.200 peak   368 spectrum    1 weight  0.10000E+01 volume  0.21971E-01 ppm1      1.555 ppm2      0.425 CV     1
 ASSI {  371}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 666  and name HD% ))
      3.400     1.600     1.600 peak   371 spectrum    1 weight  0.10000E+01 volume  0.68313E-02 ppm1      4.345 ppm2      7.237 CV     1
 ASSI {  376}
   (( segid "    " and resid 667  and name HG2 ))
   (( segid "    " and resid 65   and name HD% ))
      5.700     4.300     0.300 peak   376 spectrum    1 weight  0.10000E+01 volume  0.30058E-03 ppm1      1.182 ppm2      6.505 CV     1
 OR {  376}
   (( segid "    " and resid 667  and name HG3 ))
   (( segid "    " and resid 65   and name HD% ))
 ASSI {  379}
   (( segid "    " and resid 667  and name HG2 ))
   (( segid "    " and resid 667  and name HE2 ))
      2.300     0.900     0.900 peak   379 spectrum    1 weight  0.10000E+01 volume  0.71267E-01 ppm1      1.182 ppm2      2.958 CV     1
 OR {  379}
   (( segid "    " and resid 667  and name HG3 ))
   (( segid "    " and resid 667  and name HE2 ))
 OR {  379}
   (( segid "    " and resid 667  and name HG2 ))
   (( segid "    " and resid 667  and name HE3 ))
 ASSI {  385}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 72   and name HD2%)))
      6.000     4.700     0.000 peak   385 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.197 ppm2      1.116 CV     1
 OR {  385}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 72   and name HD1%)))
 ASSI {  388}
   (( segid "    " and resid 70   and name HE% ))
   (( segid "    " and resid 68   and name HB3 ))
      2.500     1.000     1.000 peak   388 spectrum    1 weight  0.10000E+01 volume  0.42464E-01 ppm1      2.197 ppm2      3.841 CV     1
 ASSI {  390}
   (( segid "    " and resid 670  and name HG1%)))
   (( segid "    " and resid 48   and name HD1%)))
      2.000     0.700     0.700 peak   390 spectrum    1 weight  0.10000E+01 volume  0.14179E+00 ppm1      0.724 ppm2      0.128 CV     1
 ASSI {  391}
   (( segid "    " and resid 670  and name HG2%)))
   (( segid "    " and resid 668  and name HG3 ))
      6.000     4.700     0.000 peak   391 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.648 ppm2      2.198 CV     1
 OR {  391}
   (( segid "    " and resid 670  and name HG2%)))
   (( segid "    " and resid 668  and name HG2 ))
 ASSI {  393}
   (( segid "    " and resid 670  and name HG2%)))
   (( segid "    " and resid 38   and name HB% ))
      6.000     4.700     0.000 peak   393 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.648 ppm2      1.161 CV     1
 ASSI {  394}
   (( segid "    " and resid 670  and name HG2%)))
   (( segid "    " and resid 48   and name HD1%)))
      3.100     1.400     1.400 peak   394 spectrum    1 weight  0.10000E+01 volume  0.11521E-01 ppm1      0.648 ppm2      0.126 CV     1
 ASSI {  395}
   (( segid "    " and resid 672  and name HB  ))
   (( segid "    " and resid 36   and name HD2%)))
      6.000     6.000     0.000 peak   395 spectrum    1 weight  0.10000E+01 volume  0.26993E-04 ppm1      2.039 ppm2      0.851 CV     1
 ASSI {  401}
   (( segid "    " and resid 673  and name HB  ))
   (( segid "    " and resid 673  and name HG2%)))
      6.000     4.700     0.000 peak   401 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.892 ppm2      0.766 CV     1
 ASSI {  402}
   (( segid "    " and resid 675  and name HG2%)))
   (( segid "    " and resid 676  and name HA  ))
      6.000     4.700     0.000 peak   402 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.223 ppm2      4.228 CV     1
 ASSI {  404}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 43   and name HD1 ))
      3.500     1.700     1.700 peak   404 spectrum    1 weight  0.10000E+01 volume  0.53912E-02 ppm1      1.147 ppm2      6.965 CV     1
 ASSI {  405}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 668  and name HG3 ))
      6.000     4.700     0.000 peak   405 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.147 ppm2      2.203 CV     1
 OR {  405}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 668  and name HG2 ))
 ASSI {  406}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 39   and name HE% ))
      6.000     4.700     0.000 peak   406 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.153 ppm2      1.588 CV     1
 ASSI {  407}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 48   and name HD1%)))
      3.300     1.600     1.600 peak   407 spectrum    1 weight  0.10000E+01 volume  0.77175E-02 ppm1      1.153 ppm2      0.128 CV     1
 ASSI {  410}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HD1%)))
      6.000     4.700     0.000 peak   410 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.517 ppm2      0.806 CV     1
 ASSI {  413}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name HD1%)))
      6.000     4.700     0.000 peak   413 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.329 ppm2      0.806 CV     1
 ASSI {  418}
   (( segid "    " and resid 35   and name HD1%)))
   (( segid "    " and resid 35   and name HD2%)))
      6.000     4.700     0.000 peak   418 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.959 ppm2      0.762 CV     1
 ASSI {  423}
   (( segid "    " and resid 60   and name HG13))))
   (( segid "    " and resid 60   and name HD1%)))
      6.000     4.700     0.000 peak   423 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.258 ppm2      0.872 CV     1
 ASSI {  428}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 46   and name HD3 ))
      6.000     4.700     0.000 peak   428 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.341 ppm2      3.130 CV     1
 OR {  428}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 46   and name HD2 ))
 ASSI {  431}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 33   and name HD2 ))
      3.000     1.300     1.300 peak   431 spectrum    1 weight  0.10000E+01 volume  0.14106E-01 ppm1      1.135 ppm2      2.923 CV     1
 ASSI {  435}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 36   and name HD1%)))
      6.000     4.700     0.000 peak   435 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.114 ppm2      0.902 CV     1
 ASSI {  436}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 57   and name HB3 ))
      6.000     4.700     0.000 peak   436 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.114 ppm2      0.966 CV     1
 ASSI {  439}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 57   and name HB2 ))
      6.000     5.300     0.000 peak   439 spectrum    1 weight  0.10000E+01 volume  0.15324E-03 ppm1      0.120 ppm2      1.449 CV     1
 ASSI {  440}
   (( segid "    " and resid 48   and name HD1%)))
   (( segid "    " and resid 36   and name HB3 ))
      2.500     1.000     1.000 peak   440 spectrum    1 weight  0.10000E+01 volume  0.45050E-01 ppm1      0.120 ppm2      1.238 CV     1
 ASSI {  441}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 50   and name HA  ))
      2.700     1.100     1.100 peak   441 spectrum    1 weight  0.10000E+01 volume  0.26956E-01 ppm1      2.819 ppm2      4.242 CV     1
 ASSI {  442}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
      2.900     1.300     1.300 peak   442 spectrum    1 weight  0.10000E+01 volume  0.16691E-01 ppm1      3.406 ppm2      4.247 CV     1
 ASSI {  443}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 55   and name HB% ))
      5.500     4.000     0.500 peak   443 spectrum    1 weight  0.10000E+01 volume  0.35559E-03 ppm1      2.819 ppm2      1.419 CV     1
 ASSI {  444}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 55   and name HB% ))
      2.600     1.100     1.100 peak   444 spectrum    1 weight  0.10000E+01 volume  0.32310E-01 ppm1      3.406 ppm2      1.419 CV     1
 ASSI {  445}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 57   and name HD1%)))
      5.100     3.400     0.900 peak   445 spectrum    1 weight  0.10000E+01 volume  0.59082E-03 ppm1      2.819 ppm2      0.682 CV     1
 ASSI {  447}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 57   and name HD2%)))
      4.900     3.200     1.100 peak   447 spectrum    1 weight  0.10000E+01 volume  0.74590E-03 ppm1      3.406 ppm2      0.428 CV     1
 ASSI {  448}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 57   and name HD2%)))
      2.700     1.100     1.100 peak   448 spectrum    1 weight  0.10000E+01 volume  0.29430E-01 ppm1      2.819 ppm2      0.428 CV     1
 ASSI {  449}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 76   and name HB3 ))
      6.000     4.700     0.000 peak   449 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.564 ppm2      2.550 CV     1
 ASSI {  450}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 76   and name HB3 ))
      6.000     4.700     0.000 peak   450 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.782 ppm2      2.552 CV     1
 ASSI {  453}
   (( segid "    " and resid 55   and name HB% ))
   (( segid "    " and resid 57   and name HD1%)))
      6.000     4.700     0.000 peak   453 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.411 ppm2      0.675 CV     1
 ASSI {  454}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG3 ))
      2.800     1.200     1.200 peak   454 spectrum    1 weight  0.10000E+01 volume  0.22156E-01 ppm1      4.521 ppm2      1.262 CV     1
 ASSI {  455}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HB3 ))
      2.000     0.700     0.700 peak   455 spectrum    1 weight  0.10000E+01 volume  0.17799E+00 ppm1      4.521 ppm2      2.496 CV     1
 ASSI {  459}
   (( segid "    " and resid 57   and name HD2%)))
   (( segid "    " and resid 71   and name HG2%)))
      6.000     4.700     0.000 peak   459 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.419 ppm2      0.581 CV     1
 ASSI {  461}
   (( segid "    " and resid 57   and name HD2%)))
   (( segid "    " and resid 64   and name HB3 ))
      6.000     4.700     0.000 peak   461 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.419 ppm2      3.449 CV     1
 ASSI {  462}
   (( segid "    " and resid 57   and name HD2%)))
   (( segid "    " and resid 73   and name HB2 ))
      6.000     4.700     0.000 peak   462 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.419 ppm2      3.548 CV     1
 ASSI {  463}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 67   and name HB3 ))
      6.000     4.700     0.000 peak   463 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.151 ppm2      1.067 CV     1
 ASSI {  467}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 77   and name HE% ))
      3.200     1.500     1.500 peak   467 spectrum    1 weight  0.10000E+01 volume  0.88622E-02 ppm1      1.047 ppm2      6.197 CV     1
 ASSI {  468}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 77   and name HE% ))
      2.600     1.000     1.000 peak   468 spectrum    1 weight  0.10000E+01 volume  0.36594E-01 ppm1      1.446 ppm2      6.195 CV     1
 ASSI {  470}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HB3 ))
      6.000     4.700     0.000 peak   470 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.464 ppm2      1.055 CV     1
 ASSI {  472}
   (( segid "    " and resid 70   and name HB3 ))
   (( segid "    " and resid 72   and name HD2%)))
      2.500     1.000     1.000 peak   472 spectrum    1 weight  0.10000E+01 volume  0.38034E-01 ppm1      1.933 ppm2      1.123 CV     1
 OR {  472}
   (( segid "    " and resid 70   and name HB3 ))
   (( segid "    " and resid 72   and name HD1%)))
 ASSI {  474}
   (( segid "    " and resid 39   and name HE% ))
   (( segid "    " and resid 48   and name HD1%)))
      6.000     4.700     0.000 peak   474 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.587 ppm2      0.128 CV     1
 ASSI {  478}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 57   and name HD1%)))
      2.800     1.200     1.200 peak   478 spectrum    1 weight  0.10000E+01 volume  0.22156E-01 ppm1      3.546 ppm2      0.679 CV     1
 ASSI {  480}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 57   and name HD2%)))
      2.600     1.100     1.100 peak   480 spectrum    1 weight  0.10000E+01 volume  0.29910E-01 ppm1      2.890 ppm2      0.433 CV     1
 ASSI {  484}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 78   and name HA  ))
      2.900     1.200     1.200 peak   484 spectrum    1 weight  0.10000E+01 volume  0.18020E-01 ppm1      3.623 ppm2      3.327 CV     1
 ASSI {  485}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 78   and name HA  ))
      2.900     1.200     1.200 peak   485 spectrum    1 weight  0.10000E+01 volume  0.17651E-01 ppm1      3.887 ppm2      3.327 CV     1
 ASSI {  487}
   (( segid "    " and resid 668  and name HG3 ))
   (( segid "    " and resid 66   and name HB  ))
      6.000     4.700     0.000 peak   487 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.194 ppm2      4.158 CV     1
 OR {  487}
   (( segid "    " and resid 668  and name HG2 ))
   (( segid "    " and resid 66   and name HB  ))
 ASSI {  492}
   (( segid "    " and resid 71   and name HD1%)))
   (( segid "    " and resid 48   and name HD2%)))
      6.000     4.700     0.000 peak   492 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.630 ppm2     -0.808 CV     1
 ASSI {  494}
   (( segid "    " and resid 71   and name HD1%)))
   (( segid "    " and resid 71   and name HG13))))
      6.000     4.700     0.000 peak   494 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.625 ppm2      0.929 CV     1
 ASSI {  495}
   (( segid "    " and resid 71   and name HD1%)))
   (( segid "    " and resid 71   and name HG12))))
      6.000     4.700     0.000 peak   495 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.625 ppm2      1.629 CV     1
 ASSI {  496}
   (( segid "    " and resid 71   and name HD1%)))
   (( segid "    " and resid 71   and name HB  ))
      6.000     4.700     0.000 peak   496 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.625 ppm2      1.697 CV     1
 ASSI {  502}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 43   and name HA  ))
      6.000     4.700     0.000 peak   502 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.416 ppm2      5.710 CV     1
 ASSI {  505}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 35   and name HD2%)))
      6.000     4.700     0.000 peak   505 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.416 ppm2      0.763 CV     1
 ASSI {  506}
   (( segid "    " and resid 30   and name HD1%)))
   (( segid "    " and resid 35   and name HD1%)))
      6.000     4.700     0.000 peak   506 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.416 ppm2      0.953 CV     1
 ASSI {  518}
   (( segid "    " and resid 667  and name HB2 ))
   (( segid "    " and resid 65   and name HE% ))
      6.000     4.700     0.000 peak   518 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.681 ppm2      6.442 CV     1
 ASSI {  519}
   (( segid "    " and resid 667  and name HB2 ))
   (( segid "    " and resid 65   and name HD% ))
      6.000     4.700     0.000 peak   519 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.678 ppm2      6.513 CV     1
 ASSI {  521}
   (( segid "    " and resid 667  and name HB2 ))
   (( segid "    " and resid 667  and name HG3 ))
      6.000     4.700     0.000 peak   521 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.681 ppm2      1.188 CV     1
 OR {  521}
   (( segid "    " and resid 667  and name HB2 ))
   (( segid "    " and resid 667  and name HG2 ))
 OR {  521}
   (( segid "    " and resid 667  and name HB2 ))
   (( segid "    " and resid 667  and name HD3 ))
 ASSI {  522}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 43   and name HZ2 ))
      6.000     4.700     0.000 peak   522 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.499 ppm2      7.058 CV     1
 OR {  522}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 43   and name HZ2 ))
 ASSI {  524}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 38   and name HB% ))
      6.000     4.700     0.000 peak   524 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.499 ppm2      1.150 CV     1
 OR {  524}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 38   and name HB% ))
 ASSI {  525}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 71   and name HD1%)))
      6.000     4.700     0.000 peak   525 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.499 ppm2      0.638 CV     1
 OR {  525}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 71   and name HD1%)))
 ASSI {  527}
   (( segid "    " and resid 38   and name HB% ))
   (( segid "    " and resid 39   and name HB3 ))
      6.000     4.700     0.000 peak   527 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.156 ppm2      2.098 CV     1
 ASSI {  531}
   (( segid "    " and resid 48   and name HD2%)))
   (( segid "    " and resid 43   and name HD1 ))
      6.000     4.700     0.000 peak   531 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1     -0.816 ppm2      6.952 CV     1
 OR {  531}
   (( segid "    " and resid 48   and name HD2%)))
   (( segid "    " and resid 43   and name HZ3 ))
 ASSI {  543}
   (( segid "    " and resid 671  and name HB  ))
   (( segid "    " and resid 671  and name HG2%)))
      6.000     4.700     0.000 peak   543 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.248 ppm2      1.265 CV     1
 ASSI {  551}
   (( segid "    " and resid 25   and name HA1 ))
   (( segid "    " and resid 43   and name HZ3 ))
      6.000     4.700     0.000 peak   551 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.336 ppm2      6.937 CV     1
 ASSI {  552}
   (( segid "    " and resid 25   and name HA2 ))
   (( segid "    " and resid 25   and name HA1 ))
      6.000     4.700     0.000 peak   552 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.002 ppm2      4.332 CV     1
 ASSI {  553}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 72   and name HD2%)))
      6.000     4.700     0.000 peak   553 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.639 ppm2      1.118 CV     1
 OR {  553}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 72   and name HD1%)))
 ASSI {  554}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 76   and name HB3 ))
      6.000     4.700     0.000 peak   554 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.097 ppm2      2.548 CV     1
 ASSI {  555}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 76   and name HB2 ))
      6.000     4.700     0.000 peak   555 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.097 ppm2      3.104 CV     1
 ASSI {  556}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 52   and name HB3 ))
      6.000     4.700     0.000 peak   556 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.097 ppm2      3.562 CV     1
 ASSI {  558}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 51   and name HB2 ))
      6.000     4.700     0.000 peak   558 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.097 ppm2      3.935 CV     1
 OR {  558}
   (( segid "    " and resid 72   and name HD2%)))
   (( segid "    " and resid 51   and name HB3 ))
 ASSI {  563}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 57   and name HD1%)))
      6.000     4.700     0.000 peak   563 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.606 ppm2      0.677 CV     1
 ASSI {  565}
   (( segid "    " and resid 36   and name HD2%)))
   (( segid "    " and resid 48   and name HD1%)))
      6.000     4.700     0.000 peak   565 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.854 ppm2      0.128 CV     1
 ASSI {  566}
   (( segid "    " and resid 663  and name HD2%)))
   (( segid "    " and resid 663  and name HA  ))
      6.000     4.700     0.000 peak   566 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.704 ppm2      4.341 CV     1
 ASSI {  568}
   (( segid "    " and resid 663  and name HD2%)))
   (( segid "    " and resid 65   and name HD% ))
      6.000     4.700     0.000 peak   568 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.701 ppm2      6.484 CV     1
 ASSI {  572}
   (( segid "    " and resid 663  and name HD2%)))
   (( segid "    " and resid 663  and name HB2 ))
      6.000     4.700     0.000 peak   572 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.701 ppm2      1.611 CV     1
 ASSI {  575}
   (( segid "    " and resid 663  and name HA  ))
   (( segid "    " and resid 663  and name HD1%)))
      6.000     4.700     0.000 peak   575 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.333 ppm2      0.618 CV     1
 ASSI {  576}
   (( segid "    " and resid 663  and name HB3 ))
   (( segid "    " and resid 663  and name HD1%)))
      6.000     4.700     0.000 peak   576 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.610 ppm2      0.616 CV     1
 OR {  576}
   (( segid "    " and resid 663  and name HB2 ))
   (( segid "    " and resid 663  and name HD1%)))
 ASSI {  581}
   (( segid "    " and resid 663  and name HB2 ))
   (( segid "    " and resid 666  and name HD% ))
      6.000     4.700     0.000 peak   581 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.616 ppm2      7.233 CV     1
 ASSI {  583}
   (( segid "    " and resid 663  and name HD1%)))
   (( segid "    " and resid 663  and name HG  ))
      6.000     4.700     0.000 peak   583 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.613 ppm2      1.564 CV     1
 ASSI {  586}
   (( segid "    " and resid 663  and name HD1%)))
   (( segid "    " and resid 65   and name HD% ))
      6.000     4.700     0.000 peak   586 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.613 ppm2      6.498 CV     1
 ASSI {  587}
   (( segid "    " and resid 78   and name HG13))))
   (( segid "    " and resid 78   and name HG12))))
      6.000     4.700     0.000 peak   587 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.235 ppm2      1.757 CV     1
 ASSI {  590}
   (( segid "    " and resid 78   and name HG13))))
   (( segid "    " and resid 65   and name HD% ))
      6.000     4.700     0.000 peak   590 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.235 ppm2      6.493 CV     1
 ASSI {  591}
   (( segid "    " and resid 78   and name HG12))))
   (( segid "    " and resid 65   and name HD% ))
      6.000     4.700     0.000 peak   591 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.757 ppm2      6.493 CV     1
 ASSI {  598}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 18   and name HA  ))
      6.000     4.700     0.000 peak   598 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.499 ppm2      4.242 CV     1
 ASSI {  599}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 18   and name HD1%)))
      6.000     4.700     0.000 peak   599 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.517 ppm2      0.806 CV     1
 ASSI {  600}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 18   and name HD2%)))
      6.000     4.700     0.000 peak   600 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.517 ppm2      0.755 CV     1
 ASSI {  601}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 18   and name HB3 ))
      6.000     4.700     0.000 peak   601 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.517 ppm2      1.351 CV     1
 ASSI {  602}
   (( segid "    " and resid 36   and name HD2%)))
   (( segid "    " and resid 672  and name HA  ))
      6.000     4.700     0.000 peak   602 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.854 ppm2      4.571 CV     1
 ASSI {  603}
   (( segid "    " and resid 671  and name HG2%)))
   (( segid "    " and resid 37   and name HE% ))
      6.000     4.700     0.000 peak   603 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.264 ppm2      6.395 CV     1
 ASSI {  612}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 30   and name HG12))))
      6.000     4.700     0.000 peak   612 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.341 ppm2      1.256 CV     1
 ASSI {  614}
   (( segid "    " and resid 674  and name HA  ))
   (( segid "    " and resid 34   and name HD% ))
      6.000     4.700     0.000 peak   614 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.773 ppm2      7.290 CV     1
 ASSI {  619}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 81   and name HD% ))
      6.000     4.700     0.000 peak   619 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.642 ppm2      6.846 CV     1
 ASSI {  620}
   (( segid "    " and resid 80   and name HD1%)))
   (( segid "    " and resid 81   and name HE% ))
      6.000     4.700     0.000 peak   620 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.642 ppm2      7.102 CV     1
 ASSI {  622}
   (( segid "    " and resid 46   and name HD3 ))
   (( segid "    " and resid 46   and name HB3 ))
      6.000     4.700     0.000 peak   622 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.113 ppm2      1.894 CV     1
 OR {  622}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HB3 ))
 OR {  622}
   (( segid "    " and resid 46   and name HD3 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI {  625}
   (( segid "    " and resid 67   and name HE3 ))
   (( segid "    " and resid 81   and name HE% ))
      6.000     4.700     0.000 peak   625 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.408 ppm2      7.091 CV     1
 OR {  625}
   (( segid "    " and resid 67   and name HE2 ))
   (( segid "    " and resid 81   and name HE% ))
 ASSI {  627}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HD2 ))
      6.000     4.700     0.000 peak   627 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.916 ppm2      3.363 CV     1
 ASSI {  628}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HG3 ))
      6.000     4.700     0.000 peak   628 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.916 ppm2      1.354 CV     1
 ASSI {  629}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HG2 ))
      6.000     4.700     0.000 peak   629 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.916 ppm2      1.558 CV     1
 ASSI {  633}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 49   and name HB3 ))
      6.000     4.700     0.000 peak   633 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.054 ppm2      1.314 CV     1
 OR {  633}
   (( segid "    " and resid 49   and name HE3 ))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI {  634}
   (( segid "    " and resid 49   and name HE3 ))
   (( segid "    " and resid 49   and name HG2 ))
      6.000     4.700     0.000 peak   634 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.054 ppm2      1.131 CV     1
 OR {  634}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 49   and name HG2 ))
 ASSI {  659}
   (( segid "    " and resid 71   and name HG13))))
   (( segid "    " and resid 71   and name HG12))))
      6.000     4.700     0.000 peak   659 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.921 ppm2      1.629 CV     1
 ASSI {  665}
   (( segid "    " and resid 70   and name HG3 ))
   (( segid "    " and resid 70   and name HE% ))
      6.000     4.700     0.000 peak   665 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.593 ppm2      2.204 CV     1
 ASSI {  684}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 70   and name HE% ))
      6.000     4.700     0.000 peak   684 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.248 ppm2      2.202 CV     1
 ASSI {  691}
   (( segid "    " and resid 21   and name HE2 ))
   (( segid "    " and resid 42   and name HD% ))
      6.000     4.700     0.000 peak   691 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.458 ppm2      7.236 CV     1
 OR {  691}
   (( segid "    " and resid 21   and name HE3 ))
   (( segid "    " and resid 42   and name HD% ))
 ASSI {  696}
   (( segid "    " and resid 35   and name HD1%)))
   (( segid "    " and resid 42   and name HD% ))
      6.000     4.700     0.000 peak   696 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.931 ppm2      7.240 CV     1
 ASSI {  698}
   (( segid "    " and resid 35   and name HD1%)))
   (( segid "    " and resid 42   and name HE% ))
      6.000     4.700     0.000 peak   698 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.931 ppm2      6.716 CV     1
 ASSI {  701}
   (( segid "    " and resid 668  and name HB3 ))
   (( segid "    " and resid 39   and name HB3 ))
      6.000     4.700     0.000 peak   701 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.420 ppm2      2.105 CV     1
 ASSI {  702}
   (( segid "    " and resid 46   and name HG3 ))
   (( segid "    " and resid 46   and name HB2 ))
      6.000     4.700     0.000 peak   702 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.610 ppm2      1.889 CV     1
 OR {  702}
   (( segid "    " and resid 46   and name HG3 ))
   (( segid "    " and resid 46   and name HB3 ))
 ASSI {  703}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 72   and name HD1%)))
      6.000     4.700     0.000 peak   703 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.546 ppm2      1.122 CV     1



! 7J = 5.86
assign (resid  646 and name C)  (resid  647 and name N)
       (resid  647 and name CA) (resid  647 and name C) 1.0   -60.0   40.0 2
! 11J = 2.83
assign (resid  650 and name C)  (resid  651 and name N)
       (resid  651 and name CA) (resid  651 and name C) 1.0   -60.0   40.0 2
! 13J = 10.51
assign (resid  652 and name C)  (resid  653 and name N)
       (resid  653 and name CA) (resid  653 and name C) 1.0  -120.0   40.0 2
! 15J = 0.85
assign (resid  654 and name C)  (resid  655 and name N)
       (resid  655 and name CA) (resid  655 and name C) 1.0   -60.0   40.0 2
! 18J = 1.05
assign (resid  657 and name C)  (resid  658 and name N)
       (resid  658 and name CA) (resid  658 and name C) 1.0   -60.0   40.0 2
! 26J = 1.41
assign (resid  665 and name C)  (resid  666 and name N)
       (resid  666 and name CA) (resid  666 and name C) 1.0   -60.0   40.0 2
! 27J = 4.87
assign (resid  666 and name C)  (resid  667 and name N)
       (resid  667 and name CA) (resid  667 and name C) 1.0   -60.0   40.0 2
! 31J = 4.55
assign (resid  670 and name C)  (resid  671 and name N)
       (resid  671 and name CA) (resid  671 and name C) 1.0   -60.0   40.0 2
! 33J = 8.51
assign (resid  672 and name C)  (resid  673 and name N)
       (resid  673 and name CA) (resid  673 and name C) 1.0  -120.0   40.0 2
! 37J = 5.07
assign (resid  676 and name C)  (resid  677 and name N)
       (resid  677 and name CA) (resid  677 and name C) 1.0   -60.0   40.0 2
! 39J = 13.73
assign (resid  678 and name C)  (resid  679 and name N)
       (resid  679 and name CA) (resid  679 and name C) 1.0  -120.0   40.0 2
! 52J = 0.69
assign (resid  906 and name C)  (resid  907 and name N)
       (resid  907 and name CA) (resid  907 and name C) 1.0   -60.0   40.0 2
! 54J = 1.39
assign (resid  908 and name C)  (resid  909 and name N)
       (resid  909 and name CA) (resid  909 and name C) 1.0   -60.0   40.0 2
! 58J = 1.39
assign (resid   18 and name C)  (resid   19 and name N)
       (resid   19 and name CA) (resid   19 and name C) 1.0   -60.0   40.0 2
! 71J = 5.26    
assign (resid   31 and name C)  (resid   32 and name N)
       (resid   32 and name CA) (resid   32 and name C) 1.0   -60.0   40.0 2
! 73J = 5.11
assign (resid   33 and name C)  (resid   34 and name N)
       (resid   34 and name CA) (resid   34 and name C) 1.0   -60.0   40.0 2
! 74J = 4.78
assign (resid   34 and name C)  (resid   35 and name N)
       (resid   35 and name CA) (resid   35 and name C) 1.0   -60.0   40.0 2
! 75J = 8.11
assign (resid   35 and name C)  (resid   36 and name N)
       (resid   36 and name CA) (resid   36 and name C) 1.0  -120.0   40.0 2
! 76J = 8.39 
assign (resid   36 and name C)  (resid   37 and name N)
       (resid   37 and name CA) (resid   37 and name C) 1.0  -120.0   40.0 2
! 82J = 8.18
assign (resid   42 and name C)  (resid   43 and name N)
       (resid   43 and name CA) (resid   43 and name C) 1.0  -120.0   40.0 2
! 83J = 12.76
assign (resid   43 and name C)  (resid   44 and name N)
       (resid   44 and name CA) (resid   44 and name C) 1.0  -120.0   40.0 2
! 86J = 1.50
assign (resid   46 and name C)  (resid   47 and name N)
       (resid   47 and name CA) (resid   47 and name C) 1.0   -60.0   40.0 2
! 88J = 8.58
assign (resid   48 and name C)  (resid   49 and name N)
       (resid   49 and name CA) (resid   49 and name C) 1.0  -120.0   40.0 2
! 90J = 3.79
assign (resid   50 and name C)  (resid   51 and name N)
       (resid   51 and name CA) (resid   51 and name C) 1.0   -60.0   40.0 2
! 91J = 9.59
assign (resid   51 and name C)  (resid   52 and name N)
       (resid   52 and name CA) (resid   52 and name C) 1.0  -120.0   40.0 2
! 95J = 5.01
assign (resid   55 and name C)  (resid   56 and name N)
       (resid   56 and name CA) (resid   56 and name C) 1.0   -60.0   40.0 2
! 98J = 5.91
assign (resid   58 and name C)  (resid   59 and name N)
       (resid   59 and name CA) (resid   59 and name C) 1.0   -60.0   40.0 2
! 101J = 1.22
assign (resid   61 and name C)  (resid   62 and name N)
       (resid   62 and name CA) (resid   62 and name C) 1.0   -60.0   40.0 2
! 102J = 4.57
assign (resid   62 and name C)  (resid   63 and name N)
       (resid   63 and name CA) (resid   63 and name C) 1.0   -60.0   40.0 2
! 114J = 3.58
assign (resid   74 and name C)  (resid   75 and name N)
       (resid   75 and name CA) (resid   75 and name C) 1.0   -60.0   40.0 2
! 116J = 4.98
assign (resid   76 and name C)  (resid   77 and name N)
       (resid   77 and name CA) (resid   77 and name C) 1.0   -60.0   40.0 2
! 118J = 3.13
assign (resid   78 and name C)  (resid   79 and name N)
       (resid   79 and name CA) (resid   79 and name C) 1.0   -60.0   40.0 2
! negative phi restraints (where aN i,i is clearly weaker than aN i,i+1)
! 8
assign (resid  647 and name C)  (resid  648 and name N)
       (resid  648 and name CA) (resid  648 and name C) 1.0  -100.0   80.0 2
! 9
assign (resid  648 and name C)  (resid  649 and name N)
       (resid  649 and name CA) (resid  649 and name C) 1.0  -100.0   80.0 2
! 11
assign (resid  650 and name C)  (resid  651 and name N)
       (resid  651 and name CA) (resid  651 and name C) 1.0  -100.0   80.0 2
!12
assign (resid  651 and name C)  (resid  652 and name N)
       (resid  652 and name CA) (resid  652 and name C) 1.0  -100.0   80.0 2
!13
assign (resid  652 and name C)  (resid  653 and name N)
       (resid  653 and name CA) (resid  653 and name C) 1.0  -100.0   80.0 2
!14
assign (resid  653 and name C)  (resid  654 and name N)
       (resid  654 and name CA) (resid  654 and name C) 1.0  -100.0   80.0 2
!15
assign (resid  654 and name C)  (resid  655 and name N)
       (resid  655 and name CA) (resid  655 and name C) 1.0  -100.0   80.0 2
!16
assign (resid  655 and name C)  (resid  656 and name N)
       (resid  656 and name CA) (resid  656 and name C) 1.0  -100.0   80.0 2
!17
assign (resid  656 and name C)  (resid  657 and name N)
       (resid  657 and name CA) (resid  657 and name C) 1.0  -100.0   80.0 2
!27
assign (resid  666 and name C)  (resid  667 and name N)
       (resid  667 and name CA) (resid  667 and name C) 1.0  -100.0   80.0 2
!28
assign (resid  667 and name C)  (resid  668 and name N)
       (resid  668 and name CA) (resid  668 and name C) 1.0  -100.0   80.0 2
!29
assign (resid  668 and name C)  (resid  669 and name N)
       (resid  669 and name CA) (resid  669 and name C) 1.0  -100.0   80.0 2
!30
assign (resid  669 and name C)  (resid  670 and name N)
       (resid  670 and name CA) (resid  670 and name C) 1.0  -100.0   80.0 2
!31
assign (resid  670 and name C)  (resid  671 and name N)
       (resid  671 and name CA) (resid  671 and name C) 1.0  -100.0   80.0 2
!32
assign (resid  671 and name C)  (resid  672 and name N)
       (resid  672 and name CA) (resid  672 and name C) 1.0  -100.0   80.0 2
!33
assign (resid  672 and name C)  (resid  673 and name N)
       (resid  673 and name CA) (resid  673 and name C) 1.0  -100.0   80.0 2
!34
assign (resid  673 and name C)  (resid  674 and name N)
       (resid  674 and name CA) (resid  674 and name C) 1.0  -100.0   80.0 2
!37
assign (resid  676 and name C)  (resid  677 and name N)
       (resid  677 and name CA) (resid  677 and name C) 1.0  -100.0   80.0 2
!40
assign (resid  679 and name C)  (resid  680 and name N)
       (resid  680 and name CA) (resid  680 and name C) 1.0  -100.0   80.0 2
!51
assign (resid  905 and name C)  (resid  906 and name N)
       (resid  906 and name CA) (resid  906 and name C) 1.0  -100.0   80.0 2
!52
assign (resid  906 and name C)  (resid  907 and name N)
       (resid  907 and name CA) (resid  907 and name C) 1.0  -100.0   80.0 2
!54
assign (resid  908 and name C)  (resid  909 and name N)
       (resid  909 and name CA) (resid  909 and name C) 1.0  -100.0   80.0 2
!57
assign (resid   17 and name C)  (resid   18 and name N)
       (resid   18 and name CA) (resid   18 and name C) 1.0  -100.0   80.0 2
!60
assign (resid   20 and name C)  (resid   21 and name N)
       (resid   21 and name CA) (resid   21 and name C) 1.0  -100.0   80.0 2
!73
assign (resid   33 and name C)  (resid   34 and name N)
       (resid   34 and name CA) (resid   34 and name C) 1.0  -100.0   80.0 2
!74
assign (resid   34 and name C)  (resid   35 and name N)
       (resid   35 and name CA) (resid   35 and name C) 1.0  -100.0   80.0 2
!75
assign (resid   35 and name C)  (resid   36 and name N)
       (resid   36 and name CA) (resid   36 and name C) 1.0  -100.0   80.0 2
!78
assign (resid   38 and name C)  (resid   39 and name N)
!       (resid  78 and name CA)  (resid 78 and name C) 1.0  -100.0   80.0 2
!83
assign (resid   43 and name C)  (resid   44 and name N)
       (resid   44 and name CA) (resid   44 and name C) 1.0  -100.0   80.0 2
!87
assign (resid   47 and name C)  (resid   48 and name N)
       (resid   48 and name CA) (resid   48 and name C) 1.0  -100.0   80.0 2
!88
assign (resid   48 and name C)  (resid   49 and name N)
       (resid   49 and name CA) (resid   49 and name C) 1.0  -100.0   80.0 2
!94
assign (resid   54 and name C)  (resid   55 and name N)
       (resid   55 and name CA) (resid   55 and name C) 1.0  -100.0   80.0 2
!95
assign (resid   55 and name C)  (resid   56 and name N)
       (resid   56 and name CA) (resid   56 and name C) 1.0  -100.0   80.0 2
!99
assign (resid   59 and name C)  (resid   60 and name N)
       (resid   60 and name CA) (resid   60 and name C) 1.0  -100.0   80.0 2
!103
assign (resid   63 and name C)  (resid   64 and name N)
       (resid   64 and name CA) (resid   64 and name C) 1.0  -100.0   80.0 2
!104
assign (resid   64 and name C)  (resid   65 and name N)
       (resid   65 and name CA) (resid   65 and name C) 1.0  -100.0   80.0 2
!105
assign (resid   65 and name C)  (resid   66 and name N)
       (resid   66 and name CA) (resid   66 and name C) 1.0  -100.0   80.0 2
!106
assign (resid   66 and name C)  (resid   67 and name N)
       (resid   67 and name CA) (resid   67 and name C) 1.0  -100.0   80.0 2
!111
assign (resid   71 and name C)  (resid   72 and name N)
       (resid   72 and name CA) (resid   72 and name C) 1.0  -100.0   80.0 2
!112
assign (resid   72 and name C)  (resid   73 and name N)
       (resid   73 and name CA) (resid   73 and name C) 1.0  -100.0   80.0 2




! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! /home/wai/aria/CtIP_LMO4_pred.tab
!
! settings: min phiError=20.0, min psiError=20.0, errorFactor=2.0
!

! Talos derived phi restraint:
assign (resid 650 and name C)  
       (resid 651 and name N)  
       (resid 651 and name CA) 
       (resid 651 and name C)  
       1.0 -67  20 2

! Talos derived phi restraint:
assign (resid 651 and name C)  
       (resid 652 and name N)  
       (resid 652 and name CA) 
       (resid 652 and name C)  
       1.0 -72  20 2

! Talos derived phi restraint:
assign (resid 657 and name C)  
       (resid 658 and name N)  
       (resid 658 and name CA) 
       (resid 658 and name C)  
       1.0 -78  39 2

! Talos derived phi restraint:
assign (resid 660 and name C)  
       (resid 661 and name N)  
       (resid 661 and name CA) 
       (resid 661 and name C)  
       1.0 -70  20 2

! Talos derived phi restraint:
assign (resid 663 and name C)  
       (resid 664 and name N)  
       (resid 664 and name CA) 
       (resid 664 and name C)  
       1.0 -64  20 2

! Talos derived phi restraint:
assign (resid 664 and name C)  
       (resid 665 and name N)  
       (resid 665 and name CA) 
       (resid 665 and name C)  
       1.0 -66  20 2

! Talos derived phi restraint:
assign (resid 666 and name C)  
       (resid 667 and name N)  
       (resid 667 and name CA) 
       (resid 667 and name C)  
       1.0 -66  20 2

! Talos derived phi restraint:
assign (resid 667 and name C)  
       (resid 668 and name N)  
       (resid 668 and name CA) 
       (resid 668 and name C)  
       1.0 -102  55 2

! Talos derived phi restraint:
assign (resid 668 and name C)  
       (resid 669 and name N)  
       (resid 669 and name CA) 
       (resid 669 and name C)  
       1.0 -79  20 2

! Talos derived phi restraint:
assign (resid 669 and name C)  
       (resid 670 and name N)  
       (resid 670 and name CA) 
       (resid 670 and name C)  
       1.0 -105  20 2

! Talos derived phi restraint:
assign (resid 670 and name C)  
       (resid 671 and name N)  
       (resid 671 and name CA) 
       (resid 671 and name C)  
       1.0 -120  31 2

! Talos derived phi restraint:
assign (resid 671 and name C)  
       (resid 672 and name N)  
       (resid 672 and name CA) 
       (resid 672 and name C)  
       1.0 -111  30 2

! Talos derived phi restraint:
assign (resid 672 and name C)  
       (resid 673 and name N)  
       (resid 673 and name CA) 
       (resid 673 and name C)  
       1.0 -105  20 2

! Talos derived phi restraint:
assign (resid 673 and name C)  
       (resid 674 and name N)  
       (resid 674 and name CA) 
       (resid 674 and name C)  
       1.0 -91  44 2

! Talos derived phi restraint:
assign (resid 675 and name C)  
       (resid 676 and name N)  
       (resid 676 and name CA) 
       (resid 676 and name C)  
       1.0 -77  26 2

! Talos derived phi restraint:
assign (resid 678 and name C)  
       (resid 679 and name N)  
       (resid 679 and name CA) 
       (resid 679 and name C)  
       1.0 -75  26 2

! Talos derived phi restraint:
assign (resid 681 and name C)  
       (resid 682 and name N)  
       (resid 682 and name CA) 
       (resid 682 and name C)  
       1.0 -73  30 2

! Talos derived phi restraint:
assign (resid 905 and name C)  
       (resid 906 and name N)  
       (resid 906 and name CA) 
       (resid 906 and name C)  
       1.0 -89  46 2

! Talos derived phi restraint:
assign (resid  20 and name C)  
       (resid  21 and name N)  
       (resid  21 and name CA) 
       (resid  21 and name C)  
       1.0 -100  49 2

! Talos derived phi restraint:
assign (resid  21 and name C)  
       (resid  22 and name N)  
       (resid  22 and name CA) 
       (resid  22 and name C)  
       1.0 -102  38 2

! Talos derived phi restraint:
assign (resid  22 and name C)  
       (resid  23 and name N)  
       (resid  23 and name CA) 
       (resid  23 and name C)  
       1.0 -96  74 2

! Talos derived phi restraint:
assign (resid  28 and name C)  
       (resid  29 and name N)  
       (resid  29 and name CA) 
       (resid  29 and name C)  
       1.0 -96  81 2

! Talos derived phi restraint:
assign (resid  29 and name C)  
       (resid  30 and name N)  
       (resid  30 and name CA) 
       (resid  30 and name C)  
       1.0 -84  47 2

! Talos derived phi restraint:
assign (resid  34 and name C)  
       (resid  35 and name N)  
       (resid  35 and name CA) 
       (resid  35 and name C)  
       1.0 -144  50 2

! Talos derived phi restraint:
assign (resid  35 and name C)  
       (resid  36 and name N)  
       (resid  36 and name CA) 
       (resid  36 and name C)  
       1.0 -130  20 2

! Talos derived phi restraint:
assign (resid  36 and name C)  
       (resid  37 and name N)  
       (resid  37 and name CA) 
       (resid  37 and name C)  
       1.0 -118  26 2

! Talos derived phi restraint:
assign (resid  40 and name C)  
       (resid  41 and name N)  
       (resid  41 and name CA) 
       (resid  41 and name C)  
       1.0 -113  47 2

! Talos derived phi restraint:
assign (resid  41 and name C)  
       (resid  42 and name N)  
       (resid  42 and name CA) 
       (resid  42 and name C)  
       1.0 -111  37 2

! Talos derived phi restraint:
assign (resid  42 and name C)  
       (resid  43 and name N)  
       (resid  43 and name CA) 
       (resid  43 and name C)  
       1.0 -134  33 2

! Talos derived phi restraint:
assign (resid  44 and name C)  
       (resid  45 and name N)  
       (resid  45 and name CA) 
       (resid  45 and name C)  
       1.0 -60  20 2

! Talos derived phi restraint:
assign (resid  48 and name C)  
       (resid  49 and name N)  
       (resid  49 and name CA) 
       (resid  49 and name C)  
       1.0 -114  29 2

! Talos derived phi restraint:
assign (resid  49 and name C)  
       (resid  50 and name N)  
       (resid  50 and name CA) 
       (resid  50 and name C)  
       1.0 -113  79 2

! Talos derived phi restraint:
assign (resid  50 and name C)  
       (resid  51 and name N)  
       (resid  51 and name CA) 
       (resid  51 and name C)  
       1.0 -59  20 2

! Talos derived phi restraint:
assign (resid  51 and name C)  
       (resid  52 and name N)  
       (resid  52 and name CA) 
       (resid  52 and name C)  
       1.0 -84  38 2

! Talos derived phi restraint:
assign (resid  52 and name C)  
       (resid  53 and name N)  
       (resid  53 and name CA) 
       (resid  53 and name C)  
       1.0 -95  29 2

! Talos derived phi restraint:
assign (resid  56 and name C)  
       (resid  57 and name N)  
       (resid  57 and name CA) 
       (resid  57 and name C)  
       1.0 -85  20 2

! Talos derived phi restraint:
assign (resid  61 and name C)  
       (resid  62 and name N)  
       (resid  62 and name CA) 
       (resid  62 and name C)  
       1.0 -85  44 2

! Talos derived phi restraint:
assign (resid  63 and name C)  
       (resid  64 and name N)  
       (resid  64 and name CA) 
       (resid  64 and name C)  
       1.0 -130  59 2

! Talos derived phi restraint:
assign (resid  64 and name C)  
       (resid  65 and name N)  
       (resid  65 and name CA) 
       (resid  65 and name C)  
       1.0 -134  31 2

! Talos derived phi restraint:
assign (resid  65 and name C)  
       (resid  66 and name N)  
       (resid  66 and name CA) 
       (resid  66 and name C)  
       1.0 -129  29 2

! Talos derived phi restraint:
assign (resid  68 and name C)  
       (resid  69 and name N)  
       (resid  69 and name CA) 
       (resid  69 and name C)  
       1.0  78  20 2

! Talos derived phi restraint:
assign (resid  69 and name C)  
       (resid  70 and name N)  
       (resid  70 and name CA) 
       (resid  70 and name C)  
       1.0 -105  56 2

! Talos derived phi restraint:
assign (resid  70 and name C)  
       (resid  71 and name N)  
       (resid  71 and name CA) 
       (resid  71 and name C)  
       1.0 -99  20 2

! Talos derived phi restraint:
assign (resid  71 and name C)  
       (resid  72 and name N)  
       (resid  72 and name CA) 
       (resid  72 and name C)  
       1.0 -125  37 2

! Talos derived phi restraint:
assign (resid  72 and name C)  
       (resid  73 and name N)  
       (resid  73 and name CA) 
       (resid  73 and name C)  
       1.0 -93  56 2

! Talos derived phi restraint:
assign (resid  73 and name C)  
       (resid  74 and name N)  
       (resid  74 and name CA) 
       (resid  74 and name C)  
       1.0 -60  20 2

! Talos derived phi restraint:
assign (resid  74 and name C)  
       (resid  75 and name N)  
       (resid  75 and name CA) 
       (resid  75 and name C)  
       1.0 -62  20 2

! Talos derived phi restraint:
assign (resid  75 and name C)  
       (resid  76 and name N)  
       (resid  76 and name CA) 
       (resid  76 and name C)  
       1.0 -67  20 2

! Talos derived phi restraint:
assign (resid  76 and name C)  
       (resid  77 and name N)  
       (resid  77 and name CA) 
       (resid  77 and name C)  
       1.0 -63  20 2

! Talos derived phi restraint:
assign (resid  77 and name C)  
       (resid  78 and name N)  
       (resid  78 and name CA) 
       (resid  78 and name C)  
       1.0 -62  20 2

! Talos derived phi restraint:
assign (resid  78 and name C)  
       (resid  79 and name N)  
       (resid  79 and name CA) 
       (resid  79 and name C)  
       1.0 -60  20 2

! Talos derived phi restraint:
assign (resid  79 and name C)  
       (resid  80 and name N)  
       (resid  80 and name CA) 
       (resid  80 and name C)  
       1.0 -75  23 2

! Talos derived psi restraint:
assign (resid 651 and name N)  
       (resid 651 and name CA) 
       (resid 651 and name C)  
       (resid 652 and name N)  
       1.0 -37  27 2

! Talos derived psi restraint:
assign (resid 652 and name N)  
       (resid 652 and name CA) 
       (resid 652 and name C)  
       (resid 653 and name N)  
       1.0 -34  20 2

! Talos derived psi restraint:
assign (resid 658 and name N)  
       (resid 658 and name CA) 
       (resid 658 and name C)  
       (resid 659 and name N)  
       1.0 141  32 2

! Talos derived psi restraint:
assign (resid 661 and name N)  
       (resid 661 and name CA) 
       (resid 661 and name C)  
       (resid 662 and name N)  
       1.0 -27  49 2

! Talos derived psi restraint:
assign (resid 664 and name N)  
       (resid 664 and name CA) 
       (resid 664 and name C)  
       (resid 665 and name N)  
       1.0 -35  25 2

! Talos derived psi restraint:
assign (resid 665 and name N)  
       (resid 665 and name CA) 
       (resid 665 and name C)  
       (resid 666 and name N)  
       1.0 -30  20 2

! Talos derived psi restraint:
assign (resid 667 and name N)  
       (resid 667 and name CA) 
       (resid 667 and name C)  
       (resid 668 and name N)  
       1.0 134  21 2

! Talos derived psi restraint:
assign (resid 668 and name N)  
       (resid 668 and name CA) 
       (resid 668 and name C)  
       (resid 669 and name N)  
       1.0 129  43 2

! Talos derived psi restraint:
assign (resid 669 and name N)  
       (resid 669 and name CA) 
       (resid 669 and name C)  
       (resid 670 and name N)  
       1.0 125  30 2

! Talos derived psi restraint:
assign (resid 670 and name N)  
       (resid 670 and name CA) 
       (resid 670 and name C)  
       (resid 671 and name N)  
       1.0 126  30 2

! Talos derived psi restraint:
assign (resid 671 and name N)  
       (resid 671 and name CA) 
       (resid 671 and name C)  
       (resid 672 and name N)  
       1.0 124  20 2

! Talos derived psi restraint:
assign (resid 672 and name N)  
       (resid 672 and name CA) 
       (resid 672 and name C)  
       (resid 673 and name N)  
       1.0 122  20 2

! Talos derived psi restraint:
assign (resid 673 and name N)  
       (resid 673 and name CA) 
       (resid 673 and name C)  
       (resid 674 and name N)  
       1.0 126  20 2

! Talos derived psi restraint:
assign (resid 674 and name N)  
       (resid 674 and name CA) 
       (resid 674 and name C)  
       (resid 675 and name N)  
       1.0 137  58 2

! Talos derived psi restraint:
assign (resid 676 and name N)  
       (resid 676 and name CA) 
       (resid 676 and name C)  
       (resid 677 and name N)  
       1.0 -17  49 2

! Talos derived psi restraint:
assign (resid 679 and name N)  
       (resid 679 and name CA) 
       (resid 679 and name C)  
       (resid 680 and name N)  
       1.0 -25  23 2

! Talos derived psi restraint:
assign (resid 682 and name N)  
       (resid 682 and name CA) 
       (resid 682 and name C)  
       (resid 683 and name N)  
       1.0 -26  39 2

! Talos derived psi restraint:
assign (resid 906 and name N)  
       (resid 906 and name CA) 
       (resid 906 and name C)  
       (resid 907 and name N)  
       1.0 127  47 2

! Talos derived psi restraint:
assign (resid  21 and name N)  
       (resid  21 and name CA) 
       (resid  21 and name C)  
       (resid  22 and name N)  
       1.0 130  41 2

! Talos derived psi restraint:
assign (resid  22 and name N)  
       (resid  22 and name CA) 
       (resid  22 and name C)  
       (resid  23 and name N)  
       1.0 133  38 2

! Talos derived psi restraint:
assign (resid  23 and name N)  
       (resid  23 and name CA) 
       (resid  23 and name C)  
       (resid  24 and name N)  
       1.0 125  29 2

! Talos derived psi restraint:
assign (resid  29 and name N)  
       (resid  29 and name CA) 
       (resid  29 and name C)  
       (resid  30 and name N)  
       1.0 137  55 2

! Talos derived psi restraint:
assign (resid  30 and name N)  
       (resid  30 and name CA) 
       (resid  30 and name C)  
       (resid  31 and name N)  
       1.0 131  21 2

! Talos derived psi restraint:
assign (resid  35 and name N)  
       (resid  35 and name CA) 
       (resid  35 and name C)  
       (resid  36 and name N)  
       1.0 156  42 2

! Talos derived psi restraint:
assign (resid  36 and name N)  
       (resid  36 and name CA) 
       (resid  36 and name C)  
       (resid  37 and name N)  
       1.0 145  25 2

! Talos derived psi restraint:
assign (resid  37 and name N)  
       (resid  37 and name CA) 
       (resid  37 and name C)  
       (resid  38 and name N)  
       1.0 126  23 2

! Talos derived psi restraint:
assign (resid  41 and name N)  
       (resid  41 and name CA) 
       (resid  41 and name C)  
       (resid  42 and name N)  
       1.0 138  32 2

! Talos derived psi restraint:
assign (resid  42 and name N)  
       (resid  42 and name CA) 
       (resid  42 and name C)  
       (resid  43 and name N)  
       1.0 148  39 2

! Talos derived psi restraint:
assign (resid  43 and name N)  
       (resid  43 and name CA) 
       (resid  43 and name C)  
       (resid  44 and name N)  
       1.0 143  39 2

! Talos derived psi restraint:
assign (resid  45 and name N)  
       (resid  45 and name CA) 
       (resid  45 and name C)  
       (resid  46 and name N)  
       1.0 -31  24 2

! Talos derived psi restraint:
assign (resid  49 and name N)  
       (resid  49 and name CA) 
       (resid  49 and name C)  
       (resid  50 and name N)  
       1.0 150  39 2

! Talos derived psi restraint:
assign (resid  50 and name N)  
       (resid  50 and name CA) 
       (resid  50 and name C)  
       (resid  51 and name N)  
       1.0 128  20 2

! Talos derived psi restraint:
assign (resid  51 and name N)  
       (resid  51 and name CA) 
       (resid  51 and name C)  
       (resid  52 and name N)  
       1.0 -25  29 2

! Talos derived psi restraint:
assign (resid  52 and name N)  
       (resid  52 and name CA) 
       (resid  52 and name C)  
       (resid  53 and name N)  
       1.0 -31  20 2

! Talos derived psi restraint:
assign (resid  53 and name N)  
       (resid  53 and name CA) 
       (resid  53 and name C)  
       (resid  54 and name N)  
       1.0 -11  24 2

! Talos derived psi restraint:
assign (resid  57 and name N)  
       (resid  57 and name CA) 
       (resid  57 and name C)  
       (resid  58 and name N)  
       1.0  -1  20 2

! Talos derived psi restraint:
assign (resid  62 and name N)  
       (resid  62 and name CA) 
       (resid  62 and name C)  
       (resid  63 and name N)  
       1.0 143  27 2

! Talos derived psi restraint:
assign (resid  64 and name N)  
       (resid  64 and name CA) 
       (resid  64 and name C)  
       (resid  65 and name N)  
       1.0 151  32 2

! Talos derived psi restraint:
assign (resid  65 and name N)  
       (resid  65 and name CA) 
       (resid  65 and name C)  
       (resid  66 and name N)  
       1.0 147  33 2

! Talos derived psi restraint:
assign (resid  66 and name N)  
       (resid  66 and name CA) 
       (resid  66 and name C)  
       (resid  67 and name N)  
       1.0 141  42 2

! Talos derived psi restraint:
assign (resid  69 and name N)  
       (resid  69 and name CA) 
       (resid  69 and name C)  
       (resid  70 and name N)  
       1.0   2  26 2

! Talos derived psi restraint:
assign (resid  70 and name N)  
       (resid  70 and name CA) 
       (resid  70 and name C)  
       (resid  71 and name N)  
       1.0 142  33 2

! Talos derived psi restraint:
assign (resid  71 and name N)  
       (resid  71 and name CA) 
       (resid  71 and name C)  
       (resid  72 and name N)  
       1.0 129  20 2

! Talos derived psi restraint:
assign (resid  72 and name N)  
       (resid  72 and name CA) 
       (resid  72 and name C)  
       (resid  73 and name N)  
       1.0 148  20 2

! Talos derived psi restraint:
assign (resid  73 and name N)  
       (resid  73 and name CA) 
       (resid  73 and name C)  
       (resid  74 and name N)  
       1.0 165  24 2

! Talos derived psi restraint:
assign (resid  74 and name N)  
       (resid  74 and name CA) 
       (resid  74 and name C)  
       (resid  75 and name N)  
       1.0 -36  20 2

! Talos derived psi restraint:
assign (resid  75 and name N)  
       (resid  75 and name CA) 
       (resid  75 and name C)  
       (resid  76 and name N)  
       1.0 -39  20 2

! Talos derived psi restraint:
assign (resid  76 and name N)  
       (resid  76 and name CA) 
       (resid  76 and name C)  
       (resid  77 and name N)  
       1.0 -39  20 2

! Talos derived psi restraint:
assign (resid  77 and name N)  
       (resid  77 and name CA) 
       (resid  77 and name C)  
       (resid  78 and name N)  
       1.0 -43  20 2

! Talos derived psi restraint:
assign (resid  78 and name N)  
       (resid  78 and name CA) 
       (resid  78 and name C)  
       (resid  79 and name N)  
       1.0 -44  20 2

! Talos derived psi restraint:
assign (resid  79 and name N)  
       (resid  79 and name CA) 
       (resid  79 and name C)  
       (resid  80 and name N)  
       1.0 -46  20 2

! Talos derived psi restraint:
assign (resid  80 and name N)  
       (resid  80 and name CA) 
       (resid  80 and name C)  
       (resid  81 and name N)  
       1.0 -36  26 2





  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    SER 641           1H       SER 641  55.161   3.672  -8.927
    2    HA   SER 641           HA       SER 641  53.960   4.252  -6.589
    3    HB2  SER 641           2HB      SER 641  52.097   4.627  -8.724
    4    HB3  SER 641           1HB      SER 641  53.169   5.819  -7.985
    5    HG   SER 641           HG       SER 641  53.296   4.897 -10.424
    6    H    LEU 642           H        LEU 642  51.801   3.971  -5.783
    7    HA   LEU 642           HA       LEU 642  50.394   1.567  -6.707
    8    HB2  LEU 642           2HB      LEU 642  51.860   1.745  -4.278
    9    HB3  LEU 642           1HB      LEU 642  50.157   1.713  -3.867
   10    HG   LEU 642           HG       LEU 642  51.107  -0.307  -5.825
   11   HD11  LEU 642          1HD1      LEU 642  52.019  -1.759  -4.188
   12   HD12  LEU 642          2HD1      LEU 642  52.845  -0.209  -4.008
   13   HD13  LEU 642          3HD1      LEU 642  51.572  -0.667  -2.875
   14   HD21  LEU 642          3HD2      LEU 642  48.756  -0.165  -5.171
   15   HD22  LEU 642          1HD2      LEU 642  49.476  -1.689  -4.647
   16   HD23  LEU 642          2HD2      LEU 642  49.210  -0.393  -3.480
   17    H    GLN 643           H        GLN 643  49.924   4.378  -7.075
   18    HA   GLN 643           HA       GLN 643  47.585   4.926  -5.421
   19    HB2  GLN 643           2HB      GLN 643  49.019   6.581  -7.511
   20    HB3  GLN 643           1HB      GLN 643  47.572   7.107  -6.662
   21    HG2  GLN 643           2HG      GLN 643  49.052   8.076  -5.285
   22    HG3  GLN 643           1HG      GLN 643  49.130   6.469  -4.565
   23   HE21  GLN 643          1HE2      GLN 643  51.017   8.896  -5.282
   24   HE22  GLN 643          2HE2      GLN 643  52.461   8.079  -5.796
   25    H    ASN 644           H        ASN 644  46.731   2.902  -6.504
   26    HA   ASN 644           HA       ASN 644  45.335   3.623  -8.989
   27    HB2  ASN 644           2HB      ASN 644  47.400   1.844  -8.931
   28    HB3  ASN 644           1HB      ASN 644  46.028   0.774  -8.656
   29   HD21  ASN 644          1HD2      ASN 644  47.892   2.304 -10.948
   30   HD22  ASN 644          2HD2      ASN 644  46.849   2.090 -12.318
   31    H    ASN 645           H        ASN 645  43.874   4.128  -6.977
   32    HA   ASN 645           HA       ASN 645  41.756   2.269  -7.031
   33    HB2  ASN 645           2HB      ASN 645  43.351   1.077  -5.450
   34    HB3  ASN 645           1HB      ASN 645  43.087   2.404  -4.320
   35   HD21  ASN 645          1HD2      ASN 645  42.059   1.209  -2.763
   36   HD22  ASN 645          2HD2      ASN 645  40.502   0.487  -2.988
   37    H    GLN 646           H        GLN 646  40.429   3.953  -7.407
   38    HA   GLN 646           HA       GLN 646  39.920   5.692  -5.101
   39    HB2  GLN 646           2HB      GLN 646  40.876   6.570  -7.602
   40    HB3  GLN 646           1HB      GLN 646  39.169   6.994  -7.564
   41    HG2  GLN 646           2HG      GLN 646  40.663   7.635  -5.116
   42    HG3  GLN 646           1HG      GLN 646  41.162   8.523  -6.553
   43   HE21  GLN 646          1HE2      GLN 646  40.181  10.003  -4.603
   44   HE22  GLN 646          2HE2      GLN 646  38.572  10.545  -4.952
   45    H    ASP 647           H        ASP 647  37.648   6.776  -5.484
   46    HA   ASP 647           HA       ASP 647  35.801   4.595  -5.792
   47    HB2  ASP 647           2HB      ASP 647  35.577   6.398  -4.044
   48    HB3  ASP 647           1HB      ASP 647  35.128   7.504  -5.341
   49    H    VAL 648           H        VAL 648  34.761   4.052  -7.575
   50    HA   VAL 648           HA       VAL 648  34.501   6.053  -9.703
   51    HB   VAL 648           HB       VAL 648  36.533   4.534  -9.988
   52   HG11  VAL 648          1HG1      VAL 648  35.390   2.417 -11.360
   53   HG12  VAL 648          2HG1      VAL 648  36.194   2.347  -9.790
   54   HG13  VAL 648          3HG1      VAL 648  34.442   2.540  -9.877
   55   HG21  VAL 648          3HG2      VAL 648  34.536   5.370 -11.921
   56   HG22  VAL 648          1HG2      VAL 648  36.295   5.491 -11.982
   57   HG23  VAL 648          2HG2      VAL 648  35.495   4.000 -12.480
   58    H    SER 649           H        SER 649  32.995   3.794  -7.793
   59    HA   SER 649           HA       SER 649  30.653   3.834  -9.511
   60    HB2  SER 649           2HB      SER 649  31.711   1.203  -8.453
   61    HB3  SER 649           1HB      SER 649  30.311   1.445  -9.498
   62    HG   SER 649           HG       SER 649  32.267   2.591 -10.754
   63    H    PHE 650           H        PHE 650  30.925   5.277  -7.216
   64    HA   PHE 650           HA       PHE 650  28.729   4.230  -5.708
   65    HB2  PHE 650           2HB      PHE 650  30.953   3.192  -4.765
   66    HB3  PHE 650           1HB      PHE 650  31.103   4.761  -3.977
   67    HD1  PHE 650           1HD      PHE 650  28.339   2.333  -4.618
   68    HD2  PHE 650           2HD      PHE 650  30.398   4.765  -1.795
   69    HE1  PHE 650           1HE      PHE 650  26.792   1.591  -2.851
   70    HE2  PHE 650           2HE      PHE 650  28.858   4.025  -0.030
   71    HZ   PHE 650           HZ       PHE 650  27.054   2.437  -0.552
   72    H    GLU 651           H        GLU 651  31.093   6.315  -4.161
   73    HA   GLU 651           HA       GLU 651  28.902   8.093  -3.614
   74    HB2  GLU 651           2HB      GLU 651  30.627   9.318  -2.228
   75    HB3  GLU 651           1HB      GLU 651  30.282   7.661  -1.761
   76    HG2  GLU 651           2HG      GLU 651  32.331   6.893  -2.479
   77    HG3  GLU 651           1HG      GLU 651  32.576   8.251  -3.575
   78    H    ASN 652           H        ASN 652  31.527   8.105  -5.865
   79    HA   ASN 652           HA       ASN 652  31.721  10.890  -6.278
   80    HB2  ASN 652           2HB      ASN 652  33.384   9.434  -7.259
   81    HB3  ASN 652           1HB      ASN 652  32.159   8.606  -8.216
   82   HD21  ASN 652          1HD2      ASN 652  32.366   9.125 -10.282
   83   HD22  ASN 652          2HD2      ASN 652  32.682  10.713 -10.895
   84    H    ILE 653           H        ILE 653  29.383   8.524  -7.305
   85    HA   ILE 653           HA       ILE 653  27.916  10.645  -8.736
   86    HB   ILE 653           HB       ILE 653  27.140   7.831  -9.235
   87   HG12  ILE 653          2HG1      ILE 653  29.192   8.492 -11.121
   88   HG13  ILE 653          1HG1      ILE 653  29.865   8.589  -9.495
   89   HG21  ILE 653          1HG2      ILE 653  25.990   9.694 -10.296
   90   HG22  ILE 653          2HG2      ILE 653  27.505  10.239 -11.016
   91   HG23  ILE 653          3HG2      ILE 653  26.803   8.695 -11.501
   92   HD11  ILE 653          3HD1      ILE 653  28.653   6.272  -9.224
   93   HD12  ILE 653          1HD1      ILE 653  28.810   6.251 -10.980
   94   HD13  ILE 653          2HD1      ILE 653  30.247   6.397  -9.970
   95    H    GLN 654           H        GLN 654  27.551  10.812  -6.166
   96    HA   GLN 654           HA       GLN 654  25.493   9.037  -5.195
   97    HB2  GLN 654           2HB      GLN 654  27.156  11.206  -4.084
   98    HB3  GLN 654           1HB      GLN 654  25.549  11.063  -3.385
   99    HG2  GLN 654           2HG      GLN 654  26.273   8.495  -3.315
  100    HG3  GLN 654           1HG      GLN 654  27.863   9.245  -3.213
  101   HE21  GLN 654          1HE2      GLN 654  24.896   8.609  -1.612
  102   HE22  GLN 654          2HE2      GLN 654  25.323   9.296  -0.078
  103    H    TRP 655           H        TRP 655  24.053   9.540  -7.030
  104    HA   TRP 655           HA       TRP 655  22.592  12.054  -6.656
  105    HB2  TRP 655           2HB      TRP 655  21.623  11.720  -8.812
  106    HB3  TRP 655           1HB      TRP 655  23.341  11.390  -8.967
  107    HD1  TRP 655           HD       TRP 655  23.778   8.487  -8.533
  108    HE1  TRP 655           1HE      TRP 655  22.576   6.631  -9.858
  109    HE3  TRP 655           3HE      TRP 655  19.716  11.148 -10.123
  110    HZ2  TRP 655           2HZ      TRP 655  20.204   6.349 -11.379
  111    HZ3  TRP 655           3HZ      TRP 655  18.027  10.019 -11.506
  112    HH2  TRP 655           HH       TRP 655  18.265   7.668 -12.122
  113    H    SER 656           H        SER 656  20.309  12.047  -6.394
  114    HA   SER 656           HA       SER 656  19.427   9.967  -4.636
  115    HB2  SER 656           2HB      SER 656  17.330  11.782  -5.409
  116    HB3  SER 656           1HB      SER 656  18.138  11.619  -3.849
  117    HG   SER 656           HG       SER 656  18.749  13.593  -4.401
  118    H    ILE 657           H        ILE 657  18.053   8.319  -5.045
  119    HA   ILE 657           HA       ILE 657  17.078   8.072  -7.817
  120    HB   ILE 657           HB       ILE 657  16.915   5.576  -7.201
  121   HG12  ILE 657          2HG1      ILE 657  19.193   5.933  -5.373
  122   HG13  ILE 657          1HG1      ILE 657  17.646   6.457  -4.715
  123   HG21  ILE 657          1HG2      ILE 657  18.571   5.594  -8.671
  124   HG22  ILE 657          2HG2      ILE 657  19.074   7.206  -8.158
  125   HG23  ILE 657          3HG2      ILE 657  19.704   5.780  -7.331
  126   HD11  ILE 657          3HD1      ILE 657  18.541   3.735  -5.520
  127   HD12  ILE 657          1HD1      ILE 657  17.725   4.267  -4.049
  128   HD13  ILE 657          2HD1      ILE 657  16.823   4.138  -5.559
  129    H    ASP 658           H        ASP 658  15.082   6.751  -8.059
  130    HA   ASP 658           HA       ASP 658  12.967   7.797  -6.477
  131    HB2  ASP 658           2HB      ASP 658  13.250   6.078  -8.827
  132    HB3  ASP 658           1HB      ASP 658  11.917   5.584  -7.789
  133    HA   PRO 659           HA       PRO 659  12.898   4.927  -3.143
  134    HB2  PRO 659           2HB      PRO 659  10.007   5.243  -2.905
  135    HB3  PRO 659           1HB      PRO 659  11.284   5.821  -1.833
  136    HG2  PRO 659           2HG      PRO 659   9.785   7.481  -3.360
  137    HG3  PRO 659           1HG      PRO 659  11.466   7.832  -2.923
  138    HD2  PRO 659           2HD      PRO 659  10.357   6.748  -5.486
  139    HD3  PRO 659           1HD      PRO 659  11.636   7.955  -5.233
  140    H    GLY 660           H        GLY 660  13.175   3.311  -5.120
  141    HA2  GLY 660           1HA      GLY 660  12.738   0.936  -5.117
  142    HA3  GLY 660           2HA      GLY 660  11.061   1.291  -4.732
  143    H    ALA 661           H        ALA 661  13.285   2.480  -7.228
  144    HA   ALA 661           HA       ALA 661  11.190   2.160  -9.225
  145    HB1  ALA 661           1HB      ALA 661  13.776   3.609  -9.080
  146    HB2  ALA 661           2HB      ALA 661  13.198   3.116 -10.672
  147    HB3  ALA 661           3HB      ALA 661  12.201   4.156  -9.655
  148    H    ASP 662           H        ASP 662  14.226   0.752  -8.254
  149    HA   ASP 662           HA       ASP 662  14.327  -0.972 -10.593
  150    HB2  ASP 662           2HB      ASP 662  16.498  -1.466 -10.008
  151    HB3  ASP 662           1HB      ASP 662  16.335   0.124  -9.275
  152    H    LEU 663           H        LEU 663  12.859  -0.958  -7.594
  153    HA   LEU 663           HA       LEU 663  12.764  -3.867  -7.359
  154    HB2  LEU 663           2HB      LEU 663  11.546  -1.722  -5.610
  155    HB3  LEU 663           1HB      LEU 663  11.533  -3.441  -5.269
  156    HG   LEU 663           HG       LEU 663  14.099  -1.896  -5.544
  157   HD11  LEU 663          1HD1      LEU 663  12.843  -2.538  -2.906
  158   HD12  LEU 663          2HD1      LEU 663  14.113  -1.374  -3.288
  159   HD13  LEU 663          3HD1      LEU 663  12.443  -1.041  -3.749
  160   HD21  LEU 663          3HD2      LEU 663  14.416  -4.242  -5.708
  161   HD22  LEU 663          1HD2      LEU 663  14.885  -3.778  -4.074
  162   HD23  LEU 663          2HD2      LEU 663  13.328  -4.550  -4.357
  163    H    SER 664           H        SER 664  11.579  -2.588  -9.637
  164    HA   SER 664           HA       SER 664   8.836  -2.063  -9.359
  165    HB2  SER 664           2HB      SER 664   9.436  -3.047 -11.981
  166    HB3  SER 664           1HB      SER 664   9.175  -1.379 -11.463
  167    HG   SER 664           HG       SER 664  11.292  -1.071 -11.287
  168    H    GLN 665           H        GLN 665  10.596  -5.038  -9.737
  169    HA   GLN 665           HA       GLN 665   8.393  -6.615 -10.631
  170    HB2  GLN 665           2HB      GLN 665  10.955  -7.505  -9.294
  171    HB3  GLN 665           1HB      GLN 665   9.840  -8.535 -10.181
  172    HG2  GLN 665           2HG      GLN 665  11.310  -8.185 -11.846
  173    HG3  GLN 665           1HG      GLN 665  10.352  -6.723 -12.079
  174   HE21  GLN 665          1HE2      GLN 665  11.850  -5.336 -12.802
  175   HE22  GLN 665          2HE2      GLN 665  13.278  -4.888 -11.926
  176    H    TYR 666           H        TYR 666   9.527  -5.552  -7.539
  177    HA   TYR 666           HA       TYR 666   7.811  -7.460  -6.126
  178    HB2  TYR 666           2HB      TYR 666   9.684  -5.387  -4.968
  179    HB3  TYR 666           1HB      TYR 666   8.895  -6.702  -4.102
  180    HD1  TYR 666           2HD      TYR 666   9.452  -9.116  -5.011
  181    HD2  TYR 666           1HD      TYR 666  11.856  -5.671  -5.682
  182    HE1  TYR 666           2HE      TYR 666  11.394 -10.563  -5.438
  183    HE2  TYR 666           1HE      TYR 666  13.803  -7.105  -6.116
  184    HH   TYR 666           HH       TYR 666  13.935  -9.813  -6.999
  185    H    LYS 667           H        LYS 667   7.606  -4.502  -7.529
  186    HA   LYS 667           HA       LYS 667   6.166  -3.068  -5.504
  187    HB2  LYS 667           2HB      LYS 667   7.577  -2.240  -7.615
  188    HB3  LYS 667           1HB      LYS 667   5.987  -2.278  -8.363
  189    HG2  LYS 667           2HG      LYS 667   5.131  -0.668  -6.886
  190    HG3  LYS 667           1HG      LYS 667   6.497  -0.836  -5.783
  191    HD2  LYS 667           2HD      LYS 667   7.976   0.069  -7.545
  192    HD3  LYS 667           1HD      LYS 667   6.560   0.320  -8.567
  193    HE2  LYS 667           2HE      LYS 667   6.074   2.234  -7.540
  194    HE3  LYS 667           1HE      LYS 667   6.153   1.464  -5.955
  195    HZ1  LYS 667           3HZ      LYS 667   7.756   3.301  -6.261
  196    HZ2  LYS 667           1HZ      LYS 667   8.524   2.398  -7.475
  197    HZ3  LYS 667           2HZ      LYS 667   8.494   1.821  -5.879
  198    H    MET 668           H        MET 668   3.996  -2.560  -5.477
  199    HA   MET 668           HA       MET 668   2.275  -4.064  -7.330
  200    HB2  MET 668           2HB      MET 668   0.681  -4.456  -5.612
  201    HB3  MET 668           1HB      MET 668   2.239  -4.885  -4.922
  202    HG2  MET 668           2HG      MET 668   1.553  -3.654  -3.191
  203    HG3  MET 668           1HG      MET 668   2.053  -2.288  -4.188
  204    HE1  MET 668           3HE      MET 668   0.403  -2.247  -1.842
  205    HE2  MET 668           1HE      MET 668  -0.989  -1.228  -2.204
  206    HE3  MET 668           2HE      MET 668  -1.209  -2.959  -1.939
  207    H    ASP 669           H        ASP 669   0.301  -2.986  -7.929
  208    HA   ASP 669           HA       ASP 669   0.617  -0.074  -7.839
  209    HB2  ASP 669           2HB      ASP 669   0.412  -1.134 -10.076
  210    HB3  ASP 669           1HB      ASP 669  -1.190  -1.714  -9.624
  211    H    VAL 670           H        VAL 670  -0.529   0.972  -6.387
  212    HA   VAL 670           HA       VAL 670  -2.842  -0.273  -5.178
  213    HB   VAL 670           HB       VAL 670  -2.190   2.553  -4.543
  214   HG11  VAL 670          1HG1      VAL 670  -3.663   0.466  -3.403
  215   HG12  VAL 670          2HG1      VAL 670  -2.284   0.716  -2.331
  216   HG13  VAL 670          3HG1      VAL 670  -3.357   2.062  -2.717
  217   HG21  VAL 670          3HG2      VAL 670  -0.170   0.461  -4.486
  218   HG22  VAL 670          1HG2      VAL 670  -0.003   2.203  -4.267
  219   HG23  VAL 670          2HG2      VAL 670  -0.446   1.181  -2.900
  220    H    THR 671           H        THR 671  -4.400  -0.325  -6.742
  221    HA   THR 671           HA       THR 671  -5.163   2.116  -8.112
  222    HB   THR 671           HB       THR 671  -6.672  -0.497  -8.244
  223    HG1  THR 671           1HG      THR 671  -4.119   0.114  -9.213
  224   HG21  THR 671          3HG2      THR 671  -7.745   0.431  -9.981
  225   HG22  THR 671          1HG2      THR 671  -6.247   1.042 -10.681
  226   HG23  THR 671          2HG2      THR 671  -7.077   1.965  -9.430
  227    H    VAL 672           H        VAL 672  -6.400   3.537  -7.091
  228    HA   VAL 672           HA       VAL 672  -8.152   2.659  -4.933
  229    HB   VAL 672           HB       VAL 672  -8.136   5.514  -5.732
  230   HG11  VAL 672          1HG1      VAL 672  -9.328   4.536  -3.742
  231   HG12  VAL 672          2HG1      VAL 672  -7.741   4.233  -3.033
  232   HG13  VAL 672          3HG1      VAL 672  -8.249   5.885  -3.384
  233   HG21  VAL 672          3HG2      VAL 672  -5.785   4.573  -4.151
  234   HG22  VAL 672          1HG2      VAL 672  -5.719   4.508  -5.913
  235   HG23  VAL 672          2HG2      VAL 672  -5.986   6.049  -5.095
  236    H    ILE 673           H        ILE 673 -10.056   1.880  -5.599
  237    HA   ILE 673           HA       ILE 673 -11.293   2.879  -8.022
  238    HB   ILE 673           HB       ILE 673 -11.906   0.623  -6.139
  239   HG12  ILE 673          2HG1      ILE 673 -12.028  -0.392  -8.632
  240   HG13  ILE 673          1HG1      ILE 673 -10.968   0.979  -8.933
  241   HG21  ILE 673          1HG2      ILE 673 -13.738   0.970  -8.420
  242   HG22  ILE 673          2HG2      ILE 673 -14.050   0.364  -6.793
  243   HG23  ILE 673          3HG2      ILE 673 -13.953   2.102  -7.085
  244   HD11  ILE 673          3HD1      ILE 673  -9.376   0.171  -7.337
  245   HD12  ILE 673          1HD1      ILE 673 -10.470  -1.119  -6.837
  246   HD13  ILE 673          2HD1      ILE 673  -9.776  -1.131  -8.458
  247    H    ASP 674           H        ASP 674 -12.733   4.454  -8.075
  248    HA   ASP 674           HA       ASP 674 -13.740   5.507  -5.570
  249    HB2  ASP 674           2HB      ASP 674 -13.999   7.504  -6.629
  250    HB3  ASP 674           1HB      ASP 674 -12.827   6.795  -7.731
  251    H    THR 675           H        THR 675 -15.786   5.472  -4.895
  252    HA   THR 675           HA       THR 675 -17.672   3.802  -6.358
  253    HB   THR 675           HB       THR 675 -18.915   4.640  -4.018
  254    HG1  THR 675           1HG      THR 675 -16.627   3.776  -2.864
  255   HG21  THR 675          3HG2      THR 675 -17.218   2.182  -4.459
  256   HG22  THR 675          1HG2      THR 675 -18.904   2.371  -4.936
  257   HG23  THR 675          2HG2      THR 675 -18.468   2.369  -3.227
  258    H    LYS 676           H        LYS 676 -18.921   4.834  -7.800
  259    HA   LYS 676           HA       LYS 676 -19.349   7.669  -7.652
  260    HB2  LYS 676           2HB      LYS 676 -20.670   7.350  -9.722
  261    HB3  LYS 676           1HB      LYS 676 -19.065   6.640  -9.822
  262    HG2  LYS 676           2HG      LYS 676 -20.057   4.794 -10.544
  263    HG3  LYS 676           1HG      LYS 676 -20.643   4.570  -8.894
  264    HD2  LYS 676           2HD      LYS 676 -22.356   6.439 -10.153
  265    HD3  LYS 676           1HD      LYS 676 -22.135   5.091 -11.272
  266    HE2  LYS 676           2HE      LYS 676 -23.230   3.636  -9.942
  267    HE3  LYS 676           1HE      LYS 676 -22.592   4.348  -8.461
  268    HZ1  LYS 676           3HZ      LYS 676 -25.023   4.986  -9.940
  269    HZ2  LYS 676           1HZ      LYS 676 -24.207   6.292  -9.224
  270    HZ3  LYS 676           2HZ      LYS 676 -24.736   4.994  -8.265
  271    H    ASP 677           H        ASP 677 -20.765   5.174  -6.062
  272    HA   ASP 677           HA       ASP 677 -23.414   6.426  -5.997
  273    HB2  ASP 677           2HB      ASP 677 -22.713   3.767  -6.077
  274    HB3  ASP 677           1HB      ASP 677 -23.027   4.021  -4.364
  275    H    GLY 678           H        GLY 678 -23.320   8.133  -4.634
  276    HA2  GLY 678           1HA      GLY 678 -23.834   8.447  -2.217
  277    HA3  GLY 678           2HA      GLY 678 -22.358   7.550  -1.900
  278    H    SER 679           H        SER 679 -21.272   9.139  -4.362
  279    HA   SER 679           HA       SER 679 -20.080  11.209  -2.759
  280    HB2  SER 679           2HB      SER 679 -19.742  10.977  -5.735
  281    HB3  SER 679           1HB      SER 679 -18.571  11.503  -4.525
  282    HG   SER 679           HG       SER 679 -18.355   9.284  -5.468
  283    H    GLN 680           H        GLN 680 -22.878  10.947  -4.558
  284    HA   GLN 680           HA       GLN 680 -23.077  13.866  -4.855
  285    HB2  GLN 680           2HB      GLN 680 -24.982  11.876  -6.077
  286    HB3  GLN 680           1HB      GLN 680 -24.707  13.551  -6.536
  287    HG2  GLN 680           2HG      GLN 680 -23.581  12.554  -8.219
  288    HG3  GLN 680           1HG      GLN 680 -22.275  12.604  -7.036
  289   HE21  GLN 680          1HE2      GLN 680 -22.197  10.807  -9.085
  290   HE22  GLN 680          2HE2      GLN 680 -22.428   9.206  -8.465
  291    H    SER 681           H        SER 681 -23.846  14.600  -2.956
  292    HA   SER 681           HA       SER 681 -25.473  13.133  -1.197
  293    HB2  SER 681           2HB      SER 681 -25.730  16.019  -0.907
  294    HB3  SER 681           1HB      SER 681 -25.011  14.842   0.191
  295    HG   SER 681           HG       SER 681 -23.726  16.617  -1.165
  296    H    LYS 682           H        LYS 682 -26.212  15.016  -3.976
  297    HA   LYS 682           HA       LYS 682 -28.980  15.471  -3.251
  298    HB2  LYS 682           2HB      LYS 682 -27.294  16.889  -4.772
  299    HB3  LYS 682           1HB      LYS 682 -28.026  15.903  -6.030
  300    HG2  LYS 682           2HG      LYS 682 -30.095  16.857  -5.767
  301    HG3  LYS 682           1HG      LYS 682 -29.789  17.313  -4.089
  302    HD2  LYS 682           2HD      LYS 682 -29.736  19.338  -5.249
  303    HD3  LYS 682           1HD      LYS 682 -28.034  18.916  -5.047
  304    HE2  LYS 682           2HE      LYS 682 -27.973  18.033  -7.317
  305    HE3  LYS 682           1HE      LYS 682 -29.685  18.403  -7.520
  306    HZ1  LYS 682           3HZ      LYS 682 -27.407  20.128  -7.734
  307    HZ2  LYS 682           1HZ      LYS 682 -28.613  20.768  -6.726
  308    HZ3  LYS 682           2HZ      LYS 682 -28.983  20.340  -8.323
  309    H    LEU 683           H        LEU 683 -27.390  12.798  -4.201
  310    HA   LEU 683           HA       LEU 683 -28.899  11.807  -6.363
  311    HB2  LEU 683           2HB      LEU 683 -26.762  10.923  -4.836
  312    HB3  LEU 683           1HB      LEU 683 -28.026   9.760  -4.485
  313    HG   LEU 683           HG       LEU 683 -26.396   9.252  -6.404
  314   HD11  LEU 683          1HD1      LEU 683 -29.294   8.883  -6.222
  315   HD12  LEU 683          2HD1      LEU 683 -28.621   8.634  -7.831
  316   HD13  LEU 683          3HD1      LEU 683 -28.009   7.704  -6.465
  317   HD21  LEU 683          3HD2      LEU 683 -26.927  10.175  -8.560
  318   HD22  LEU 683          1HD2      LEU 683 -28.238  11.135  -7.873
  319   HD23  LEU 683          2HD2      LEU 683 -26.566  11.492  -7.445
  320    H    GLY 684           H        GLY 684 -29.271  11.386  -2.865
  321    HA2  GLY 684           1HA      GLY 684 -32.038  11.394  -2.808
  322    HA3  GLY 684           2HA      GLY 684 -31.558   9.717  -3.035
  323    H    GLY 685           H        GLY 685 -32.775   9.710  -0.869
  324    HA2  GLY 685           1HA      GLY 685 -31.231  10.705   1.381
  325    HA3  GLY 685           2HA      GLY 685 -32.767   9.855   1.461
  326    H    GLY 901           H        GLY 901 -29.495   9.127   0.259
  327    HA2  GLY 901           1HA      GLY 901 -28.122   7.321   0.613
  328    HA3  GLY 901           2HA      GLY 901 -28.903   7.165   2.180
  329    H    GLY 902           H        GLY 902 -29.479   5.110   2.428
  330    HA2  GLY 902           1HA      GLY 902 -30.582   3.662   0.120
  331    HA3  GLY 902           2HA      GLY 902 -29.997   2.935   1.609
  332    H    SER 903           H        SER 903 -31.811   5.641   2.312
  333    HA   SER 903           HA       SER 903 -34.136   3.960   2.942
  334    HB2  SER 903           2HB      SER 903 -34.076   6.612   4.166
  335    HB3  SER 903           1HB      SER 903 -34.263   5.029   4.922
  336    HG   SER 903           HG       SER 903 -32.251   5.126   5.487
  337    H    GLY 904           H        GLY 904 -33.346   7.277   1.898
  338    HA2  GLY 904           1HA      GLY 904 -36.027   7.765   0.955
  339    HA3  GLY 904           2HA      GLY 904 -34.642   8.835   0.779
  340    H    GLY 905           H        GLY 905 -36.076   5.861  -0.456
  341    HA2  GLY 905           1HA      GLY 905 -36.321   5.994  -3.005
  342    HA3  GLY 905           2HA      GLY 905 -34.574   6.217  -2.969
  343    H    HIS 906           H        HIS 906 -36.794   3.983  -3.629
  344    HA   HIS 906           HA       HIS 906 -35.587   1.786  -2.130
  345    HB2  HIS 906           2HB      HIS 906 -38.017   1.915  -3.925
  346    HB3  HIS 906           1HB      HIS 906 -37.427   0.428  -3.189
  347    HD1  HIS 906           1HD      HIS 906 -36.794   1.828  -0.341
  348    HD2  HIS 906           2HD      HIS 906 -40.355   1.988  -2.491
  349    HE1  HIS 906           1HE      HIS 906 -38.620   2.333   1.335
  350    H    MET 907           H        MET 907 -33.563   1.933  -3.233
  351    HA   MET 907           HA       MET 907 -33.565   1.177  -6.052
  352    HB2  MET 907           2HB      MET 907 -31.527   2.328  -4.186
  353    HB3  MET 907           1HB      MET 907 -30.990   1.486  -5.633
  354    HG2  MET 907           2HG      MET 907 -33.027   3.279  -6.414
  355    HG3  MET 907           1HG      MET 907 -31.929   4.159  -5.352
  356    HE1  MET 907           3HE      MET 907 -31.432   5.764  -7.620
  357    HE2  MET 907           1HE      MET 907 -30.273   5.526  -6.313
  358    HE3  MET 907           2HE      MET 907 -29.733   5.475  -7.991
  359    H    GLY 908           H        GLY 908 -34.384  -0.967  -5.510
  360    HA2  GLY 908           1HA      GLY 908 -32.903  -2.824  -3.982
  361    HA3  GLY 908           2HA      GLY 908 -34.087  -3.225  -5.221
  362    H    SER 909           H        SER 909 -30.931  -3.532  -4.356
  363    HA   SER 909           HA       SER 909 -29.938  -3.548  -7.114
  364    HB2  SER 909           2HB      SER 909 -28.263  -3.898  -4.631
  365    HB3  SER 909           1HB      SER 909 -27.752  -3.353  -6.229
  366    HG   SER 909           HG       SER 909 -29.705  -1.834  -4.939
  367    H    GLY 910           H        GLY 910 -29.339  -5.395  -8.127
  368    HA2  GLY 910           1HA      GLY 910 -30.133  -7.890  -6.909
  369    HA3  GLY 910           2HA      GLY 910 -29.515  -7.671  -8.540
  370    H    GLY 911           H        GLY 911 -27.196  -6.139  -7.271
  371    HA2  GLY 911           1HA      GLY 911 -25.443  -8.403  -6.986
  372    HA3  GLY 911           2HA      GLY 911 -24.991  -6.708  -6.865
  373    H    LEU  18           H        LEU  18 -25.293  -9.532  -5.172
  374    HA   LEU  18           HA       LEU  18 -25.663  -8.098  -2.626
  375    HB2  LEU  18           2HB      LEU  18 -26.407 -10.857  -3.505
  376    HB3  LEU  18           1HB      LEU  18 -26.095 -10.548  -1.807
  377    HG   LEU  18           HG       LEU  18 -28.211  -9.222  -3.504
  378   HD11  LEU  18          1HD1      LEU  18 -28.511 -11.629  -2.694
  379   HD12  LEU  18          2HD1      LEU  18 -28.626 -10.933  -1.078
  380   HD13  LEU  18          3HD1      LEU  18 -29.788 -10.473  -2.321
  381   HD21  LEU  18          3HD2      LEU  18 -27.184  -7.708  -1.809
  382   HD22  LEU  18          1HD2      LEU  18 -28.895  -8.034  -1.537
  383   HD23  LEU  18          2HD2      LEU  18 -27.675  -8.850  -0.559
  384    H    SER  19           H        SER  19 -23.396  -9.587  -4.566
  385    HA   SER  19           HA       SER  19 -21.696 -10.365  -2.306
  386    HB2  SER  19           2HB      SER  19 -20.486 -10.810  -4.888
  387    HB3  SER  19           1HB      SER  19 -20.920 -11.985  -3.647
  388    HG   SER  19           HG       SER  19 -22.698 -12.450  -4.685
  389    H    TRP  20           H        TRP  20 -21.918  -8.166  -5.024
  390    HA   TRP  20           HA       TRP  20 -20.747  -6.337  -5.667
  391    HB2  TRP  20           2HB      TRP  20 -19.561  -6.073  -2.924
  392    HB3  TRP  20           1HB      TRP  20 -20.105  -4.811  -4.023
  393    HD1  TRP  20           HD       TRP  20 -23.057  -5.441  -4.515
  394    HE1  TRP  20           1HE      TRP  20 -24.797  -5.441  -2.618
  395    HE3  TRP  20           3HE      TRP  20 -19.909  -6.093  -0.536
  396    HZ2  TRP  20           2HZ      TRP  20 -24.825  -5.687   0.195
  397    HZ3  TRP  20           3HZ      TRP  20 -20.873  -6.198   1.724
  398    HH2  TRP  20           HH       TRP  20 -23.280  -5.997   2.080
  399    H    LYS  21           H        LYS  21 -18.181  -6.262  -3.540
  400    HA   LYS  21           HA       LYS  21 -16.481  -7.858  -5.343
  401    HB2  LYS  21           2HB      LYS  21 -15.575  -5.431  -3.786
  402    HB3  LYS  21           1HB      LYS  21 -14.682  -6.301  -5.025
  403    HG2  LYS  21           2HG      LYS  21 -17.282  -5.094  -5.795
  404    HG3  LYS  21           1HG      LYS  21 -15.918  -4.011  -5.512
  405    HD2  LYS  21           2HD      LYS  21 -14.834  -6.028  -7.060
  406    HD3  LYS  21           1HD      LYS  21 -16.449  -5.812  -7.738
  407    HE2  LYS  21           2HE      LYS  21 -15.995  -3.378  -7.912
  408    HE3  LYS  21           1HE      LYS  21 -14.350  -3.676  -7.351
  409    HZ1  LYS  21           3HZ      LYS  21 -14.224  -3.583  -9.678
  410    HZ2  LYS  21           1HZ      LYS  21 -15.602  -4.550  -9.895
  411    HZ3  LYS  21           2HZ      LYS  21 -14.163  -5.234  -9.316
  412    H    ARG  22           H        ARG  22 -15.471  -9.510  -4.381
  413    HA   ARG  22           HA       ARG  22 -15.801  -9.892  -1.544
  414    HB2  ARG  22           2HB      ARG  22 -16.103 -11.788  -3.022
  415    HB3  ARG  22           1HB      ARG  22 -14.482 -11.584  -3.673
  416    HG2  ARG  22           2HG      ARG  22 -13.779 -13.041  -2.163
  417    HG3  ARG  22           1HG      ARG  22 -14.133 -11.840  -0.920
  418    HD2  ARG  22           2HD      ARG  22 -16.466 -12.711  -0.839
  419    HD3  ARG  22           1HD      ARG  22 -15.980 -13.988  -1.953
  420    HE   ARG  22           HE       ARG  22 -15.039 -13.660   0.821
  421   HH11  ARG  22          2HH1      ARG  22 -15.387 -15.605  -2.074
  422   HH12  ARG  22          1HH1      ARG  22 -14.855 -17.071  -1.305
  423   HH21  ARG  22          2HH2      ARG  22 -14.323 -15.589   1.828
  424   HH22  ARG  22          1HH2      ARG  22 -14.228 -17.054   0.900
  425    H    CYS  23           H        CYS  23 -14.318  -9.584   0.005
  426    HA   CYS  23           HA       CYS  23 -11.811  -8.333  -0.733
  427    HB2  CYS  23           2HB      CYS  23 -13.133  -7.365   1.084
  428    HB3  CYS  23           1HB      CYS  23 -13.052  -8.882   1.974
  429    H    ALA  24           H        ALA  24  -9.797  -9.098  -0.221
  430    HA   ALA  24           HA       ALA  24  -9.635 -11.971   0.369
  431    HB1  ALA  24           1HB      ALA  24  -7.157 -10.580  -0.350
  432    HB2  ALA  24           2HB      ALA  24  -7.845 -12.076  -0.983
  433    HB3  ALA  24           3HB      ALA  24  -8.411 -10.519  -1.589
  434    H    GLY  25           H        GLY  25  -9.696  -9.193   2.006
  435    HA2  GLY  25           1HA      GLY  25  -7.454  -9.771   3.798
  436    HA3  GLY  25           2HA      GLY  25  -8.449  -8.323   3.810
  437    H    CYS  26           H        CYS  26 -10.975  -9.150   4.125
  438    HA   CYS  26           HA       CYS  26 -10.799 -10.390   6.761
  439    HB2  CYS  26           2HB      CYS  26 -13.298  -9.635   6.863
  440    HB3  CYS  26           1HB      CYS  26 -12.018  -8.460   7.096
  441    H    GLY  27           H        GLY  27 -11.783 -11.041   3.575
  442    HA2  GLY  27           1HA      GLY  27 -12.146 -13.238   2.801
  443    HA3  GLY  27           2HA      GLY  27 -12.630 -13.708   4.424
  444    H    GLY  28           H        GLY  28 -14.195 -10.933   4.037
  445    HA2  GLY  28           1HA      GLY  28 -16.619 -12.303   3.105
  446    HA3  GLY  28           2HA      GLY  28 -16.574 -10.828   4.065
  447    H    LYS  29           H        LYS  29 -17.739  -9.506   2.780
  448    HA   LYS  29           HA       LYS  29 -16.694  -9.013   0.075
  449    HB2  LYS  29           2HB      LYS  29 -19.422  -8.155   0.981
  450    HB3  LYS  29           1HB      LYS  29 -18.841  -8.439  -0.653
  451    HG2  LYS  29           2HG      LYS  29 -19.790 -10.440  -0.565
  452    HG3  LYS  29           1HG      LYS  29 -18.598 -10.896   0.649
  453    HD2  LYS  29           2HD      LYS  29 -20.765 -11.365   1.538
  454    HD3  LYS  29           1HD      LYS  29 -20.122  -9.958   2.389
  455    HE2  LYS  29           2HE      LYS  29 -21.880  -8.750   1.782
  456    HE3  LYS  29           1HE      LYS  29 -21.549  -9.075   0.082
  457    HZ1  LYS  29           3HZ      LYS  29 -22.681 -11.384   1.053
  458    HZ2  LYS  29           1HZ      LYS  29 -23.428 -10.222   0.068
  459    HZ3  LYS  29           2HZ      LYS  29 -23.593 -10.134   1.752
  460    H    ILE  30           H        ILE  30 -16.409  -6.852  -0.566
  461    HA   ILE  30           HA       ILE  30 -15.718  -5.085   1.585
  462    HB   ILE  30           HB       ILE  30 -15.712  -4.612  -1.399
  463   HG12  ILE  30          2HG1      ILE  30 -13.301  -5.001   0.355
  464   HG13  ILE  30          1HG1      ILE  30 -14.165  -6.386  -0.304
  465   HG21  ILE  30          1HG2      ILE  30 -14.593  -2.595  -1.052
  466   HG22  ILE  30          2HG2      ILE  30 -15.864  -2.580   0.169
  467   HG23  ILE  30          3HG2      ILE  30 -14.210  -2.984   0.622
  468   HD11  ILE  30          3HD1      ILE  30 -12.279  -5.823  -1.695
  469   HD12  ILE  30          1HD1      ILE  30 -13.782  -5.526  -2.568
  470   HD13  ILE  30          2HD1      ILE  30 -12.877  -4.174  -1.884
  471    H    ALA  31           H        ALA  31 -17.277  -4.131   2.664
  472    HA   ALA  31           HA       ALA  31 -19.460  -2.838   1.170
  473    HB1  ALA  31           1HB      ALA  31 -19.723  -4.546   3.240
  474    HB2  ALA  31           2HB      ALA  31 -19.632  -3.017   4.113
  475    HB3  ALA  31           3HB      ALA  31 -20.878  -3.262   2.888
  476    H    ASP  32           H        ASP  32 -16.561  -2.113   1.917
  477    HA   ASP  32           HA       ASP  32 -16.853   0.278   3.491
  478    HB2  ASP  32           2HB      ASP  32 -14.742  -1.335   2.914
  479    HB3  ASP  32           1HB      ASP  32 -14.456  -0.009   1.790
  480    H    ARG  33           H        ARG  33 -15.777   2.334   2.453
  481    HA   ARG  33           HA       ARG  33 -17.526   3.094   0.303
  482    HB2  ARG  33           2HB      ARG  33 -16.933   4.643   2.154
  483    HB3  ARG  33           1HB      ARG  33 -15.270   4.654   1.578
  484    HG2  ARG  33           2HG      ARG  33 -16.508   6.641   0.875
  485    HG3  ARG  33           1HG      ARG  33 -15.945   5.684  -0.494
  486    HD2  ARG  33           2HD      ARG  33 -18.045   5.114  -1.136
  487    HD3  ARG  33           1HD      ARG  33 -18.659   5.079   0.516
  488    HE   ARG  33           HE       ARG  33 -19.109   7.355   0.393
  489   HH11  ARG  33          2HH1      ARG  33 -17.594   6.205  -2.560
  490   HH12  ARG  33          1HH1      ARG  33 -17.942   7.660  -3.444
  491   HH21  ARG  33          2HH2      ARG  33 -19.530   9.262  -0.764
  492   HH22  ARG  33          1HH2      ARG  33 -19.017   9.406  -2.416
  493    H    PHE  34           H        PHE  34 -13.999   3.448   0.613
  494    HA   PHE  34           HA       PHE  34 -13.789   3.113  -2.293
  495    HB2  PHE  34           2HB      PHE  34 -12.290   4.662  -0.273
  496    HB3  PHE  34           1HB      PHE  34 -11.307   3.904  -1.524
  497    HD1  PHE  34           2HD      PHE  34 -14.546   5.739  -1.331
  498    HD2  PHE  34           1HD      PHE  34 -10.816   5.233  -3.312
  499    HE1  PHE  34           2HE      PHE  34 -15.134   7.549  -2.883
  500    HE2  PHE  34           1HE      PHE  34 -11.397   7.040  -4.873
  501    HZ   PHE  34           HZ       PHE  34 -13.558   8.194  -4.667
  502    H    LEU  35           H        LEU  35 -13.069   1.249  -3.056
  503    HA   LEU  35           HA       LEU  35 -11.583  -0.516  -1.261
  504    HB2  LEU  35           2HB      LEU  35 -12.100  -2.317  -2.743
  505    HB3  LEU  35           1HB      LEU  35 -13.576  -1.435  -2.413
  506    HG   LEU  35           HG       LEU  35 -12.570  -0.295  -4.759
  507   HD11  LEU  35          1HD1      LEU  35 -12.734  -3.173  -5.382
  508   HD12  LEU  35          2HD1      LEU  35 -11.758  -1.902  -6.120
  509   HD13  LEU  35          3HD1      LEU  35 -11.251  -2.630  -4.596
  510   HD21  LEU  35          3HD2      LEU  35 -14.524  -1.763  -5.712
  511   HD22  LEU  35          1HD2      LEU  35 -14.811  -2.114  -4.007
  512   HD23  LEU  35          2HD2      LEU  35 -14.862  -0.449  -4.585
  513    H    LEU  36           H        LEU  36  -9.614  -1.442  -1.909
  514    HA   LEU  36           HA       LEU  36  -8.189   0.209  -3.888
  515    HB2  LEU  36           2HB      LEU  36  -7.281  -0.752  -1.180
  516    HB3  LEU  36           1HB      LEU  36  -6.169  -0.148  -2.394
  517    HG   LEU  36           HG       LEU  36  -8.047   1.866  -2.242
  518   HD11  LEU  36          1HD1      LEU  36  -8.759   0.476  -0.114
  519   HD12  LEU  36          2HD1      LEU  36  -7.397   1.332   0.607
  520   HD13  LEU  36          3HD1      LEU  36  -8.734   2.240  -0.100
  521   HD21  LEU  36          3HD2      LEU  36  -5.584   2.048  -2.392
  522   HD22  LEU  36          1HD2      LEU  36  -6.290   3.140  -1.202
  523   HD23  LEU  36          2HD2      LEU  36  -5.482   1.666  -0.673
  524    H    TYR  37           H        TYR  37  -6.259  -0.801  -4.773
  525    HA   TYR  37           HA       TYR  37  -6.627  -3.700  -5.081
  526    HB2  TYR  37           2HB      TYR  37  -6.369  -1.607  -6.980
  527    HB3  TYR  37           1HB      TYR  37  -4.918  -2.599  -7.090
  528    HD1  TYR  37           2HD      TYR  37  -5.536  -5.251  -6.932
  529    HD2  TYR  37           1HD      TYR  37  -8.048  -2.161  -8.413
  530    HE1  TYR  37           2HE      TYR  37  -6.774  -6.903  -8.258
  531    HE2  TYR  37           1HE      TYR  37  -9.290  -3.798  -9.744
  532    HH   TYR  37           HH       TYR  37  -8.150  -6.940 -10.313
  533    H    ALA  38           H        ALA  38  -4.971  -5.054  -4.758
  534    HA   ALA  38           HA       ALA  38  -2.243  -4.097  -4.618
  535    HB1  ALA  38           1HB      ALA  38  -3.396  -5.571  -2.254
  536    HB2  ALA  38           2HB      ALA  38  -1.769  -4.912  -2.423
  537    HB3  ALA  38           3HB      ALA  38  -3.152  -3.826  -2.298
  538    H    MET  39           H        MET  39  -1.064  -5.496  -5.679
  539    HA   MET  39           HA       MET  39  -0.220  -7.392  -6.568
  540    HB2  MET  39           2HB      MET  39  -1.611  -8.399  -4.190
  541    HB3  MET  39           1HB      MET  39  -1.461  -9.586  -5.480
  542    HG2  MET  39           2HG      MET  39   0.429  -9.882  -4.125
  543    HG3  MET  39           1HG      MET  39   0.996  -9.011  -5.548
  544    HE1  MET  39           3HE      MET  39   1.170  -7.997  -1.244
  545    HE2  MET  39           1HE      MET  39  -0.460  -7.565  -1.766
  546    HE3  MET  39           2HE      MET  39   0.150  -9.197  -2.039
  547    H    ASP  40           H        ASP  40  -3.554  -8.427  -5.855
  548    HA   ASP  40           HA       ASP  40  -4.429  -8.122  -8.555
  549    HB2  ASP  40           2HB      ASP  40  -2.919 -10.161  -8.660
  550    HB3  ASP  40           1HB      ASP  40  -4.092 -10.978  -7.633
  551    H    SER  41           H        SER  41  -5.048  -8.369  -5.333
  552    HA   SER  41           HA       SER  41  -7.718  -9.539  -5.704
  553    HB2  SER  41           2HB      SER  41  -6.669  -9.072  -2.972
  554    HB3  SER  41           1HB      SER  41  -7.573 -10.442  -3.619
  555    HG   SER  41           HG       SER  41  -5.462 -10.744  -4.875
  556    H    TYR  42           H        TYR  42  -9.400  -8.623  -4.170
  557    HA   TYR  42           HA       TYR  42  -9.375  -5.708  -4.388
  558    HB2  TYR  42           2HB      TYR  42 -11.522  -7.729  -3.769
  559    HB3  TYR  42           1HB      TYR  42 -11.782  -6.004  -3.570
  560    HD1  TYR  42           1HD      TYR  42 -10.405  -4.932  -5.966
  561    HD2  TYR  42           2HD      TYR  42 -12.914  -8.332  -5.503
  562    HE1  TYR  42           1HE      TYR  42 -11.076  -4.754  -8.324
  563    HE2  TYR  42           2HE      TYR  42 -13.586  -8.166  -7.858
  564    HH   TYR  42           HH       TYR  42 -12.859  -7.235  -9.921
  565    H    TRP  43           H        TRP  43  -9.252  -4.362  -2.664
  566    HA   TRP  43           HA       TRP  43  -9.529  -5.502   0.030
  567    HB2  TRP  43           2HB      TRP  43  -7.340  -3.523  -0.537
  568    HB3  TRP  43           1HB      TRP  43  -7.513  -4.611   0.832
  569    HD1  TRP  43           HD       TRP  43  -6.567  -4.708  -2.911
  570    HE1  TRP  43           1HE      TRP  43  -5.003  -6.715  -3.287
  571    HE3  TRP  43           3HE      TRP  43  -6.719  -6.742   1.771
  572    HZ2  TRP  43           2HZ      TRP  43  -3.966  -8.862  -1.804
  573    HZ3  TRP  43           3HZ      TRP  43  -5.411  -8.781   2.213
  574    HH2  TRP  43           HH       TRP  43  -4.060  -9.815   0.453
  575    H    HIS  44           H        HIS  44  -9.321  -3.596   1.661
  576    HA   HIS  44           HA       HIS  44 -10.240  -1.028   0.696
  577    HB2  HIS  44           2HB      HIS  44 -12.045  -0.946   2.526
  578    HB3  HIS  44           1HB      HIS  44 -12.423  -1.898   1.100
  579    HD1  HIS  44           1HD      HIS  44 -13.486  -2.225   4.258
  580    HD2  HIS  44           2HD      HIS  44 -10.922  -4.627   2.049
  581    HE1  HIS  44           1HE      HIS  44 -13.470  -4.520   5.388
  582    H    SER  45           H        SER  45 -10.609   0.278   3.039
  583    HA   SER  45           HA       SER  45  -8.052   0.990   3.632
  584    HB2  SER  45           2HB      SER  45  -9.933   1.410   5.848
  585    HB3  SER  45           1HB      SER  45  -9.027   2.580   4.888
  586    HG   SER  45           HG       SER  45 -11.499   2.337   4.689
  587    H    ARG  46           H        ARG  46 -10.060  -1.097   5.754
  588    HA   ARG  46           HA       ARG  46  -7.960  -1.207   7.711
  589    HB2  ARG  46           2HB      ARG  46  -9.479  -2.246   9.111
  590    HB3  ARG  46           1HB      ARG  46 -10.512  -1.265   8.084
  591    HG2  ARG  46           2HG      ARG  46 -11.695  -3.083   7.638
  592    HG3  ARG  46           1HG      ARG  46 -10.292  -3.738   6.788
  593    HD2  ARG  46           2HD      ARG  46  -9.796  -4.125   9.522
  594    HD3  ARG  46           1HD      ARG  46 -11.482  -4.571   9.273
  595    HE   ARG  46           HE       ARG  46  -9.748  -5.712   7.297
  596   HH11  ARG  46          2HH1      ARG  46 -11.044  -6.124  10.536
  597   HH12  ARG  46          1HH1      ARG  46 -10.723  -7.837  10.573
  598   HH21  ARG  46          2HH2      ARG  46  -9.348  -7.939   7.345
  599   HH22  ARG  46          1HH2      ARG  46  -9.735  -8.862   8.770
  600    H    CYS  47           H        CYS  47  -8.728  -3.208   4.990
  601    HA   CYS  47           HA       CYS  47  -7.288  -5.467   6.170
  602    HB2  CYS  47           2HB      CYS  47  -9.049  -5.155   3.772
  603    HB3  CYS  47           1HB      CYS  47  -7.941  -6.517   3.881
  604    H    LEU  48           H        LEU  48  -7.058  -3.139   3.541
  605    HA   LEU  48           HA       LEU  48  -4.610  -4.279   2.547
  606    HB2  LEU  48           2HB      LEU  48  -6.472  -2.761   1.375
  607    HB3  LEU  48           1HB      LEU  48  -5.403  -1.482   1.913
  608    HG   LEU  48           HG       LEU  48  -5.214  -2.889  -0.459
  609   HD11  LEU  48          1HD1      LEU  48  -2.788  -1.770  -0.269
  610   HD12  LEU  48          2HD1      LEU  48  -4.263  -0.854  -0.571
  611   HD13  LEU  48          3HD1      LEU  48  -3.606  -0.950   1.061
  612   HD21  LEU  48          3HD2      LEU  48  -3.093  -4.082  -0.351
  613   HD22  LEU  48          1HD2      LEU  48  -3.015  -3.808   1.391
  614   HD23  LEU  48          2HD2      LEU  48  -4.289  -4.826   0.713
  615    H    LYS  49           H        LYS  49  -3.291  -4.308   4.372
  616    HA   LYS  49           HA       LYS  49  -2.096  -1.729   5.045
  617    HB2  LYS  49           2HB      LYS  49  -2.080  -2.845   7.509
  618    HB3  LYS  49           1HB      LYS  49  -3.306  -1.708   6.972
  619    HG2  LYS  49           2HG      LYS  49  -4.624  -3.342   7.845
  620    HG3  LYS  49           1HG      LYS  49  -4.523  -3.889   6.171
  621    HD2  LYS  49           2HD      LYS  49  -2.612  -5.356   6.856
  622    HD3  LYS  49           1HD      LYS  49  -2.948  -4.913   8.531
  623    HE2  LYS  49           2HE      LYS  49  -5.097  -5.916   8.457
  624    HE3  LYS  49           1HE      LYS  49  -5.020  -6.106   6.706
  625    HZ1  LYS  49           3HZ      LYS  49  -4.457  -8.050   8.437
  626    HZ2  LYS  49           1HZ      LYS  49  -2.905  -7.412   8.204
  627    HZ3  LYS  49           2HZ      LYS  49  -3.795  -7.969   6.874
  628    H    CYS  50           H        CYS  50  -0.165  -2.158   6.575
  629    HA   CYS  50           HA       CYS  50   1.578  -4.071   5.378
  630    HB2  CYS  50           2HB      CYS  50   2.354  -1.902   6.347
  631    HB3  CYS  50           1HB      CYS  50   1.929  -2.493   7.947
  632    H    SER  51           H        SER  51   2.127  -6.088   6.084
  633    HA   SER  51           HA       SER  51   0.486  -7.290   8.131
  634    HB2  SER  51           2HB      SER  51   2.853  -8.641   6.852
  635    HB3  SER  51           1HB      SER  51   1.359  -9.361   7.447
  636    HG   SER  51           HG       SER  51   1.161  -7.508   5.371
  637    H    SER  52           H        SER  52   3.205  -5.442   8.188
  638    HA   SER  52           HA       SER  52   4.237  -6.724  10.626
  639    HB2  SER  52           2HB      SER  52   5.916  -4.604   9.591
  640    HB3  SER  52           1HB      SER  52   6.302  -6.305   9.855
  641    HG   SER  52           HG       SER  52   5.085  -5.132   7.568
  642    H    CYS  53           H        CYS  53   3.155  -3.667   9.216
  643    HA   CYS  53           HA       CYS  53   3.371  -2.314  11.788
  644    HB2  CYS  53           2HB      CYS  53   2.470  -1.388   9.057
  645    HB3  CYS  53           1HB      CYS  53   2.417  -0.364  10.487
  646    H    GLN  54           H        GLN  54   0.973  -3.723   9.702
  647    HA   GLN  54           HA       GLN  54  -1.262  -3.961   9.765
  648    HB2  GLN  54           2HB      GLN  54  -0.549  -3.761  12.602
  649    HB3  GLN  54           1HB      GLN  54  -2.210  -3.298  12.245
  650    HG2  GLN  54           2HG      GLN  54  -1.192  -5.790  11.022
  651    HG3  GLN  54           1HG      GLN  54  -1.500  -5.790  12.756
  652   HE21  GLN  54          1HE2      GLN  54  -3.436  -3.645  10.899
  653   HE22  GLN  54          2HE2      GLN  54  -4.876  -4.613  10.872
  654    H    ALA  55           H        ALA  55   0.252  -1.224   9.730
  655    HA   ALA  55           HA       ALA  55  -1.775   0.689  10.361
  656    HB1  ALA  55           1HB      ALA  55   0.931   0.816   9.862
  657    HB2  ALA  55           2HB      ALA  55   0.227   1.542   8.417
  658    HB3  ALA  55           3HB      ALA  55  -0.155   2.200  10.008
  659    H    GLN  56           H        GLN  56  -3.494   1.156   9.171
  660    HA   GLN  56           HA       GLN  56  -4.228  -0.261   6.912
  661    HB2  GLN  56           2HB      GLN  56  -5.201   2.390   7.970
  662    HB3  GLN  56           1HB      GLN  56  -5.987   1.524   6.659
  663    HG2  GLN  56           2HG      GLN  56  -6.336  -0.393   8.164
  664    HG3  GLN  56           1HG      GLN  56  -5.616   0.535   9.478
  665   HE21  GLN  56          1HE2      GLN  56  -7.189   2.744   7.697
  666   HE22  GLN  56          2HE2      GLN  56  -8.716   2.748   8.497
  667    H    LEU  57           H        LEU  57  -3.026  -0.277   5.135
  668    HA   LEU  57           HA       LEU  57  -1.492   1.922   4.198
  669    HB2  LEU  57           2HB      LEU  57  -2.010  -0.854   3.434
  670    HB3  LEU  57           1HB      LEU  57  -1.769   0.199   2.057
  671    HG   LEU  57           HG       LEU  57   0.437   0.603   2.580
  672   HD11  LEU  57          1HD1      LEU  57   0.010  -0.368   5.392
  673   HD12  LEU  57          2HD1      LEU  57   1.479   0.339   4.719
  674   HD13  LEU  57          3HD1      LEU  57   0.032   1.328   4.907
  675   HD21  LEU  57          3HD2      LEU  57   0.229  -1.684   1.921
  676   HD22  LEU  57          1HD2      LEU  57   1.454  -1.577   3.187
  677   HD23  LEU  57          2HD2      LEU  57  -0.164  -2.168   3.571
  678    H    GLY  58           H        GLY  58  -4.731   0.839   3.698
  679    HA2  GLY  58           1HA      GLY  58  -5.189   2.364   1.296
  680    HA3  GLY  58           2HA      GLY  58  -6.408   1.562   2.279
  681    H    ASP  59           H        ASP  59  -4.896   3.139   4.554
  682    HA   ASP  59           HA       ASP  59  -6.583   5.521   4.312
  683    HB2  ASP  59           2HB      ASP  59  -6.242   3.771   6.419
  684    HB3  ASP  59           1HB      ASP  59  -5.199   5.118   6.865
  685    H    ILE  60           H        ILE  60  -3.659   4.678   3.483
  686    HA   ILE  60           HA       ILE  60  -2.462   7.274   4.140
  687    HB   ILE  60           HB       ILE  60  -0.986   4.649   3.970
  688   HG12  ILE  60          2HG1      ILE  60  -1.455   6.401   6.392
  689   HG13  ILE  60          1HG1      ILE  60  -2.382   4.952   6.031
  690   HG21  ILE  60          1HG2      ILE  60   0.345   6.510   3.159
  691   HG22  ILE  60          2HG2      ILE  60   0.011   7.416   4.637
  692   HG23  ILE  60          3HG2      ILE  60   0.963   5.932   4.708
  693   HD11  ILE  60          3HD1      ILE  60  -0.369   4.874   7.686
  694   HD12  ILE  60          1HD1      ILE  60  -0.648   3.549   6.555
  695   HD13  ILE  60          2HD1      ILE  60   0.584   4.762   6.206
  696    H    GLY  61           H        GLY  61  -2.385   4.517   1.989
  697    HA2  GLY  61           1HA      GLY  61  -2.508   4.601  -0.363
  698    HA3  GLY  61           2HA      GLY  61  -2.075   6.304  -0.299
  699    H    THR  62           H        THR  62  -0.274   4.080   1.587
  700    HA   THR  62           HA       THR  62   2.172   4.799   0.359
  701    HB   THR  62           HB       THR  62   2.591   2.470   1.877
  702    HG1  THR  62           1HG      THR  62   1.158   2.515   3.459
  703   HG21  THR  62          3HG2      THR  62   3.541   5.037   1.777
  704   HG22  THR  62          1HG2      THR  62   4.005   3.832   2.979
  705   HG23  THR  62          2HG2      THR  62   2.738   5.002   3.348
  706    H    SER  63           H        SER  63   3.140   3.933  -1.355
  707    HA   SER  63           HA       SER  63   2.137   1.640  -2.705
  708    HB2  SER  63           2HB      SER  63   4.875   2.452  -3.381
  709    HB3  SER  63           1HB      SER  63   3.434   2.398  -4.399
  710    HG   SER  63           HG       SER  63   3.247   4.475  -4.150
  711    H    SER  64           H        SER  64   2.199  -0.057  -1.235
  712    HA   SER  64           HA       SER  64   4.552  -0.760   0.218
  713    HB2  SER  64           2HB      SER  64   2.822  -2.961   0.178
  714    HB3  SER  64           1HB      SER  64   2.907  -1.704   1.420
  715    HG   SER  64           HG       SER  64   0.903  -1.408   0.792
  716    H    TYR  65           H        TYR  65   5.315  -3.128   0.101
  717    HA   TYR  65           HA       TYR  65   5.582  -3.996  -2.699
  718    HB2  TYR  65           2HB      TYR  65   7.809  -3.686  -0.668
  719    HB3  TYR  65           1HB      TYR  65   7.979  -4.582  -2.174
  720    HD1  TYR  65           1HD      TYR  65   7.476  -1.234  -0.715
  721    HD2  TYR  65           2HD      TYR  65   8.291  -3.450  -4.251
  722    HE1  TYR  65           1HE      TYR  65   8.084   0.848  -1.869
  723    HE2  TYR  65           2HE      TYR  65   8.906  -1.377  -5.416
  724    HH   TYR  65           HH       TYR  65   9.385   1.594  -3.782
  725    H    THR  66           H        THR  66   6.567  -6.271  -2.758
  726    HA   THR  66           HA       THR  66   5.976  -7.840  -0.384
  727    HB   THR  66           HB       THR  66   3.877  -7.726  -1.808
  728    HG1  THR  66           1HG      THR  66   4.112  -9.397  -0.324
  729   HG21  THR  66          3HG2      THR  66   3.793  -9.184  -3.779
  730   HG22  THR  66          1HG2      THR  66   5.525  -9.481  -3.633
  731   HG23  THR  66          2HG2      THR  66   4.938  -7.861  -4.010
  732    H    LYS  67           H        LYS  67   6.374 -10.277  -1.077
  733    HA   LYS  67           HA       LYS  67   8.390 -10.746  -3.025
  734    HB2  LYS  67           2HB      LYS  67   9.555  -9.544  -1.010
  735    HB3  LYS  67           1HB      LYS  67   9.398 -11.109  -0.222
  736    HG2  LYS  67           2HG      LYS  67  10.530 -12.040  -2.339
  737    HG3  LYS  67           1HG      LYS  67  11.003 -10.366  -2.631
  738    HD2  LYS  67           2HD      LYS  67  11.984 -10.325  -0.338
  739    HD3  LYS  67           1HD      LYS  67  11.656 -12.054  -0.222
  740    HE2  LYS  67           2HE      LYS  67  13.977 -11.587  -0.888
  741    HE3  LYS  67           1HE      LYS  67  13.092 -12.486  -2.119
  742    HZ1  LYS  67           3HZ      LYS  67  12.648 -10.155  -3.089
  743    HZ2  LYS  67           1HZ      LYS  67  14.158 -10.875  -3.339
  744    HZ3  LYS  67           2HZ      LYS  67  13.970  -9.673  -2.152
  745    H    SER  68           H        SER  68   7.621 -11.956   0.225
  746    HA   SER  68           HA       SER  68   7.237 -14.621  -0.928
  747    HB2  SER  68           2HB      SER  68   7.258 -14.337   2.004
  748    HB3  SER  68           1HB      SER  68   8.144 -15.463   0.970
  749    HG   SER  68           HG       SER  68   9.667 -13.883   0.566
  750    H    GLY  69           H        GLY  69   5.187 -12.644  -1.222
  751    HA2  GLY  69           1HA      GLY  69   2.869 -12.918  -1.290
  752    HA3  GLY  69           2HA      GLY  69   3.004 -14.171  -0.068
  753    H    MET  70           H        MET  70   4.657 -12.285   1.606
  754    HA   MET  70           HA       MET  70   2.477 -11.221   3.111
  755    HB2  MET  70           2HB      MET  70   4.985 -12.022   3.759
  756    HB3  MET  70           1HB      MET  70   5.212 -10.280   3.721
  757    HG2  MET  70           2HG      MET  70   4.428 -10.198   5.783
  758    HG3  MET  70           1HG      MET  70   2.854 -10.684   5.156
  759    HE1  MET  70           3HE      MET  70   6.128 -13.056   7.102
  760    HE2  MET  70           1HE      MET  70   5.990 -13.628   5.439
  761    HE3  MET  70           2HE      MET  70   6.283 -11.918   5.765
  762    H    ILE  71           H        ILE  71   1.777  -9.145   3.311
  763    HA   ILE  71           HA       ILE  71   2.739  -7.245   1.302
  764    HB   ILE  71           HB       ILE  71   0.444  -6.644   3.123
  765   HG12  ILE  71          2HG1      ILE  71  -0.428  -7.963   0.686
  766   HG13  ILE  71          1HG1      ILE  71   0.529  -9.046   1.693
  767   HG21  ILE  71          1HG2      ILE  71  -0.406  -5.704   0.890
  768   HG22  ILE  71          2HG2      ILE  71   0.937  -4.880   1.683
  769   HG23  ILE  71          3HG2      ILE  71   1.242  -5.956   0.317
  770   HD11  ILE  71          3HD1      ILE  71  -1.217  -9.387   3.000
  771   HD12  ILE  71          1HD1      ILE  71  -1.319  -7.660   3.349
  772   HD13  ILE  71          2HD1      ILE  71  -2.182  -8.331   1.965
  773    H    LEU  72           H        LEU  72   4.381  -5.995   1.967
  774    HA   LEU  72           HA       LEU  72   4.290  -4.990   4.737
  775    HB2  LEU  72           2HB      LEU  72   6.881  -5.098   3.293
  776    HB3  LEU  72           1HB      LEU  72   6.543  -5.285   5.003
  777    HG   LEU  72           HG       LEU  72   5.484  -7.464   3.359
  778   HD11  LEU  72          1HD1      LEU  72   8.471  -7.179   3.596
  779   HD12  LEU  72          2HD1      LEU  72   7.575  -8.493   2.834
  780   HD13  LEU  72          3HD1      LEU  72   7.556  -6.882   2.117
  781   HD21  LEU  72          3HD2      LEU  72   7.345  -8.281   5.339
  782   HD22  LEU  72          1HD2      LEU  72   6.368  -6.974   6.010
  783   HD23  LEU  72          2HD2      LEU  72   5.585  -8.414   5.358
  784    H    CYS  73           H        CYS  73   4.924  -2.834   5.086
  785    HA   CYS  73           HA       CYS  73   4.225  -1.044   3.033
  786    HB2  CYS  73           2HB      CYS  73   4.895   0.736   4.573
  787    HB3  CYS  73           1HB      CYS  73   3.932  -0.481   5.400
  788    H    ARG  74           H        ARG  74   5.692   0.853   2.484
  789    HA   ARG  74           HA       ARG  74   7.588   0.060   0.677
  790    HB2  ARG  74           2HB      ARG  74   6.439   2.430   1.409
  791    HB3  ARG  74           1HB      ARG  74   8.110   2.691   1.879
  792    HG2  ARG  74           2HG      ARG  74   8.868   2.283  -0.355
  793    HG3  ARG  74           1HG      ARG  74   7.245   1.810  -0.864
  794    HD2  ARG  74           2HD      ARG  74   7.417   4.009  -1.606
  795    HD3  ARG  74           1HD      ARG  74   6.549   4.168  -0.079
  796    HE   ARG  74           HE       ARG  74   9.264   4.411   0.488
  797   HH11  ARG  74          2HH1      ARG  74   6.785   6.146  -1.274
  798   HH12  ARG  74          1HH1      ARG  74   7.589   7.685  -1.142
  799   HH21  ARG  74          2HH2      ARG  74  10.307   6.409   0.696
  800   HH22  ARG  74          1HH2      ARG  74   9.611   7.840  -0.009
  801    H    ASN  75           H        ASN  75   8.147   1.270   3.958
  802    HA   ASN  75           HA       ASN  75  11.002   1.008   3.723
  803    HB2  ASN  75           2HB      ASN  75  10.257   2.803   5.077
  804    HB3  ASN  75           1HB      ASN  75   9.145   1.774   5.970
  805   HD21  ASN  75          1HD2      ASN  75   9.771   1.087   7.877
  806   HD22  ASN  75          2HD2      ASN  75  11.401   1.073   8.467
  807    H    ASP  76           H        ASP  76   8.378  -0.902   5.044
  808    HA   ASP  76           HA       ASP  76   9.961  -2.461   6.804
  809    HB2  ASP  76           2HB      ASP  76   7.220  -2.268   6.186
  810    HB3  ASP  76           1HB      ASP  76   7.678  -3.949   5.917
  811    H    TYR  77           H        TYR  77   8.978  -2.929   3.436
  812    HA   TYR  77           HA       TYR  77   9.771  -5.600   3.201
  813    HB2  TYR  77           2HB      TYR  77   8.503  -4.641   1.409
  814    HB3  TYR  77           1HB      TYR  77   9.723  -3.398   1.133
  815    HD1  TYR  77           2HD      TYR  77   9.811  -7.124   1.461
  816    HD2  TYR  77           1HD      TYR  77  10.824  -3.712  -0.875
  817    HE1  TYR  77           2HE      TYR  77  10.945  -8.579  -0.163
  818    HE2  TYR  77           1HE      TYR  77  11.967  -5.156  -2.503
  819    HH   TYR  77           HH       TYR  77  13.116  -7.814  -2.105
  820    H    ILE  78           H        ILE  78  11.645  -2.625   2.798
  821    HA   ILE  78           HA       ILE  78  14.028  -3.909   1.938
  822    HB   ILE  78           HB       ILE  78  14.065  -1.282   3.387
  823   HG12  ILE  78          2HG1      ILE  78  13.406  -1.402   0.464
  824   HG13  ILE  78          1HG1      ILE  78  12.112  -1.529   1.653
  825   HG21  ILE  78          1HG2      ILE  78  16.183  -1.520   2.700
  826   HG22  ILE  78          2HG2      ILE  78  15.760  -2.752   1.511
  827   HG23  ILE  78          3HG2      ILE  78  15.558  -1.044   1.121
  828   HD11  ILE  78          3HD1      ILE  78  12.243   0.739   1.031
  829   HD12  ILE  78          1HD1      ILE  78  12.966   0.626   2.635
  830   HD13  ILE  78          2HD1      ILE  78  13.996   0.765   1.210
  831    H    ARG  79           H        ARG  79  12.733  -3.009   5.062
  832    HA   ARG  79           HA       ARG  79  15.117  -3.589   6.533
  833    HB2  ARG  79           2HB      ARG  79  12.977  -2.111   7.113
  834    HB3  ARG  79           1HB      ARG  79  12.436  -3.620   7.836
  835    HG2  ARG  79           2HG      ARG  79  15.155  -2.986   8.589
  836    HG3  ARG  79           1HG      ARG  79  14.029  -1.694   9.010
  837    HD2  ARG  79           2HD      ARG  79  14.138  -3.190  10.865
  838    HD3  ARG  79           1HD      ARG  79  12.576  -3.425  10.081
  839    HE   ARG  79           HE       ARG  79  14.438  -5.251   9.021
  840   HH11  ARG  79          2HH1      ARG  79  12.676  -4.633  11.994
  841   HH12  ARG  79          1HH1      ARG  79  12.631  -6.314  12.445
  842   HH21  ARG  79          2HH2      ARG  79  14.351  -7.436   9.618
  843   HH22  ARG  79          1HH2      ARG  79  13.568  -7.895  11.102
  844    H    LEU  80           H        LEU  80  12.216  -5.345   5.649
  845    HA   LEU  80           HA       LEU  80  12.774  -7.523   7.454
  846    HB2  LEU  80           2HB      LEU  80  10.518  -6.530   6.146
  847    HB3  LEU  80           1HB      LEU  80  10.794  -8.105   5.423
  848    HG   LEU  80           HG       LEU  80  10.945  -8.071   8.363
  849   HD11  LEU  80          1HD1      LEU  80   8.557  -7.932   8.714
  850   HD12  LEU  80          2HD1      LEU  80   9.158  -6.430   8.012
  851   HD13  LEU  80          3HD1      LEU  80   8.300  -7.596   7.003
  852   HD21  LEU  80          3HD2      LEU  80  10.384  -9.886   6.235
  853   HD22  LEU  80          1HD2      LEU  80  10.658 -10.225   7.944
  854   HD23  LEU  80          2HD2      LEU  80   9.031  -9.877   7.365
  855    H    PHE  81           H        PHE  81  12.444  -7.327   3.887
  856    HA   PHE  81           HA       PHE  81  13.955  -9.846   3.770
  857    HB2  PHE  81           2HB      PHE  81  11.955  -8.656   1.848
  858    HB3  PHE  81           1HB      PHE  81  12.928 -10.077   1.482
  859    HD1  PHE  81           2HD      PHE  81  12.623 -12.153   2.823
  860    HD2  PHE  81           1HD      PHE  81  10.049  -8.785   3.211
  861    HE1  PHE  81           2HE      PHE  81  10.936 -13.575   3.917
  862    HE2  PHE  81           1HE      PHE  81   8.354 -10.200   4.302
  863    HZ   PHE  81           HZ       PHE  81   8.798 -12.596   4.657
  864    H    GLY  82           H        GLY  82  13.422  -7.686   1.061
  865    HA2  GLY  82           1HA      GLY  82  15.076  -6.220   0.124
  866    HA3  GLY  82           2HA      GLY  82  16.309  -7.146   0.971
  Start of MODEL    2
    1    H    SER 641           1H       SER 641  22.561 -33.708  -2.619
    2    HA   SER 641           HA       SER 641  22.626 -36.389  -3.842
    3    HB2  SER 641           2HB      SER 641  20.173 -35.255  -2.645
    4    HB3  SER 641           1HB      SER 641  20.854 -36.877  -2.504
    5    HG   SER 641           HG       SER 641  21.064 -35.930  -0.519
    6    H    LEU 642           H        LEU 642  20.769 -33.341  -3.805
    7    HA   LEU 642           HA       LEU 642  20.245 -33.777  -6.669
    8    HB2  LEU 642           2HB      LEU 642  18.161 -34.091  -5.597
    9    HB3  LEU 642           1HB      LEU 642  18.414 -32.728  -4.524
   10    HG   LEU 642           HG       LEU 642  18.470 -31.500  -6.961
   11   HD11  LEU 642          1HD1      LEU 642  16.620 -32.362  -8.280
   12   HD12  LEU 642          2HD1      LEU 642  17.882 -33.581  -8.116
   13   HD13  LEU 642          3HD1      LEU 642  16.415 -33.698  -7.148
   14   HD21  LEU 642          3HD2      LEU 642  16.966 -30.324  -5.830
   15   HD22  LEU 642          1HD2      LEU 642  15.763 -31.576  -6.144
   16   HD23  LEU 642          2HD2      LEU 642  16.757 -31.653  -4.690
   17    H    GLN 643           H        GLN 643  20.991 -32.249  -7.942
   18    HA   GLN 643           HA       GLN 643  21.421 -29.554  -6.819
   19    HB2  GLN 643           2HB      GLN 643  23.475 -31.133  -7.415
   20    HB3  GLN 643           1HB      GLN 643  23.145 -30.550  -9.042
   21    HG2  GLN 643           2HG      GLN 643  23.125 -28.222  -7.687
   22    HG3  GLN 643           1HG      GLN 643  24.280 -29.147  -6.725
   23   HE21  GLN 643          1HE2      GLN 643  25.536 -27.220  -7.683
   24   HE22  GLN 643          2HE2      GLN 643  26.389 -27.557  -9.155
   25    H    ASN 644           H        ASN 644  19.127 -29.636  -7.714
   26    HA   ASN 644           HA       ASN 644  18.833 -29.563 -10.570
   27    HB2  ASN 644           2HB      ASN 644  17.111 -30.139  -8.570
   28    HB3  ASN 644           1HB      ASN 644  16.687 -28.455  -8.854
   29   HD21  ASN 644          1HD2      ASN 644  14.703 -29.960  -9.317
   30   HD22  ASN 644          2HD2      ASN 644  14.459 -30.306 -10.998
   31    H    ASN 645           H        ASN 645  20.371 -27.907 -11.019
   32    HA   ASN 645           HA       ASN 645  20.197 -25.262 -10.106
   33    HB2  ASN 645           2HB      ASN 645  22.089 -26.360 -11.440
   34    HB3  ASN 645           1HB      ASN 645  21.115 -26.047 -12.873
   35   HD21  ASN 645          1HD2      ASN 645  21.137 -24.071 -13.754
   36   HD22  ASN 645          2HD2      ASN 645  21.998 -22.712 -13.114
   37    H    GLN 646           H        GLN 646  18.325 -24.193 -10.163
   38    HA   GLN 646           HA       GLN 646  16.321 -24.602 -12.119
   39    HB2  GLN 646           2HB      GLN 646  16.717 -22.524  -9.980
   40    HB3  GLN 646           1HB      GLN 646  15.343 -22.483 -11.076
   41    HG2  GLN 646           2HG      GLN 646  15.000 -24.944 -10.312
   42    HG3  GLN 646           1HG      GLN 646  15.998 -24.460  -8.942
   43   HE21  GLN 646          1HE2      GLN 646  13.394 -22.913 -10.811
   44   HE22  GLN 646          2HE2      GLN 646  12.431 -22.508  -9.424
   45    H    ASP 647           H        ASP 647  15.750 -23.439 -13.892
   46    HA   ASP 647           HA       ASP 647  17.908 -22.015 -15.152
   47    HB2  ASP 647           2HB      ASP 647  16.288 -23.673 -16.272
   48    HB3  ASP 647           1HB      ASP 647  15.135 -22.340 -16.282
   49    H    VAL 648           H        VAL 648  18.245 -19.951 -14.729
   50    HA   VAL 648           HA       VAL 648  15.978 -18.227 -14.059
   51    HB   VAL 648           HB       VAL 648  17.942 -16.539 -13.660
   52   HG11  VAL 648          1HG1      VAL 648  16.592 -17.235 -11.853
   53   HG12  VAL 648          2HG1      VAL 648  17.236 -18.876 -11.904
   54   HG13  VAL 648          3HG1      VAL 648  18.255 -17.545 -11.353
   55   HG21  VAL 648          3HG2      VAL 648  19.419 -19.146 -13.324
   56   HG22  VAL 648          1HG2      VAL 648  19.634 -18.063 -14.699
   57   HG23  VAL 648          2HG2      VAL 648  20.045 -17.518 -13.074
   58    H    SER 649           H        SER 649  17.484 -19.176 -16.772
   59    HA   SER 649           HA       SER 649  17.907 -16.677 -18.090
   60    HB2  SER 649           2HB      SER 649  17.442 -19.153 -19.674
   61    HB3  SER 649           1HB      SER 649  18.698 -17.924 -19.843
   62    HG   SER 649           HG       SER 649  18.615 -20.203 -18.224
   63    H    PHE 650           H        PHE 650  16.392 -15.383 -18.841
   64    HA   PHE 650           HA       PHE 650  13.797 -16.536 -19.621
   65    HB2  PHE 650           2HB      PHE 650  14.377 -14.497 -17.745
   66    HB3  PHE 650           1HB      PHE 650  13.644 -13.703 -19.135
   67    HD1  PHE 650           2HD      PHE 650  11.447 -14.760 -20.028
   68    HD2  PHE 650           1HD      PHE 650  13.033 -15.468 -16.139
   69    HE1  PHE 650           2HE      PHE 650   9.218 -15.452 -19.246
   70    HE2  PHE 650           1HE      PHE 650  10.807 -16.162 -15.353
   71    HZ   PHE 650           HZ       PHE 650   8.897 -16.153 -16.906
   72    H    GLU 651           H        GLU 651  13.024 -16.053 -21.640
   73    HA   GLU 651           HA       GLU 651  14.825 -14.902 -23.532
   74    HB2  GLU 651           2HB      GLU 651  11.913 -15.282 -24.114
   75    HB3  GLU 651           1HB      GLU 651  13.294 -15.502 -25.175
   76    HG2  GLU 651           2HG      GLU 651  13.892 -17.545 -24.050
   77    HG3  GLU 651           1HG      GLU 651  12.609 -17.299 -22.864
   78    H    ASN 652           H        ASN 652  11.877 -13.819 -21.938
   79    HA   ASN 652           HA       ASN 652  11.523 -11.389 -23.289
   80    HB2  ASN 652           2HB      ASN 652   9.768 -12.273 -21.881
   81    HB3  ASN 652           1HB      ASN 652  10.804 -12.190 -20.459
   82   HD21  ASN 652          1HD2      ASN 652   9.507 -10.856 -19.277
   83   HD22  ASN 652          2HD2      ASN 652   9.191  -9.207 -19.706
   84    H    ILE 653           H        ILE 653  13.223 -12.072 -20.245
   85    HA   ILE 653           HA       ILE 653  14.695  -9.550 -20.609
   86    HB   ILE 653           HB       ILE 653  15.052 -10.278 -17.946
   87   HG12  ILE 653          2HG1      ILE 653  12.113 -10.142 -18.109
   88   HG13  ILE 653          1HG1      ILE 653  12.800 -11.650 -18.707
   89   HG21  ILE 653          1HG2      ILE 653  14.643  -8.031 -19.182
   90   HG22  ILE 653          2HG2      ILE 653  12.955  -8.309 -18.759
   91   HG23  ILE 653          3HG2      ILE 653  14.174  -8.191 -17.490
   92   HD11  ILE 653          3HD1      ILE 653  13.862 -10.711 -16.135
   93   HD12  ILE 653          1HD1      ILE 653  12.166 -11.197 -16.138
   94   HD13  ILE 653          2HD1      ILE 653  13.412 -12.332 -16.660
   95    H    GLN 654           H        GLN 654  16.259 -10.597 -21.875
   96    HA   GLN 654           HA       GLN 654  17.719 -12.811 -20.629
   97    HB2  GLN 654           2HB      GLN 654  18.799 -12.997 -22.901
   98    HB3  GLN 654           1HB      GLN 654  17.073 -13.316 -22.853
   99    HG2  GLN 654           2HG      GLN 654  16.543 -11.412 -24.004
  100    HG3  GLN 654           1HG      GLN 654  18.004 -10.569 -23.493
  101   HE21  GLN 654          1HE2      GLN 654  16.492 -12.119 -25.998
  102   HE22  GLN 654          2HE2      GLN 654  17.862 -12.399 -27.022
  103    H    TRP 655           H        TRP 655  17.907  -9.516 -20.827
  104    HA   TRP 655           HA       TRP 655  20.788  -9.340 -21.040
  105    HB2  TRP 655           2HB      TRP 655  20.529  -7.059 -21.194
  106    HB3  TRP 655           1HB      TRP 655  18.954  -7.579 -21.773
  107    HD1  TRP 655           HD       TRP 655  16.926  -7.485 -19.817
  108    HE1  TRP 655           1HE      TRP 655  16.563  -5.698 -17.994
  109    HE3  TRP 655           3HE      TRP 655  21.620  -5.457 -19.721
  110    HZ2  TRP 655           2HZ      TRP 655  18.071  -3.708 -16.688
  111    HZ3  TRP 655           3HZ      TRP 655  22.076  -3.611 -18.157
  112    HH2  TRP 655           HH       TRP 655  20.333  -2.756 -16.673
  113    H    SER 656           H        SER 656  22.023  -8.196 -19.286
  114    HA   SER 656           HA       SER 656  21.773  -9.643 -16.878
  115    HB2  SER 656           2HB      SER 656  23.425  -7.271 -16.648
  116    HB3  SER 656           1HB      SER 656  23.894  -8.972 -16.612
  117    HG   SER 656           HG       SER 656  24.357  -8.917 -18.689
  118    H    ILE 657           H        ILE 657  19.683  -9.183 -16.106
  119    HA   ILE 657           HA       ILE 657  18.743  -6.593 -15.507
  120    HB   ILE 657           HB       ILE 657  17.097  -7.763 -14.032
  121   HG12  ILE 657          2HG1      ILE 657  17.740 -10.431 -15.002
  122   HG13  ILE 657          1HG1      ILE 657  19.025  -9.773 -13.994
  123   HG21  ILE 657          1HG2      ILE 657  16.787  -9.400 -16.374
  124   HG22  ILE 657          2HG2      ILE 657  15.869  -7.981 -15.868
  125   HG23  ILE 657          3HG2      ILE 657  17.343  -7.786 -16.819
  126   HD11  ILE 657          3HD1      ILE 657  17.859 -10.414 -12.230
  127   HD12  ILE 657          1HD1      ILE 657  16.663  -9.186 -12.640
  128   HD13  ILE 657          2HD1      ILE 657  16.472 -10.834 -13.234
  129    H    ASP 658           H        ASP 658  18.226  -5.831 -13.303
  130    HA   ASP 658           HA       ASP 658  20.600  -5.761 -11.709
  131    HB2  ASP 658           2HB      ASP 658  18.908  -3.854 -12.101
  132    HB3  ASP 658           1HB      ASP 658  17.922  -4.656 -10.883
  133    HA   PRO 659           HA       PRO 659  19.698  -9.234  -9.073
  134    HB2  PRO 659           2HB      PRO 659  21.225  -8.317  -6.944
  135    HB3  PRO 659           1HB      PRO 659  21.828  -9.286  -8.291
  136    HG2  PRO 659           2HG      PRO 659  21.965  -6.339  -7.859
  137    HG3  PRO 659           1HG      PRO 659  23.168  -7.428  -8.572
  138    HD2  PRO 659           2HD      PRO 659  21.649  -5.826 -10.093
  139    HD3  PRO 659           1HD      PRO 659  22.107  -7.456 -10.633
  140    H    GLY 660           H        GLY 660  19.399  -5.872  -7.962
  141    HA2  GLY 660           1HA      GLY 660  16.864  -5.882  -7.109
  142    HA3  GLY 660           2HA      GLY 660  17.653  -6.714  -5.783
  143    H    ALA 661           H        ALA 661  19.189  -4.088  -7.562
  144    HA   ALA 661           HA       ALA 661  19.439  -2.544  -5.143
  145    HB1  ALA 661           1HB      ALA 661  21.283  -2.122  -6.392
  146    HB2  ALA 661           2HB      ALA 661  20.430  -2.328  -7.921
  147    HB3  ALA 661           3HB      ALA 661  20.269  -0.822  -7.018
  148    H    ASP 662           H        ASP 662  17.102  -2.885  -7.536
  149    HA   ASP 662           HA       ASP 662  15.660  -0.572  -6.465
  150    HB2  ASP 662           2HB      ASP 662  16.613   0.010  -8.707
  151    HB3  ASP 662           1HB      ASP 662  15.677  -1.315  -9.397
  152    H    LEU 663           H        LEU 663  13.642  -1.071  -5.858
  153    HA   LEU 663           HA       LEU 663  12.740  -3.803  -6.302
  154    HB2  LEU 663           2HB      LEU 663  11.337  -1.754  -4.616
  155    HB3  LEU 663           1HB      LEU 663  11.293  -3.500  -4.474
  156    HG   LEU 663           HG       LEU 663  13.824  -1.959  -3.957
  157   HD11  LEU 663          1HD1      LEU 663  13.211  -1.355  -1.878
  158   HD12  LEU 663          2HD1      LEU 663  11.580  -1.432  -2.543
  159   HD13  LEU 663          3HD1      LEU 663  12.226  -2.798  -1.636
  160   HD21  LEU 663          3HD2      LEU 663  13.666  -4.513  -4.301
  161   HD22  LEU 663          1HD2      LEU 663  14.569  -3.897  -2.917
  162   HD23  LEU 663          2HD2      LEU 663  12.937  -4.524  -2.696
  163    H    SER 664           H        SER 664  12.511  -2.812  -8.660
  164    HA   SER 664           HA       SER 664  10.063  -1.392  -9.156
  165    HB2  SER 664           2HB      SER 664  10.978  -2.722 -11.497
  166    HB3  SER 664           1HB      SER 664  11.145  -1.014 -11.083
  167    HG   SER 664           HG       SER 664  13.129  -1.370 -10.278
  168    H    GLN 665           H        GLN 665  11.187  -4.709  -9.428
  169    HA   GLN 665           HA       GLN 665   8.752  -5.745 -10.514
  170    HB2  GLN 665           2HB      GLN 665  10.363  -7.755  -9.203
  171    HB3  GLN 665           1HB      GLN 665  10.017  -7.556 -10.913
  172    HG2  GLN 665           2HG      GLN 665  12.310  -7.427 -10.873
  173    HG3  GLN 665           1HG      GLN 665  11.853  -5.728 -10.818
  174   HE21  GLN 665          1HE2      GLN 665  14.167  -7.488  -9.760
  175   HE22  GLN 665          2HE2      GLN 665  14.370  -6.921  -8.142
  176    H    TYR 666           H        TYR 666  10.150  -5.363  -7.345
  177    HA   TYR 666           HA       TYR 666   8.206  -7.024  -6.016
  178    HB2  TYR 666           2HB      TYR 666  10.292  -5.129  -4.914
  179    HB3  TYR 666           1HB      TYR 666   9.304  -6.213  -3.942
  180    HD1  TYR 666           2HD      TYR 666   9.364  -8.729  -5.356
  181    HD2  TYR 666           1HD      TYR 666  12.463  -5.858  -4.859
  182    HE1  TYR 666           2HE      TYR 666  11.047 -10.502  -5.638
  183    HE2  TYR 666           1HE      TYR 666  14.149  -7.620  -5.133
  184    HH   TYR 666           HH       TYR 666  13.762 -10.343  -6.491
  185    H    LYS 667           H        LYS 667   8.004  -4.030  -7.346
  186    HA   LYS 667           HA       LYS 667   6.640  -2.671  -5.201
  187    HB2  LYS 667           2HB      LYS 667   8.039  -1.723  -7.248
  188    HB3  LYS 667           1HB      LYS 667   6.457  -1.709  -8.005
  189    HG2  LYS 667           2HG      LYS 667   5.935  -0.535  -5.602
  190    HG3  LYS 667           1HG      LYS 667   7.569   0.036  -5.947
  191    HD2  LYS 667           2HD      LYS 667   6.247   0.285  -8.372
  192    HD3  LYS 667           1HD      LYS 667   5.041   0.768  -7.177
  193    HE2  LYS 667           2HE      LYS 667   7.243   2.062  -6.257
  194    HE3  LYS 667           1HE      LYS 667   7.530   2.094  -7.996
  195    HZ1  LYS 667           3HZ      LYS 667   6.261   4.025  -7.088
  196    HZ2  LYS 667           1HZ      LYS 667   4.980   2.966  -6.758
  197    HZ3  LYS 667           2HZ      LYS 667   5.489   3.206  -8.357
  198    H    MET 668           H        MET 668   4.509  -2.183  -5.076
  199    HA   MET 668           HA       MET 668   2.704  -3.235  -7.118
  200    HB2  MET 668           2HB      MET 668   1.511  -4.574  -5.713
  201    HB3  MET 668           1HB      MET 668   3.059  -4.667  -4.890
  202    HG2  MET 668           2HG      MET 668   2.349  -3.003  -3.289
  203    HG3  MET 668           1HG      MET 668   0.829  -2.784  -4.150
  204    HE1  MET 668           3HE      MET 668   1.136  -3.092  -1.281
  205    HE2  MET 668           1HE      MET 668  -0.562  -3.532  -1.478
  206    HE3  MET 668           2HE      MET 668   0.520  -4.579  -0.562
  207    H    ASP 669           H        ASP 669   1.260  -1.749  -7.719
  208    HA   ASP 669           HA       ASP 669   1.226   0.727  -6.155
  209    HB2  ASP 669           2HB      ASP 669   1.255   0.154  -8.985
  210    HB3  ASP 669           1HB      ASP 669  -0.106   1.194  -8.573
  211    H    VAL 670           H        VAL 670  -0.667   1.780  -5.620
  212    HA   VAL 670           HA       VAL 670  -2.881  -0.054  -5.167
  213    HB   VAL 670           HB       VAL 670  -2.729   2.746  -4.081
  214   HG11  VAL 670          1HG1      VAL 670  -3.791   1.350  -2.118
  215   HG12  VAL 670          2HG1      VAL 670  -4.767   1.892  -3.482
  216   HG13  VAL 670          3HG1      VAL 670  -4.178   0.231  -3.425
  217   HG21  VAL 670          3HG2      VAL 670  -1.714   0.686  -2.287
  218   HG22  VAL 670          1HG2      VAL 670  -0.684   0.942  -3.695
  219   HG23  VAL 670          2HG2      VAL 670  -1.082   2.294  -2.635
  220    H    THR 671           H        THR 671  -4.266  -0.135  -6.827
  221    HA   THR 671           HA       THR 671  -5.081   2.300  -8.191
  222    HB   THR 671           HB       THR 671  -6.406  -0.349  -8.685
  223    HG1  THR 671           1HG      THR 671  -3.707   0.318  -9.136
  224   HG21  THR 671          3HG2      THR 671  -6.720   2.056  -9.841
  225   HG22  THR 671          1HG2      THR 671  -6.922   0.536 -10.717
  226   HG23  THR 671          2HG2      THR 671  -5.406   1.430 -10.837
  227    H    VAL 672           H        VAL 672  -6.521   3.547  -7.208
  228    HA   VAL 672           HA       VAL 672  -8.214   2.439  -5.134
  229    HB   VAL 672           HB       VAL 672  -8.280   5.302  -6.046
  230   HG11  VAL 672          1HG1      VAL 672  -9.020   3.777  -3.590
  231   HG12  VAL 672          2HG1      VAL 672  -8.551   5.473  -3.446
  232   HG13  VAL 672          3HG1      VAL 672  -9.923   5.021  -4.458
  233   HG21  VAL 672          3HG2      VAL 672  -6.413   4.423  -3.888
  234   HG22  VAL 672          1HG2      VAL 672  -5.904   4.307  -5.573
  235   HG23  VAL 672          2HG2      VAL 672  -6.366   5.869  -4.897
  236    H    ILE 673           H        ILE 673 -10.173   1.672  -5.515
  237    HA   ILE 673           HA       ILE 673 -11.557   2.385  -7.975
  238    HB   ILE 673           HB       ILE 673 -12.122   0.328  -5.844
  239   HG12  ILE 673          2HG1      ILE 673 -12.068  -0.803  -8.411
  240   HG13  ILE 673          1HG1      ILE 673 -10.748   0.363  -8.397
  241   HG21  ILE 673          1HG2      ILE 673 -14.174  -0.175  -6.726
  242   HG22  ILE 673          2HG2      ILE 673 -14.153   1.574  -6.965
  243   HG23  ILE 673          3HG2      ILE 673 -13.782   0.495  -8.311
  244   HD11  ILE 673          3HD1      ILE 673 -10.081  -0.740  -6.177
  245   HD12  ILE 673          1HD1      ILE 673 -11.145  -2.053  -6.683
  246   HD13  ILE 673          2HD1      ILE 673  -9.760  -1.604  -7.680
  247    H    ASP 674           H        ASP 674 -13.108   3.854  -8.072
  248    HA   ASP 674           HA       ASP 674 -14.061   5.056  -5.605
  249    HB2  ASP 674           2HB      ASP 674 -15.136   6.721  -7.211
  250    HB3  ASP 674           1HB      ASP 674 -13.382   6.701  -7.145
  251    H    THR 675           H        THR 675 -15.845   4.419  -4.699
  252    HA   THR 675           HA       THR 675 -17.696   2.675  -6.038
  253    HB   THR 675           HB       THR 675 -18.864   3.286  -3.635
  254    HG1  THR 675           1HG      THR 675 -16.648   3.071  -2.364
  255   HG21  THR 675          3HG2      THR 675 -18.562   1.040  -4.190
  256   HG22  THR 675          1HG2      THR 675 -17.494   1.258  -2.804
  257   HG23  THR 675          2HG2      THR 675 -16.827   1.234  -4.438
  258    H    LYS 676           H        LYS 676 -18.248   4.338  -7.682
  259    HA   LYS 676           HA       LYS 676 -19.781   6.625  -6.899
  260    HB2  LYS 676           2HB      LYS 676 -20.256   5.882  -9.634
  261    HB3  LYS 676           1HB      LYS 676 -19.381   7.268  -9.001
  262    HG2  LYS 676           2HG      LYS 676 -17.412   6.388  -9.548
  263    HG3  LYS 676           1HG      LYS 676 -17.818   4.834  -8.817
  264    HD2  LYS 676           2HD      LYS 676 -17.398   4.510 -11.168
  265    HD3  LYS 676           1HD      LYS 676 -19.119   4.269 -10.851
  266    HE2  LYS 676           2HE      LYS 676 -18.613   7.027 -11.449
  267    HE3  LYS 676           1HE      LYS 676 -17.936   6.005 -12.718
  268    HZ1  LYS 676           3HZ      LYS 676 -20.566   5.191 -11.894
  269    HZ2  LYS 676           1HZ      LYS 676 -19.957   5.474 -13.450
  270    HZ3  LYS 676           2HZ      LYS 676 -20.533   6.769 -12.516
  271    H    ASP 677           H        ASP 677 -20.713   3.832  -8.899
  272    HA   ASP 677           HA       ASP 677 -23.502   4.269  -8.284
  273    HB2  ASP 677           2HB      ASP 677 -22.297   1.987  -9.863
  274    HB3  ASP 677           1HB      ASP 677 -23.962   2.554  -9.903
  275    H    GLY 678           H        GLY 678 -23.103   3.902  -5.959
  276    HA2  GLY 678           1HA      GLY 678 -23.416   2.594  -4.093
  277    HA3  GLY 678           2HA      GLY 678 -23.867   1.275  -5.167
  278    H    SER 679           H        SER 679 -22.431  -0.314  -5.586
  279    HA   SER 679           HA       SER 679 -19.817  -0.115  -4.281
  280    HB2  SER 679           2HB      SER 679 -20.607  -2.713  -5.424
  281    HB3  SER 679           1HB      SER 679 -19.988  -2.327  -3.817
  282    HG   SER 679           HG       SER 679 -22.076  -1.594  -3.262
  283    H    GLN 680           H        GLN 680 -21.374  -0.654  -7.375
  284    HA   GLN 680           HA       GLN 680 -19.142   0.130  -8.897
  285    HB2  GLN 680           2HB      GLN 680 -18.717  -2.375  -8.010
  286    HB3  GLN 680           1HB      GLN 680 -19.659  -2.742  -9.449
  287    HG2  GLN 680           2HG      GLN 680 -17.781  -2.604 -10.607
  288    HG3  GLN 680           1HG      GLN 680 -17.791  -0.869 -10.294
  289   HE21  GLN 680          1HE2      GLN 680 -15.609  -0.620 -10.185
  290   HE22  GLN 680          2HE2      GLN 680 -14.639  -1.290  -8.915
  291    H    SER 681           H        SER 681 -19.757   0.573 -10.985
  292    HA   SER 681           HA       SER 681 -22.502   0.534 -11.643
  293    HB2  SER 681           2HB      SER 681 -20.650   0.762 -13.907
  294    HB3  SER 681           1HB      SER 681 -21.855   1.909 -13.316
  295    HG   SER 681           HG       SER 681 -20.412   2.811 -12.012
  296    H    LYS 682           H        LYS 682 -19.890  -1.678 -12.183
  297    HA   LYS 682           HA       LYS 682 -21.417  -3.239 -14.114
  298    HB2  LYS 682           2HB      LYS 682 -18.576  -3.260 -13.160
  299    HB3  LYS 682           1HB      LYS 682 -19.243  -4.687 -13.942
  300    HG2  LYS 682           2HG      LYS 682 -18.438  -3.681 -15.791
  301    HG3  LYS 682           1HG      LYS 682 -19.989  -2.842 -15.728
  302    HD2  LYS 682           2HD      LYS 682 -18.885  -1.021 -14.440
  303    HD3  LYS 682           1HD      LYS 682 -17.344  -1.844 -14.678
  304    HE2  LYS 682           2HE      LYS 682 -18.839  -1.463 -17.151
  305    HE3  LYS 682           1HE      LYS 682 -18.435   0.052 -16.343
  306    HZ1  LYS 682           3HZ      LYS 682 -16.766  -0.905 -17.989
  307    HZ2  LYS 682           1HZ      LYS 682 -16.396  -2.043 -16.784
  308    HZ3  LYS 682           2HZ      LYS 682 -16.169  -0.387 -16.487
  309    H    LEU 683           H        LEU 683 -21.784  -2.937 -11.024
  310    HA   LEU 683           HA       LEU 683 -21.559  -5.701 -10.183
  311    HB2  LEU 683           2HB      LEU 683 -21.229  -3.531  -8.770
  312    HB3  LEU 683           1HB      LEU 683 -22.977  -3.554  -8.649
  313    HG   LEU 683           HG       LEU 683 -22.341  -6.114  -7.922
  314   HD11  LEU 683          1HD1      LEU 683 -20.502  -5.992  -6.351
  315   HD12  LEU 683          2HD1      LEU 683 -19.941  -5.560  -7.967
  316   HD13  LEU 683          3HD1      LEU 683 -20.228  -4.300  -6.766
  317   HD21  LEU 683          3HD2      LEU 683 -22.895  -3.581  -6.453
  318   HD22  LEU 683          1HD2      LEU 683 -23.911  -5.006  -6.659
  319   HD23  LEU 683          2HD2      LEU 683 -22.545  -5.052  -5.542
  320    H    GLY 684           H        GLY 684 -24.005  -3.436 -11.264
  321    HA2  GLY 684           1HA      GLY 684 -26.041  -3.996 -12.256
  322    HA3  GLY 684           2HA      GLY 684 -25.837  -5.646 -11.690
  323    H    GLY 685           H        GLY 685 -26.066  -5.958  -9.301
  324    HA2  GLY 685           1HA      GLY 685 -27.029  -5.354  -7.227
  325    HA3  GLY 685           2HA      GLY 685 -27.790  -3.975  -8.007
  326    H    GLY 901           H        GLY 901 -28.044  -6.927  -9.703
  327    HA2  GLY 901           1HA      GLY 901 -29.744  -8.631  -9.263
  328    HA3  GLY 901           2HA      GLY 901 -30.754  -7.352  -8.608
  329    H    GLY 902           H        GLY 902 -32.406  -8.011 -10.045
  330    HA2  GLY 902           1HA      GLY 902 -32.299  -6.603 -12.564
  331    HA3  GLY 902           2HA      GLY 902 -32.413  -8.351 -12.736
  332    H    SER 903           H        SER 903 -34.129  -9.261 -11.047
  333    HA   SER 903           HA       SER 903 -36.588  -7.709 -11.489
  334    HB2  SER 903           2HB      SER 903 -36.824 -10.494 -10.539
  335    HB3  SER 903           1HB      SER 903 -37.700  -9.667 -11.828
  336    HG   SER 903           HG       SER 903 -36.124 -10.146 -13.245
  337    H    GLY 904           H        GLY 904 -36.491  -6.350  -9.720
  338    HA2  GLY 904           1HA      GLY 904 -36.544  -7.680  -7.078
  339    HA3  GLY 904           2HA      GLY 904 -35.906  -6.062  -7.346
  340    H    GLY 905           H        GLY 905 -37.196  -4.429  -6.929
  341    HA2  GLY 905           1HA      GLY 905 -39.911  -4.257  -7.628
  342    HA3  GLY 905           2HA      GLY 905 -39.813  -4.765  -5.946
  343    H    HIS 906           H        HIS 906 -38.201  -3.432  -4.632
  344    HA   HIS 906           HA       HIS 906 -38.543  -0.588  -5.335
  345    HB2  HIS 906           2HB      HIS 906 -39.629  -1.560  -3.198
  346    HB3  HIS 906           1HB      HIS 906 -37.990  -1.611  -2.556
  347    HD1  HIS 906           1HD      HIS 906 -37.928   0.298  -0.913
  348    HD2  HIS 906           2HD      HIS 906 -39.680   1.348  -4.540
  349    HE1  HIS 906           1HE      HIS 906 -38.337   2.792  -0.813
  350    H    MET 907           H        MET 907 -36.780   0.704  -5.440
  351    HA   MET 907           HA       MET 907 -34.192  -0.556  -5.498
  352    HB2  MET 907           2HB      MET 907 -34.944   1.234  -7.100
  353    HB3  MET 907           1HB      MET 907 -34.826   2.382  -5.775
  354    HG2  MET 907           2HG      MET 907 -32.870   2.240  -7.391
  355    HG3  MET 907           1HG      MET 907 -32.504   2.207  -5.669
  356    HE1  MET 907           3HE      MET 907 -30.930   1.258  -8.452
  357    HE2  MET 907           1HE      MET 907 -29.999   1.260  -6.955
  358    HE3  MET 907           2HE      MET 907 -30.063  -0.193  -7.950
  359    H    GLY 908           H        GLY 908 -34.191  -1.204  -3.260
  360    HA2  GLY 908           1HA      GLY 908 -33.018   0.926  -1.592
  361    HA3  GLY 908           2HA      GLY 908 -34.179  -0.209  -0.913
  362    H    SER 909           H        SER 909 -31.016   0.044  -2.435
  363    HA   SER 909           HA       SER 909 -30.313  -2.689  -1.949
  364    HB2  SER 909           2HB      SER 909 -28.004  -1.130  -2.497
  365    HB3  SER 909           1HB      SER 909 -28.887  -2.183  -3.600
  366    HG   SER 909           HG       SER 909 -28.714   0.468  -3.652
  367    H    GLY 910           H        GLY 910 -30.996  -2.018   0.478
  368    HA2  GLY 910           1HA      GLY 910 -28.696  -1.051   1.990
  369    HA3  GLY 910           2HA      GLY 910 -30.277  -1.459   2.640
  370    H    GLY 911           H        GLY 911 -28.980  -3.768   0.524
  371    HA2  GLY 911           1HA      GLY 911 -27.345  -5.220   2.350
  372    HA3  GLY 911           2HA      GLY 911 -28.968  -5.894   2.270
  373    H    LEU  18           H        LEU  18 -25.950  -6.152   1.011
  374    HA   LEU  18           HA       LEU  18 -26.832  -7.732  -1.212
  375    HB2  LEU  18           2HB      LEU  18 -26.452  -5.027  -1.682
  376    HB3  LEU  18           1HB      LEU  18 -24.948  -5.753  -2.209
  377    HG   LEU  18           HG       LEU  18 -27.099  -7.302  -3.262
  378   HD11  LEU  18          1HD1      LEU  18 -28.691  -5.719  -3.438
  379   HD12  LEU  18          2HD1      LEU  18 -27.545  -4.393  -3.240
  380   HD13  LEU  18          3HD1      LEU  18 -27.719  -5.181  -4.807
  381   HD21  LEU  18          3HD2      LEU  18 -25.041  -7.337  -4.348
  382   HD22  LEU  18          1HD2      LEU  18 -26.057  -6.364  -5.413
  383   HD23  LEU  18          2HD2      LEU  18 -24.899  -5.582  -4.338
  384    H    SER  19           H        SER  19 -24.626  -8.112  -2.624
  385    HA   SER  19           HA       SER  19 -22.788  -9.266  -0.691
  386    HB2  SER  19           2HB      SER  19 -21.890  -9.985  -3.194
  387    HB3  SER  19           1HB      SER  19 -23.042 -10.910  -2.227
  388    HG   SER  19           HG       SER  19 -24.113 -10.600  -4.097
  389    H    TRP  20           H        TRP  20 -22.888  -6.837  -3.191
  390    HA   TRP  20           HA       TRP  20 -21.431  -5.290  -3.969
  391    HB2  TRP  20           2HB      TRP  20 -19.925  -5.384  -1.373
  392    HB3  TRP  20           1HB      TRP  20 -20.303  -3.997  -2.386
  393    HD1  TRP  20           HD       TRP  20 -23.262  -3.743  -2.514
  394    HE1  TRP  20           1HE      TRP  20 -24.767  -3.549  -0.437
  395    HE3  TRP  20           3HE      TRP  20 -20.114  -5.760   0.969
  396    HZ2  TRP  20           2HZ      TRP  20 -24.641  -4.163   2.301
  397    HZ3  TRP  20           3HZ      TRP  20 -20.882  -5.914   3.302
  398    HH2  TRP  20           HH       TRP  20 -23.101  -5.129   3.956
  399    H    LYS  21           H        LYS  21 -18.647  -5.587  -2.300
  400    HA   LYS  21           HA       LYS  21 -17.442  -7.284  -4.381
  401    HB2  LYS  21           2HB      LYS  21 -16.809  -4.667  -3.449
  402    HB3  LYS  21           1HB      LYS  21 -15.493  -5.732  -2.981
  403    HG2  LYS  21           2HG      LYS  21 -15.161  -4.627  -5.170
  404    HG3  LYS  21           1HG      LYS  21 -15.127  -6.388  -5.252
  405    HD2  LYS  21           2HD      LYS  21 -17.646  -6.169  -5.819
  406    HD3  LYS  21           1HD      LYS  21 -17.245  -4.493  -6.197
  407    HE2  LYS  21           2HE      LYS  21 -16.993  -5.533  -8.249
  408    HE3  LYS  21           1HE      LYS  21 -15.346  -5.529  -7.622
  409    HZ1  LYS  21           3HZ      LYS  21 -16.292  -7.684  -8.624
  410    HZ2  LYS  21           1HZ      LYS  21 -17.115  -7.843  -7.147
  411    HZ3  LYS  21           2HZ      LYS  21 -15.422  -7.779  -7.168
  412    H    ARG  22           H        ARG  22 -15.934  -8.856  -3.759
  413    HA   ARG  22           HA       ARG  22 -16.124  -9.609  -0.936
  414    HB2  ARG  22           2HB      ARG  22 -16.466 -11.122  -3.188
  415    HB3  ARG  22           1HB      ARG  22 -14.791 -11.473  -2.779
  416    HG2  ARG  22           2HG      ARG  22 -16.907 -11.634  -0.676
  417    HG3  ARG  22           1HG      ARG  22 -16.686 -12.956  -1.823
  418    HD2  ARG  22           2HD      ARG  22 -14.116 -12.376  -1.003
  419    HD3  ARG  22           1HD      ARG  22 -15.068 -12.181   0.468
  420    HE   ARG  22           HE       ARG  22 -15.446 -14.440   0.505
  421   HH11  ARG  22          2HH1      ARG  22 -14.007 -13.542  -2.559
  422   HH12  ARG  22          1HH1      ARG  22 -13.848 -15.180  -3.120
  423   HH21  ARG  22          2HH2      ARG  22 -15.203 -16.616  -0.216
  424   HH22  ARG  22          1HH2      ARG  22 -14.504 -16.919  -1.775
  425    H    CYS  23           H        CYS  23 -14.375  -9.882   0.355
  426    HA   CYS  23           HA       CYS  23 -11.957  -8.525  -0.553
  427    HB2  CYS  23           2HB      CYS  23 -13.027  -7.696   1.475
  428    HB3  CYS  23           1HB      CYS  23 -12.904  -9.288   2.214
  429    H    ALA  24           H        ALA  24  -9.879  -9.312  -0.065
  430    HA   ALA  24           HA       ALA  24  -9.705 -12.243   0.143
  431    HB1  ALA  24           1HB      ALA  24  -7.685 -10.276  -0.934
  432    HB2  ALA  24           2HB      ALA  24  -7.501 -12.028  -0.891
  433    HB3  ALA  24           3HB      ALA  24  -8.749 -11.300  -1.900
  434    H    GLY  25           H        GLY  25  -9.489  -9.545   1.993
  435    HA2  GLY  25           1HA      GLY  25  -7.142 -10.388   3.532
  436    HA3  GLY  25           2HA      GLY  25  -8.010  -8.872   3.708
  437    H    CYS  26           H        CYS  26 -10.623  -9.748   4.089
  438    HA   CYS  26           HA       CYS  26 -10.285 -11.057   6.683
  439    HB2  CYS  26           2HB      CYS  26 -12.720 -10.241   7.046
  440    HB3  CYS  26           1HB      CYS  26 -11.404  -9.088   7.167
  441    H    GLY  27           H        GLY  27 -12.402 -11.112   3.826
  442    HA2  GLY  27           1HA      GLY  27 -12.452 -13.428   2.842
  443    HA3  GLY  27           2HA      GLY  27 -12.895 -13.958   4.456
  444    H    GLY  28           H        GLY  28 -14.544 -11.400   4.670
  445    HA2  GLY  28           1HA      GLY  28 -16.925 -12.579   3.464
  446    HA3  GLY  28           2HA      GLY  28 -16.895 -11.319   4.690
  447    H    LYS  29           H        LYS  29 -18.256  -9.934   3.623
  448    HA   LYS  29           HA       LYS  29 -17.524  -9.061   0.939
  449    HB2  LYS  29           2HB      LYS  29 -19.800  -7.808   2.384
  450    HB3  LYS  29           1HB      LYS  29 -19.673  -8.292   0.699
  451    HG2  LYS  29           2HG      LYS  29 -19.863 -10.662   1.446
  452    HG3  LYS  29           1HG      LYS  29 -20.185 -10.062   3.073
  453    HD2  LYS  29           2HD      LYS  29 -21.812  -9.046   0.785
  454    HD3  LYS  29           1HD      LYS  29 -22.166 -10.638   1.464
  455    HE2  LYS  29           2HE      LYS  29 -21.873  -8.966   3.670
  456    HE3  LYS  29           1HE      LYS  29 -22.772  -8.004   2.496
  457    HZ1  LYS  29           3HZ      LYS  29 -23.569 -10.389   3.943
  458    HZ2  LYS  29           1HZ      LYS  29 -24.060 -10.324   2.321
  459    HZ3  LYS  29           2HZ      LYS  29 -24.506  -9.088   3.393
  460    H    ILE  30           H        ILE  30 -16.936  -6.977   0.438
  461    HA   ILE  30           HA       ILE  30 -15.636  -5.488   2.524
  462    HB   ILE  30           HB       ILE  30 -16.074  -4.847  -0.403
  463   HG12  ILE  30          2HG1      ILE  30 -13.530  -5.640   1.019
  464   HG13  ILE  30          1HG1      ILE  30 -14.582  -6.800   0.213
  465   HG21  ILE  30          1HG2      ILE  30 -13.971  -3.445   1.131
  466   HG22  ILE  30          2HG2      ILE  30 -14.981  -2.872  -0.195
  467   HG23  ILE  30          3HG2      ILE  30 -15.634  -2.951   1.442
  468   HD11  ILE  30          3HD1      ILE  30 -13.283  -6.443  -1.560
  469   HD12  ILE  30          1HD1      ILE  30 -14.175  -4.933  -1.738
  470   HD13  ILE  30          2HD1      ILE  30 -12.625  -4.947  -0.894
  471    H    ALA  31           H        ALA  31 -16.864  -4.406   3.918
  472    HA   ALA  31           HA       ALA  31 -19.183  -2.931   2.906
  473    HB1  ALA  31           1HB      ALA  31 -20.208  -3.729   4.706
  474    HB2  ALA  31           2HB      ALA  31 -18.701  -4.432   5.297
  475    HB3  ALA  31           3HB      ALA  31 -19.118  -2.770   5.710
  476    H    ASP  32           H        ASP  32 -16.166  -2.338   2.987
  477    HA   ASP  32           HA       ASP  32 -16.053   0.159   4.431
  478    HB2  ASP  32           2HB      ASP  32 -14.135  -1.569   3.583
  479    HB3  ASP  32           1HB      ASP  32 -14.078  -0.373   2.293
  480    H    ARG  33           H        ARG  33 -15.192   2.101   2.991
  481    HA   ARG  33           HA       ARG  33 -17.347   2.575   1.122
  482    HB2  ARG  33           2HB      ARG  33 -15.724   4.191   2.798
  483    HB3  ARG  33           1HB      ARG  33 -15.475   4.731   1.141
  484    HG2  ARG  33           2HG      ARG  33 -18.254   4.309   1.518
  485    HG3  ARG  33           1HG      ARG  33 -17.653   5.273   2.869
  486    HD2  ARG  33           2HD      ARG  33 -16.961   7.002   1.492
  487    HD3  ARG  33           1HD      ARG  33 -16.870   5.965   0.068
  488    HE   ARG  33           HE       ARG  33 -19.067   6.419  -0.364
  489   HH11  ARG  33          2HH1      ARG  33 -18.390   7.283   2.972
  490   HH12  ARG  33          1HH1      ARG  33 -19.956   7.981   3.240
  491   HH21  ARG  33          2HH2      ARG  33 -21.141   7.349   0.001
  492   HH22  ARG  33          1HH2      ARG  33 -21.509   8.017   1.566
  493    H    PHE  34           H        PHE  34 -13.825   3.074   0.931
  494    HA   PHE  34           HA       PHE  34 -14.047   2.660  -1.966
  495    HB2  PHE  34           2HB      PHE  34 -12.312   4.317  -0.251
  496    HB3  PHE  34           1HB      PHE  34 -11.504   3.547  -1.615
  497    HD1  PHE  34           2HD      PHE  34 -14.947   4.910  -1.303
  498    HD2  PHE  34           1HD      PHE  34 -11.143   5.210  -3.177
  499    HE1  PHE  34           2HE      PHE  34 -15.834   6.633  -2.811
  500    HE2  PHE  34           1HE      PHE  34 -12.020   6.937  -4.691
  501    HZ   PHE  34           HZ       PHE  34 -14.372   7.641  -4.514
  502    H    LEU  35           H        LEU  35 -13.342   0.840  -2.850
  503    HA   LEU  35           HA       LEU  35 -11.604  -0.910  -1.292
  504    HB2  LEU  35           2HB      LEU  35 -11.986  -2.391  -3.447
  505    HB3  LEU  35           1HB      LEU  35 -13.167  -2.320  -2.156
  506    HG   LEU  35           HG       LEU  35 -13.577  -0.323  -4.273
  507   HD11  LEU  35          1HD1      LEU  35 -14.325  -3.121  -4.973
  508   HD12  LEU  35          2HD1      LEU  35 -14.117  -1.715  -6.017
  509   HD13  LEU  35          3HD1      LEU  35 -12.705  -2.539  -5.355
  510   HD21  LEU  35          3HD2      LEU  35 -15.898  -1.232  -4.057
  511   HD22  LEU  35          1HD2      LEU  35 -15.287  -2.338  -2.827
  512   HD23  LEU  35          2HD2      LEU  35 -15.217  -0.596  -2.559
  513    H    LEU  36           H        LEU  36  -9.648  -1.738  -2.163
  514    HA   LEU  36           HA       LEU  36  -8.460   0.057  -4.170
  515    HB2  LEU  36           2HB      LEU  36  -6.979  -0.864  -1.720
  516    HB3  LEU  36           1HB      LEU  36  -6.512   0.380  -2.865
  517    HG   LEU  36           HG       LEU  36  -9.004   1.150  -1.740
  518   HD11  LEU  36          1HD1      LEU  36  -7.640  -0.480   0.059
  519   HD12  LEU  36          2HD1      LEU  36  -7.280   1.171   0.568
  520   HD13  LEU  36          3HD1      LEU  36  -8.955   0.641   0.416
  521   HD21  LEU  36          3HD2      LEU  36  -6.509   2.239  -2.394
  522   HD22  LEU  36          1HD2      LEU  36  -7.953   3.102  -1.866
  523   HD23  LEU  36          2HD2      LEU  36  -6.753   2.585  -0.681
  524    H    TYR  37           H        TYR  37  -6.970  -0.799  -5.514
  525    HA   TYR  37           HA       TYR  37  -6.608  -3.697  -5.536
  526    HB2  TYR  37           2HB      TYR  37  -6.437  -1.498  -7.469
  527    HB3  TYR  37           1HB      TYR  37  -5.102  -2.634  -7.600
  528    HD1  TYR  37           1HD      TYR  37  -6.468  -5.181  -6.952
  529    HD2  TYR  37           2HD      TYR  37  -7.710  -1.898  -9.343
  530    HE1  TYR  37           1HE      TYR  37  -7.881  -6.695  -8.271
  531    HE2  TYR  37           2HE      TYR  37  -9.128  -3.383 -10.669
  532    HH   TYR  37           HH       TYR  37  -8.915  -6.251 -11.097
  533    H    ALA  38           H        ALA  38  -4.770  -4.648  -4.854
  534    HA   ALA  38           HA       ALA  38  -2.433  -2.917  -4.394
  535    HB1  ALA  38           1HB      ALA  38  -1.831  -4.249  -2.504
  536    HB2  ALA  38           2HB      ALA  38  -3.521  -3.776  -2.321
  537    HB3  ALA  38           3HB      ALA  38  -3.113  -5.410  -2.848
  538    H    MET  39           H        MET  39  -2.668  -6.412  -4.175
  539    HA   MET  39           HA       MET  39  -0.422  -6.671  -5.970
  540    HB2  MET  39           2HB      MET  39  -1.943  -8.523  -4.173
  541    HB3  MET  39           1HB      MET  39  -0.899  -9.188  -5.419
  542    HG2  MET  39           2HG      MET  39   1.002  -7.971  -4.479
  543    HG3  MET  39           1HG      MET  39  -0.051  -7.309  -3.227
  544    HE1  MET  39           3HE      MET  39   0.636  -9.596  -0.481
  545    HE2  MET  39           1HE      MET  39   1.477  -8.231  -1.217
  546    HE3  MET  39           2HE      MET  39  -0.281  -8.204  -1.062
  547    H    ASP  40           H        ASP  40  -3.819  -7.681  -5.878
  548    HA   ASP  40           HA       ASP  40  -4.229  -7.726  -8.637
  549    HB2  ASP  40           2HB      ASP  40  -4.071 -10.013  -9.245
  550    HB3  ASP  40           1HB      ASP  40  -2.572  -9.660  -8.396
  551    H    SER  41           H        SER  41  -5.092  -8.415  -5.440
  552    HA   SER  41           HA       SER  41  -7.779  -9.300  -6.166
  553    HB2  SER  41           2HB      SER  41  -7.325  -9.295  -3.343
  554    HB3  SER  41           1HB      SER  41  -7.541 -10.678  -4.415
  555    HG   SER  41           HG       SER  41  -5.238 -10.450  -4.911
  556    H    TYR  42           H        TYR  42  -9.523  -8.430  -4.634
  557    HA   TYR  42           HA       TYR  42  -9.308  -5.526  -4.542
  558    HB2  TYR  42           2HB      TYR  42 -11.658  -7.378  -4.084
  559    HB3  TYR  42           1HB      TYR  42 -11.744  -5.624  -3.998
  560    HD1  TYR  42           2HD      TYR  42 -10.954  -8.429  -6.303
  561    HD2  TYR  42           1HD      TYR  42 -12.125  -4.355  -5.935
  562    HE1  TYR  42           2HE      TYR  42 -11.397  -8.346  -8.719
  563    HE2  TYR  42           1HE      TYR  42 -12.562  -4.258  -8.353
  564    HH   TYR  42           HH       TYR  42 -11.417  -6.403 -10.508
  565    H    TRP  43           H        TRP  43  -9.079  -4.394  -2.718
  566    HA   TRP  43           HA       TRP  43  -9.482  -5.766  -0.147
  567    HB2  TRP  43           2HB      TRP  43  -7.271  -3.759  -0.546
  568    HB3  TRP  43           1HB      TRP  43  -7.475  -4.915   0.761
  569    HD1  TRP  43           HD       TRP  43  -6.577  -4.910  -3.012
  570    HE1  TRP  43           1HE      TRP  43  -5.002  -6.894  -3.442
  571    HE3  TRP  43           3HE      TRP  43  -6.577  -6.977   1.658
  572    HZ2  TRP  43           2HZ      TRP  43  -3.884  -9.039  -1.996
  573    HZ3  TRP  43           3HZ      TRP  43  -5.223  -8.996   2.057
  574    HH2  TRP  43           HH       TRP  43  -3.903 -10.003   0.260
  575    H    HIS  44           H        HIS  44  -9.437  -4.068   1.664
  576    HA   HIS  44           HA       HIS  44 -10.409  -1.440   0.830
  577    HB2  HIS  44           2HB      HIS  44 -12.095  -1.499   2.742
  578    HB3  HIS  44           1HB      HIS  44 -12.496  -2.495   1.349
  579    HD1  HIS  44           1HD      HIS  44 -13.256  -2.827   4.621
  580    HD2  HIS  44           2HD      HIS  44 -10.811  -5.130   2.173
  581    HE1  HIS  44           1HE      HIS  44 -13.063  -5.121   5.724
  582    H    SER  45           H        SER  45 -10.496  -0.013   2.946
  583    HA   SER  45           HA       SER  45  -7.882   0.489   3.548
  584    HB2  SER  45           2HB      SER  45  -9.628   1.312   5.722
  585    HB3  SER  45           1HB      SER  45  -8.755   2.292   4.545
  586    HG   SER  45           HG       SER  45 -11.334   1.140   4.349
  587    H    ARG  46           H        ARG  46 -10.073  -1.584   5.399
  588    HA   ARG  46           HA       ARG  46  -8.395  -1.684   7.694
  589    HB2  ARG  46           2HB      ARG  46 -11.013  -2.262   7.209
  590    HB3  ARG  46           1HB      ARG  46 -10.321  -3.873   7.365
  591    HG2  ARG  46           2HG      ARG  46  -9.351  -2.098   9.414
  592    HG3  ARG  46           1HG      ARG  46 -11.112  -2.194   9.418
  593    HD2  ARG  46           2HD      ARG  46  -9.604  -4.735   9.152
  594    HD3  ARG  46           1HD      ARG  46  -9.589  -3.945  10.729
  595    HE   ARG  46           HE       ARG  46 -11.992  -4.107  10.764
  596   HH11  ARG  46          2HH1      ARG  46 -10.326  -6.074   8.388
  597   HH12  ARG  46          1HH1      ARG  46 -11.710  -7.074   8.068
  598   HH21  ARG  46          2HH2      ARG  46 -13.809  -5.427  10.356
  599   HH22  ARG  46          1HH2      ARG  46 -13.699  -6.692   9.159
  600    H    CYS  47           H        CYS  47  -8.736  -3.779   4.868
  601    HA   CYS  47           HA       CYS  47  -6.985  -5.750   6.139
  602    HB2  CYS  47           2HB      CYS  47  -8.711  -5.841   3.683
  603    HB3  CYS  47           1HB      CYS  47  -7.498  -7.072   4.011
  604    H    LEU  48           H        LEU  48  -7.081  -3.470   3.476
  605    HA   LEU  48           HA       LEU  48  -4.622  -4.360   2.328
  606    HB2  LEU  48           2HB      LEU  48  -6.647  -2.861   1.390
  607    HB3  LEU  48           1HB      LEU  48  -5.553  -1.582   1.878
  608    HG   LEU  48           HG       LEU  48  -5.539  -3.057  -0.522
  609   HD11  LEU  48          1HD1      LEU  48  -3.958  -1.474  -1.185
  610   HD12  LEU  48          2HD1      LEU  48  -4.965  -0.656   0.012
  611   HD13  LEU  48          3HD1      LEU  48  -3.368  -1.251   0.462
  612   HD21  LEU  48          3HD2      LEU  48  -3.450  -3.928   1.388
  613   HD22  LEU  48          1HD2      LEU  48  -4.174  -4.786   0.027
  614   HD23  LEU  48          2HD2      LEU  48  -2.928  -3.569  -0.258
  615    H    LYS  49           H        LYS  49  -3.533  -4.434   4.404
  616    HA   LYS  49           HA       LYS  49  -2.072  -1.949   4.888
  617    HB2  LYS  49           2HB      LYS  49  -3.051  -3.638   7.193
  618    HB3  LYS  49           1HB      LYS  49  -2.330  -2.037   7.249
  619    HG2  LYS  49           2HG      LYS  49  -4.553  -1.576   5.754
  620    HG3  LYS  49           1HG      LYS  49  -5.117  -2.840   6.849
  621    HD2  LYS  49           2HD      LYS  49  -3.553  -0.873   8.260
  622    HD3  LYS  49           1HD      LYS  49  -4.887  -0.113   7.392
  623    HE2  LYS  49           2HE      LYS  49  -6.448  -1.054   8.715
  624    HE3  LYS  49           1HE      LYS  49  -5.578  -2.583   8.818
  625    HZ1  LYS  49           3HZ      LYS  49  -5.445  -1.788  10.950
  626    HZ2  LYS  49           1HZ      LYS  49  -5.282  -0.168  10.476
  627    HZ3  LYS  49           2HZ      LYS  49  -3.978  -1.238  10.305
  628    H    CYS  50           H        CYS  50  -0.295  -2.510   6.557
  629    HA   CYS  50           HA       CYS  50   1.358  -4.573   5.549
  630    HB2  CYS  50           2HB      CYS  50   2.029  -2.400   6.644
  631    HB3  CYS  50           1HB      CYS  50   1.557  -3.105   8.177
  632    H    SER  51           H        SER  51   1.681  -6.636   6.306
  633    HA   SER  51           HA       SER  51  -0.131  -7.677   8.295
  634    HB2  SER  51           2HB      SER  51   1.530  -9.744   7.883
  635    HB3  SER  51           1HB      SER  51   0.222  -9.347   6.772
  636    HG   SER  51           HG       SER  51   1.718  -8.231   5.484
  637    H    SER  52           H        SER  52   2.806  -6.075   8.372
  638    HA   SER  52           HA       SER  52   3.768  -7.487  10.744
  639    HB2  SER  52           2HB      SER  52   5.431  -5.275   9.860
  640    HB3  SER  52           1HB      SER  52   5.829  -6.986  10.024
  641    HG   SER  52           HG       SER  52   4.658  -5.660   7.806
  642    H    CYS  53           H        CYS  53   3.109  -4.102   9.725
  643    HA   CYS  53           HA       CYS  53   2.885  -3.479  12.590
  644    HB2  CYS  53           2HB      CYS  53   3.519  -1.204  12.116
  645    HB3  CYS  53           1HB      CYS  53   4.718  -2.290  11.434
  646    H    GLN  54           H        GLN  54   1.184  -3.770   9.723
  647    HA   GLN  54           HA       GLN  54  -0.977  -3.510   9.149
  648    HB2  GLN  54           2HB      GLN  54  -0.966  -3.981  11.972
  649    HB3  GLN  54           1HB      GLN  54  -2.282  -2.884  11.572
  650    HG2  GLN  54           2HG      GLN  54  -2.006  -5.201   9.793
  651    HG3  GLN  54           1HG      GLN  54  -2.440  -5.576  11.460
  652   HE21  GLN  54          1HE2      GLN  54  -3.806  -5.370   8.658
  653   HE22  GLN  54          2HE2      GLN  54  -5.319  -4.619   9.054
  654    H    ALA  55           H        ALA  55   0.744  -1.122   9.247
  655    HA   ALA  55           HA       ALA  55  -0.838   1.125   9.937
  656    HB1  ALA  55           1HB      ALA  55   0.674   2.362   8.402
  657    HB2  ALA  55           2HB      ALA  55   1.535   1.375   9.584
  658    HB3  ALA  55           3HB      ALA  55   1.382   0.823   7.916
  659    H    GLN  56           H        GLN  56  -2.122   2.462   8.601
  660    HA   GLN  56           HA       GLN  56  -3.847   1.065   6.865
  661    HB2  GLN  56           2HB      GLN  56  -3.461   3.994   7.441
  662    HB3  GLN  56           1HB      GLN  56  -4.675   3.417   6.313
  663    HG2  GLN  56           2HG      GLN  56  -4.625   2.240   9.034
  664    HG3  GLN  56           1HG      GLN  56  -5.231   3.882   8.842
  665   HE21  GLN  56          1HE2      GLN  56  -6.824   4.090   6.949
  666   HE22  GLN  56          2HE2      GLN  56  -8.031   2.855   6.861
  667    H    LEU  57           H        LEU  57  -2.608   0.137   5.204
  668    HA   LEU  57           HA       LEU  57  -0.871   1.664   3.539
  669    HB2  LEU  57           2HB      LEU  57  -1.706  -1.089   3.823
  670    HB3  LEU  57           1HB      LEU  57  -1.665  -0.629   2.134
  671    HG   LEU  57           HG       LEU  57   0.677   0.050   2.376
  672   HD11  LEU  57          1HD1      LEU  57   0.522   0.621   4.808
  673   HD12  LEU  57          2HD1      LEU  57   0.567  -1.111   5.150
  674   HD13  LEU  57          3HD1      LEU  57   1.937  -0.332   4.356
  675   HD21  LEU  57          3HD2      LEU  57   0.599  -2.688   3.513
  676   HD22  LEU  57          1HD2      LEU  57  -0.217  -2.395   1.979
  677   HD23  LEU  57          2HD2      LEU  57   1.507  -2.062   2.136
  678    H    GLY  58           H        GLY  58  -4.258   1.051   3.569
  679    HA2  GLY  58           1HA      GLY  58  -4.606   1.824   0.791
  680    HA3  GLY  58           2HA      GLY  58  -5.872   1.343   1.909
  681    H    ASP  59           H        ASP  59  -4.016   3.522   3.531
  682    HA   ASP  59           HA       ASP  59  -5.875   5.683   2.843
  683    HB2  ASP  59           2HB      ASP  59  -4.837   4.703   5.340
  684    HB3  ASP  59           1HB      ASP  59  -4.421   6.406   5.145
  685    H    ILE  60           H        ILE  60  -3.165   4.786   1.693
  686    HA   ILE  60           HA       ILE  60  -2.227   7.521   1.287
  687    HB   ILE  60           HB       ILE  60   0.131   6.035   1.221
  688   HG12  ILE  60          2HG1      ILE  60  -0.606   5.583   3.992
  689   HG13  ILE  60          1HG1      ILE  60  -1.607   4.636   2.897
  690   HG21  ILE  60          1HG2      ILE  60   0.906   7.625   2.671
  691   HG22  ILE  60          2HG2      ILE  60  -0.546   8.421   2.064
  692   HG23  ILE  60          3HG2      ILE  60  -0.569   7.624   3.637
  693   HD11  ILE  60          3HD1      ILE  60   0.325   3.594   1.943
  694   HD12  ILE  60          1HD1      ILE  60   1.402   4.650   2.854
  695   HD13  ILE  60          2HD1      ILE  60   0.416   3.456   3.699
  696    H    GLY  61           H        GLY  61  -1.563   7.916  -0.769
  697    HA2  GLY  61           1HA      GLY  61  -2.085   5.841  -2.728
  698    HA3  GLY  61           2HA      GLY  61  -1.705   7.526  -3.064
  699    H    THR  62           H        THR  62   0.262   5.573  -0.954
  700    HA   THR  62           HA       THR  62   2.469   5.800  -2.864
  701    HB   THR  62           HB       THR  62   3.271   4.740  -0.311
  702    HG1  THR  62           1HG      THR  62   1.854   7.228  -0.239
  703   HG21  THR  62          3HG2      THR  62   3.791   7.401  -1.636
  704   HG22  THR  62          1HG2      THR  62   4.716   5.926  -1.905
  705   HG23  THR  62          2HG2      THR  62   4.730   6.697  -0.319
  706    H    SER  63           H        SER  63   3.301   4.049  -3.833
  707    HA   SER  63           HA       SER  63   1.988   1.557  -3.686
  708    HB2  SER  63           2HB      SER  63   4.690   1.537  -4.829
  709    HB3  SER  63           1HB      SER  63   3.145   1.110  -5.566
  710    HG   SER  63           HG       SER  63   2.846   3.137  -6.215
  711    H    SER  64           H        SER  64   2.447  -0.278  -2.632
  712    HA   SER  64           HA       SER  64   4.583  -0.221  -0.634
  713    HB2  SER  64           2HB      SER  64   2.843  -2.577  -0.671
  714    HB3  SER  64           1HB      SER  64   3.185  -1.460   0.654
  715    HG   SER  64           HG       SER  64   1.709   0.016  -0.469
  716    H    TYR  65           H        TYR  65   5.295  -2.772  -0.286
  717    HA   TYR  65           HA       TYR  65   6.132  -3.752  -2.930
  718    HB2  TYR  65           2HB      TYR  65   7.934  -3.665  -0.503
  719    HB3  TYR  65           1HB      TYR  65   8.365  -4.209  -2.119
  720    HD1  TYR  65           2HD      TYR  65   8.220  -2.437  -4.014
  721    HD2  TYR  65           1HD      TYR  65   8.321  -1.471   0.127
  722    HE1  TYR  65           2HE      TYR  65   8.969  -0.161  -4.568
  723    HE2  TYR  65           1HE      TYR  65   9.078   0.800  -0.415
  724    HH   TYR  65           HH       TYR  65   9.942   1.736  -3.680
  725    H    THR  66           H        THR  66   6.840  -6.004  -2.908
  726    HA   THR  66           HA       THR  66   6.070  -7.575  -0.596
  727    HB   THR  66           HB       THR  66   4.023  -7.316  -2.087
  728    HG1  THR  66           1HG      THR  66   3.912  -8.989  -0.699
  729   HG21  THR  66          3HG2      THR  66   4.716  -7.486  -4.287
  730   HG22  THR  66          1HG2      THR  66   4.110  -9.113  -3.983
  731   HG23  THR  66          2HG2      THR  66   5.846  -8.797  -3.941
  732    H    LYS  67           H        LYS  67   6.465  -9.981  -1.175
  733    HA   LYS  67           HA       LYS  67   8.507 -10.491  -3.129
  734    HB2  LYS  67           2HB      LYS  67   9.490  -9.502  -0.818
  735    HB3  LYS  67           1HB      LYS  67   9.398 -11.203  -0.389
  736    HG2  LYS  67           2HG      LYS  67  10.764 -11.752  -2.364
  737    HG3  LYS  67           1HG      LYS  67  10.898 -10.031  -2.723
  738    HD2  LYS  67           2HD      LYS  67  12.041  -9.646  -0.625
  739    HD3  LYS  67           1HD      LYS  67  11.819 -11.332  -0.160
  740    HE2  LYS  67           2HE      LYS  67  13.972 -11.390  -0.945
  741    HE3  LYS  67           1HE      LYS  67  13.080 -11.791  -2.412
  742    HZ1  LYS  67           3HZ      LYS  67  13.288  -9.559  -3.173
  743    HZ2  LYS  67           1HZ      LYS  67  14.832 -10.087  -2.724
  744    HZ3  LYS  67           2HZ      LYS  67  13.968  -9.041  -1.710
  745    H    SER  68           H        SER  68   7.585 -11.860   0.016
  746    HA   SER  68           HA       SER  68   7.166 -14.451  -1.220
  747    HB2  SER  68           2HB      SER  68   6.623 -14.149   1.656
  748    HB3  SER  68           1HB      SER  68   7.671 -15.296   0.818
  749    HG   SER  68           HG       SER  68   9.309 -14.045   1.201
  750    H    GLY  69           H        GLY  69   5.277 -12.469  -1.967
  751    HA2  GLY  69           1HA      GLY  69   3.011 -12.300  -2.293
  752    HA3  GLY  69           2HA      GLY  69   2.880 -13.899  -1.577
  753    H    MET  70           H        MET  70   4.232 -11.158   0.122
  754    HA   MET  70           HA       MET  70   1.926 -11.264   1.953
  755    HB2  MET  70           2HB      MET  70   4.528 -11.928   2.527
  756    HB3  MET  70           1HB      MET  70   4.455 -10.248   3.051
  757    HG2  MET  70           2HG      MET  70   3.086 -10.704   4.778
  758    HG3  MET  70           1HG      MET  70   2.217 -11.962   3.899
  759    HE1  MET  70           3HE      MET  70   6.225 -12.229   5.984
  760    HE2  MET  70           1HE      MET  70   6.382 -12.605   4.267
  761    HE3  MET  70           2HE      MET  70   5.701 -11.058   4.775
  762    H    ILE  71           H        ILE  71   0.938  -9.384   2.464
  763    HA   ILE  71           HA       ILE  71   1.741  -6.961   1.126
  764    HB   ILE  71           HB       ILE  71  -0.200  -6.333   3.091
  765   HG12  ILE  71          2HG1      ILE  71  -1.775  -8.227   1.762
  766   HG13  ILE  71          1HG1      ILE  71  -0.341  -9.105   2.286
  767   HG21  ILE  71          1HG2      ILE  71  -1.508  -5.700   1.263
  768   HG22  ILE  71          2HG2      ILE  71   0.153  -5.510   0.702
  769   HG23  ILE  71          3HG2      ILE  71  -0.788  -6.919   0.211
  770   HD11  ILE  71          3HD1      ILE  71  -2.104  -7.449   4.065
  771   HD12  ILE  71          1HD1      ILE  71  -2.145  -9.206   3.924
  772   HD13  ILE  71          2HD1      ILE  71  -0.711  -8.405   4.568
  773    H    LEU  72           H        LEU  72   3.414  -5.852   1.866
  774    HA   LEU  72           HA       LEU  72   3.596  -5.323   4.752
  775    HB2  LEU  72           2HB      LEU  72   5.507  -6.641   3.002
  776    HB3  LEU  72           1HB      LEU  72   6.201  -5.224   3.764
  777    HG   LEU  72           HG       LEU  72   5.298  -6.248   5.967
  778   HD11  LEU  72          1HD1      LEU  72   4.878  -8.522   6.057
  779   HD12  LEU  72          2HD1      LEU  72   4.027  -8.020   4.597
  780   HD13  LEU  72          3HD1      LEU  72   5.593  -8.823   4.474
  781   HD21  LEU  72          3HD2      LEU  72   7.364  -7.386   6.310
  782   HD22  LEU  72          1HD2      LEU  72   7.575  -7.654   4.580
  783   HD23  LEU  72          2HD2      LEU  72   7.688  -6.021   5.241
  784    H    CYS  73           H        CYS  73   4.440  -3.252   5.302
  785    HA   CYS  73           HA       CYS  73   4.039  -1.242   3.318
  786    HB2  CYS  73           2HB      CYS  73   4.604   0.360   5.032
  787    HB3  CYS  73           1HB      CYS  73   3.575  -0.877   5.740
  788    H    ARG  74           H        ARG  74   5.717   0.439   2.891
  789    HA   ARG  74           HA       ARG  74   7.885  -0.699   1.539
  790    HB2  ARG  74           2HB      ARG  74   8.409   2.058   2.255
  791    HB3  ARG  74           1HB      ARG  74   8.108   1.355   0.675
  792    HG2  ARG  74           2HG      ARG  74   5.883   1.852   0.719
  793    HG3  ARG  74           1HG      ARG  74   5.790   1.792   2.480
  794    HD2  ARG  74           2HD      ARG  74   6.961   3.980   0.770
  795    HD3  ARG  74           1HD      ARG  74   5.539   4.069   1.812
  796    HE   ARG  74           HE       ARG  74   7.005   3.937   3.725
  797   HH11  ARG  74          2HH1      ARG  74   8.564   4.502   0.648
  798   HH12  ARG  74          1HH1      ARG  74   9.999   5.191   1.340
  799   HH21  ARG  74          2HH2      ARG  74   8.880   4.873   4.664
  800   HH22  ARG  74          1HH2      ARG  74  10.195   5.376   3.635
  801    H    ASN  75           H        ASN  75   7.620   0.697   4.738
  802    HA   ASN  75           HA       ASN  75  10.421   0.797   5.253
  803    HB2  ASN  75           2HB      ASN  75   8.457   2.089   6.387
  804    HB3  ASN  75           1HB      ASN  75   8.338   0.663   7.411
  805   HD21  ASN  75          1HD2      ASN  75   8.837   2.148   9.132
  806   HD22  ASN  75          2HD2      ASN  75  10.489   2.558   9.450
  807    H    ASP  76           H        ASP  76   7.831  -1.479   6.041
  808    HA   ASP  76           HA       ASP  76   9.457  -3.054   7.788
  809    HB2  ASP  76           2HB      ASP  76   6.688  -3.041   6.907
  810    HB3  ASP  76           1HB      ASP  76   7.340  -4.674   7.013
  811    H    TYR  77           H        TYR  77   8.513  -3.279   4.402
  812    HA   TYR  77           HA       TYR  77   9.271  -5.925   3.939
  813    HB2  TYR  77           2HB      TYR  77   8.042  -4.846   2.217
  814    HB3  TYR  77           1HB      TYR  77   9.217  -3.537   2.097
  815    HD1  TYR  77           1HD      TYR  77   9.319  -7.274   1.948
  816    HD2  TYR  77           2HD      TYR  77  10.481  -3.592   0.164
  817    HE1  TYR  77           1HE      TYR  77  10.530  -8.506   0.201
  818    HE2  TYR  77           2HE      TYR  77  11.696  -4.816  -1.587
  819    HH   TYR  77           HH       TYR  77  12.837  -7.331  -1.600
  820    H    ILE  78           H        ILE  78  11.191  -2.955   3.689
  821    HA   ILE  78           HA       ILE  78  13.538  -4.291   2.787
  822    HB   ILE  78           HB       ILE  78  13.435  -1.595   4.145
  823   HG12  ILE  78          2HG1      ILE  78  13.140  -2.173   1.190
  824   HG13  ILE  78          1HG1      ILE  78  11.784  -1.827   2.258
  825   HG21  ILE  78          1HG2      ILE  78  15.637  -2.875   3.605
  826   HG22  ILE  78          2HG2      ILE  78  15.298  -2.386   1.945
  827   HG23  ILE  78          3HG2      ILE  78  15.501  -1.164   3.201
  828   HD11  ILE  78          3HD1      ILE  78  12.677   0.377   2.716
  829   HD12  ILE  78          1HD1      ILE  78  14.085   0.033   1.712
  830   HD13  ILE  78          2HD1      ILE  78  12.483   0.135   0.981
  831    H    ARG  79           H        ARG  79  12.207  -3.556   5.915
  832    HA   ARG  79           HA       ARG  79  14.593  -4.080   7.405
  833    HB2  ARG  79           2HB      ARG  79  11.703  -3.679   8.068
  834    HB3  ARG  79           1HB      ARG  79  12.766  -4.376   9.284
  835    HG2  ARG  79           2HG      ARG  79  13.955  -2.439   9.554
  836    HG3  ARG  79           1HG      ARG  79  13.601  -1.864   7.921
  837    HD2  ARG  79           2HD      ARG  79  11.565  -1.012   8.520
  838    HD3  ARG  79           1HD      ARG  79  11.336  -2.180   9.820
  839    HE   ARG  79           HE       ARG  79  12.918   0.297   9.952
  840   HH11  ARG  79          2HH1      ARG  79  11.496  -2.491  11.541
  841   HH12  ARG  79          1HH1      ARG  79  11.770  -1.874  13.141
  842   HH21  ARG  79          2HH2      ARG  79  13.255   1.120  12.066
  843   HH22  ARG  79          1HH2      ARG  79  12.739   0.187  13.443
  844    H    LEU  80           H        LEU  80  11.911  -5.973   6.220
  845    HA   LEU  80           HA       LEU  80  12.625  -8.278   7.838
  846    HB2  LEU  80           2HB      LEU  80  10.250  -7.335   6.868
  847    HB3  LEU  80           1HB      LEU  80  10.607  -8.621   5.730
  848    HG   LEU  80           HG       LEU  80  10.717  -9.124   8.691
  849   HD11  LEU  80          1HD1      LEU  80   8.322  -8.773   6.967
  850   HD12  LEU  80          2HD1      LEU  80   8.313 -10.070   8.164
  851   HD13  LEU  80          3HD1      LEU  80   8.553  -8.398   8.676
  852   HD21  LEU  80          3HD2      LEU  80   9.932 -11.402   7.758
  853   HD22  LEU  80          1HD2      LEU  80  10.462 -10.770   6.202
  854   HD23  LEU  80          2HD2      LEU  80  11.614 -10.928   7.527
  855    H    PHE  81           H        PHE  81  12.426  -7.451   4.382
  856    HA   PHE  81           HA       PHE  81  14.013  -9.874   3.822
  857    HB2  PHE  81           2HB      PHE  81  12.080  -8.452   1.975
  858    HB3  PHE  81           1HB      PHE  81  12.985  -9.910   1.598
  859    HD1  PHE  81           1HD      PHE  81  12.401 -12.041   2.674
  860    HD2  PHE  81           2HD      PHE  81  10.093  -8.519   3.283
  861    HE1  PHE  81           1HE      PHE  81  10.536 -13.408   3.527
  862    HE2  PHE  81           2HE      PHE  81   8.232  -9.880   4.138
  863    HZ   PHE  81           HZ       PHE  81   8.454 -12.325   4.263
  864    H    GLY  82           H        GLY  82  13.334  -7.427   1.457
  865    HA2  GLY  82           1HA      GLY  82  14.874  -5.608   0.932
  866    HA3  GLY  82           2HA      GLY  82  16.177  -6.651   1.492
  Start of MODEL    3
    1    H    SER 641           1H       SER 641  -3.352   1.939 -25.160
    2    HA   SER 641           HA       SER 641  -1.279   2.611 -25.197
    3    HB2  SER 641           2HB      SER 641  -0.532   2.368 -22.411
    4    HB3  SER 641           1HB      SER 641  -0.820   3.826 -23.363
    5    HG   SER 641           HG       SER 641  -2.397   3.898 -21.876
    6    H    LEU 642           H        LEU 642  -0.877   0.520 -26.268
    7    HA   LEU 642           HA       LEU 642   0.152  -1.697 -24.824
    8    HB2  LEU 642           2HB      LEU 642   0.658  -2.652 -26.987
    9    HB3  LEU 642           1HB      LEU 642  -0.946  -1.947 -26.988
   10    HG   LEU 642           HG       LEU 642   0.822   0.053 -27.929
   11   HD11  LEU 642          1HD1      LEU 642   1.131  -2.147 -29.838
   12   HD12  LEU 642          2HD1      LEU 642   2.268  -0.886 -29.359
   13   HD13  LEU 642          3HD1      LEU 642   2.073  -2.322 -28.355
   14   HD21  LEU 642          3HD2      LEU 642  -1.635  -0.572 -28.465
   15   HD22  LEU 642          1HD2      LEU 642  -0.624   0.123 -29.735
   16   HD23  LEU 642          2HD2      LEU 642  -0.925  -1.615 -29.696
   17    H    GLN 643           H        GLN 643   2.266  -2.556 -24.846
   18    HA   GLN 643           HA       GLN 643   4.368  -0.552 -25.358
   19    HB2  GLN 643           2HB      GLN 643   3.853  -1.448 -22.926
   20    HB3  GLN 643           1HB      GLN 643   4.793  -2.831 -23.469
   21    HG2  GLN 643           2HG      GLN 643   6.598  -1.172 -24.108
   22    HG3  GLN 643           1HG      GLN 643   5.678   0.023 -23.194
   23   HE21  GLN 643          1HE2      GLN 643   5.060  -0.751 -20.944
   24   HE22  GLN 643          2HE2      GLN 643   6.305  -1.549 -20.044
   25    H    ASN 644           H        ASN 644   5.276  -1.066 -27.240
   26    HA   ASN 644           HA       ASN 644   5.438  -3.786 -28.166
   27    HB2  ASN 644           2HB      ASN 644   5.098  -2.002 -29.785
   28    HB3  ASN 644           1HB      ASN 644   6.599  -1.224 -29.289
   29   HD21  ASN 644          1HD2      ASN 644   8.154  -1.503 -30.707
   30   HD22  ASN 644          2HD2      ASN 644   8.426  -2.923 -31.661
   31    H    ASN 645           H        ASN 645   6.807  -5.094 -27.171
   32    HA   ASN 645           HA       ASN 645   9.581  -4.162 -26.813
   33    HB2  ASN 645           2HB      ASN 645   7.834  -4.989 -24.792
   34    HB3  ASN 645           1HB      ASN 645   8.870  -6.384 -25.083
   35   HD21  ASN 645          1HD2      ASN 645  10.216  -6.367 -23.406
   36   HD22  ASN 645          2HD2      ASN 645  11.228  -5.030 -22.958
   37    H    GLN 646           H        GLN 646  10.909  -5.190 -28.133
   38    HA   GLN 646           HA       GLN 646  10.107  -7.851 -29.110
   39    HB2  GLN 646           2HB      GLN 646  10.909  -5.521 -30.473
   40    HB3  GLN 646           1HB      GLN 646  12.247  -6.654 -30.624
   41    HG2  GLN 646           2HG      GLN 646   9.669  -7.903 -31.088
   42    HG3  GLN 646           1HG      GLN 646   9.999  -6.574 -32.200
   43   HE21  GLN 646          1HE2      GLN 646   9.779  -9.074 -33.186
   44   HE22  GLN 646          2HE2      GLN 646  11.334  -9.663 -33.693
   45    H    ASP 647           H        ASP 647  12.948  -7.971 -30.243
   46    HA   ASP 647           HA       ASP 647  14.063  -9.437 -28.027
   47    HB2  ASP 647           2HB      ASP 647  14.183  -9.829 -30.673
   48    HB3  ASP 647           1HB      ASP 647  15.678  -8.920 -30.466
   49    H    VAL 648           H        VAL 648  14.175  -7.504 -26.663
   50    HA   VAL 648           HA       VAL 648  16.052  -5.433 -27.280
   51    HB   VAL 648           HB       VAL 648  15.732  -5.162 -24.612
   52   HG11  VAL 648          1HG1      VAL 648  14.114  -4.254 -26.946
   53   HG12  VAL 648          2HG1      VAL 648  13.588  -3.832 -25.315
   54   HG13  VAL 648          3HG1      VAL 648  15.180  -3.334 -25.884
   55   HG21  VAL 648          3HG2      VAL 648  14.045  -6.304 -23.721
   56   HG22  VAL 648          1HG2      VAL 648  12.972  -5.890 -25.058
   57   HG23  VAL 648          2HG2      VAL 648  14.038  -7.292 -25.182
   58    H    SER 649           H        SER 649  18.120  -6.110 -27.520
   59    HA   SER 649           HA       SER 649  19.404  -7.987 -25.821
   60    HB2  SER 649           2HB      SER 649  21.250  -6.129 -27.034
   61    HB3  SER 649           1HB      SER 649  20.992  -7.834 -27.403
   62    HG   SER 649           HG       SER 649  19.724  -7.318 -29.021
   63    H    PHE 650           H        PHE 650  19.776  -7.639 -23.723
   64    HA   PHE 650           HA       PHE 650  20.387  -4.880 -22.860
   65    HB2  PHE 650           2HB      PHE 650  18.395  -6.809 -21.902
   66    HB3  PHE 650           1HB      PHE 650  19.374  -6.109 -20.618
   67    HD1  PHE 650           1HD      PHE 650  17.915  -4.731 -23.771
   68    HD2  PHE 650           2HD      PHE 650  18.222  -4.460 -19.534
   69    HE1  PHE 650           1HE      PHE 650  16.519  -2.706 -23.802
   70    HE2  PHE 650           2HE      PHE 650  16.828  -2.434 -19.560
   71    HZ   PHE 650           HZ       PHE 650  15.974  -1.555 -21.693
   72    H    GLU 651           H        GLU 651  21.515  -8.016 -23.087
   73    HA   GLU 651           HA       GLU 651  22.901  -8.374 -20.676
   74    HB2  GLU 651           2HB      GLU 651  24.452  -9.790 -22.296
   75    HB3  GLU 651           1HB      GLU 651  22.837 -10.328 -21.857
   76    HG2  GLU 651           2HG      GLU 651  23.086  -8.630 -24.268
   77    HG3  GLU 651           1HG      GLU 651  23.711 -10.276 -24.369
   78    H    ASN 652           H        ASN 652  23.644  -6.424 -23.445
   79    HA   ASN 652           HA       ASN 652  26.412  -6.059 -22.682
   80    HB2  ASN 652           2HB      ASN 652  25.583  -6.013 -25.074
   81    HB3  ASN 652           1HB      ASN 652  24.848  -4.456 -24.705
   82   HD21  ASN 652          1HD2      ASN 652  26.022  -2.717 -25.063
   83   HD22  ASN 652          2HD2      ASN 652  27.742  -2.688 -25.255
   84    H    ILE 653           H        ILE 653  23.412  -4.696 -21.845
   85    HA   ILE 653           HA       ILE 653  24.670  -2.183 -20.983
   86    HB   ILE 653           HB       ILE 653  21.740  -2.463 -20.720
   87   HG12  ILE 653          2HG1      ILE 653  22.951  -2.006 -23.451
   88   HG13  ILE 653          1HG1      ILE 653  22.311  -3.564 -22.936
   89   HG21  ILE 653          1HG2      ILE 653  23.748  -0.404 -20.975
   90   HG22  ILE 653          2HG2      ILE 653  22.418  -0.148 -22.105
   91   HG23  ILE 653          3HG2      ILE 653  22.092  -0.294 -20.379
   92   HD11  ILE 653          3HD1      ILE 653  20.713  -2.305 -24.288
   93   HD12  ILE 653          1HD1      ILE 653  20.111  -2.583 -22.654
   94   HD13  ILE 653          2HD1      ILE 653  20.744  -0.999 -23.104
   95    H    GLN 654           H        GLN 654  25.502  -4.058 -19.406
   96    HA   GLN 654           HA       GLN 654  23.731  -4.432 -17.146
   97    HB2  GLN 654           2HB      GLN 654  26.603  -5.219 -17.650
   98    HB3  GLN 654           1HB      GLN 654  25.778  -5.524 -16.128
   99    HG2  GLN 654           2HG      GLN 654  24.674  -6.502 -18.734
  100    HG3  GLN 654           1HG      GLN 654  25.893  -7.411 -17.844
  101   HE21  GLN 654          1HE2      GLN 654  24.050  -8.983 -17.954
  102   HE22  GLN 654          2HE2      GLN 654  22.912  -8.955 -16.646
  103    H    TRP 655           H        TRP 655  23.352  -2.287 -16.560
  104    HA   TRP 655           HA       TRP 655  25.407  -0.404 -16.063
  105    HB2  TRP 655           2HB      TRP 655  23.149   0.301 -14.513
  106    HB3  TRP 655           1HB      TRP 655  23.638   0.960 -16.067
  107    HD1  TRP 655           HD       TRP 655  21.973   0.649 -17.987
  108    HE1  TRP 655           1HE      TRP 655  19.851  -0.756 -18.377
  109    HE3  TRP 655           3HE      TRP 655  22.103  -2.214 -13.747
  110    HZ2  TRP 655           2HZ      TRP 655  18.433  -2.809 -17.065
  111    HZ3  TRP 655           3HZ      TRP 655  20.324  -3.874 -13.392
  112    HH2  TRP 655           HH       TRP 655  18.526  -4.162 -15.019
  113    H    SER 656           H        SER 656  26.779  -0.325 -14.418
  114    HA   SER 656           HA       SER 656  26.418  -1.935 -12.070
  115    HB2  SER 656           2HB      SER 656  28.540  -0.155 -11.632
  116    HB3  SER 656           1HB      SER 656  28.661  -1.820 -12.204
  117    HG   SER 656           HG       SER 656  29.345   0.351 -13.500
  118    H    ILE 657           H        ILE 657  24.261  -0.538 -11.930
  119    HA   ILE 657           HA       ILE 657  24.708   1.966 -10.496
  120    HB   ILE 657           HB       ILE 657  22.161   2.072 -10.534
  121   HG12  ILE 657          2HG1      ILE 657  22.199   0.194 -12.840
  122   HG13  ILE 657          1HG1      ILE 657  22.246  -0.528 -11.235
  123   HG21  ILE 657          1HG2      ILE 657  24.115   2.668 -12.487
  124   HG22  ILE 657          2HG2      ILE 657  22.666   2.128 -13.334
  125   HG23  ILE 657          3HG2      ILE 657  22.573   3.475 -12.199
  126   HD11  ILE 657          3HD1      ILE 657  19.977  -0.065 -12.449
  127   HD12  ILE 657          1HD1      ILE 657  20.136   0.176 -10.708
  128   HD13  ILE 657          2HD1      ILE 657  20.208   1.559 -11.801
  129    H    ASP 658           H        ASP 658  22.261   1.832  -8.986
  130    HA   ASP 658           HA       ASP 658  23.254   0.210  -6.769
  131    HB2  ASP 658           2HB      ASP 658  22.661   2.714  -6.583
  132    HB3  ASP 658           1HB      ASP 658  20.983   2.183  -6.623
  133    HA   PRO 659           HA       PRO 659  20.013  -2.696  -7.895
  134    HB2  PRO 659           2HB      PRO 659  21.135  -4.361  -5.775
  135    HB3  PRO 659           1HB      PRO 659  21.089  -4.653  -7.515
  136    HG2  PRO 659           2HG      PRO 659  23.389  -4.113  -6.199
  137    HG3  PRO 659           1HG      PRO 659  23.110  -3.615  -7.877
  138    HD2  PRO 659           2HD      PRO 659  22.898  -1.995  -5.362
  139    HD3  PRO 659           1HD      PRO 659  23.625  -1.557  -6.926
  140    H    GLY 660           H        GLY 660  20.484  -0.998  -5.016
  141    HA2  GLY 660           1HA      GLY 660  18.047  -2.174  -3.831
  142    HA3  GLY 660           2HA      GLY 660  19.305  -1.355  -2.915
  143    H    ALA 661           H        ALA 661  19.003   0.381  -5.662
  144    HA   ALA 661           HA       ALA 661  17.590   2.496  -4.329
  145    HB1  ALA 661           1HB      ALA 661  17.878   3.322  -6.931
  146    HB2  ALA 661           2HB      ALA 661  19.048   3.581  -5.635
  147    HB3  ALA 661           3HB      ALA 661  19.228   2.207  -6.725
  148    H    ASP 662           H        ASP 662  16.912   0.255  -6.959
  149    HA   ASP 662           HA       ASP 662  14.296   1.474  -7.365
  150    HB2  ASP 662           2HB      ASP 662  15.707   0.790  -9.331
  151    HB3  ASP 662           1HB      ASP 662  15.486  -0.883  -8.832
  152    H    LEU 663           H        LEU 663  12.673   0.835  -6.159
  153    HA   LEU 663           HA       LEU 663  12.484  -2.020  -5.441
  154    HB2  LEU 663           2HB      LEU 663  12.205   0.365  -3.863
  155    HB3  LEU 663           1HB      LEU 663  10.673  -0.488  -3.888
  156    HG   LEU 663           HG       LEU 663  12.104  -2.569  -3.248
  157   HD11  LEU 663          1HD1      LEU 663  14.025  -0.354  -3.016
  158   HD12  LEU 663          2HD1      LEU 663  13.949  -1.438  -1.628
  159   HD13  LEU 663          3HD1      LEU 663  14.301  -2.081  -3.233
  160   HD21  LEU 663          3HD2      LEU 663  10.577  -1.951  -1.660
  161   HD22  LEU 663          1HD2      LEU 663  12.082  -1.634  -0.796
  162   HD23  LEU 663          2HD2      LEU 663  11.197  -0.305  -1.543
  163    H    SER 664           H        SER 664  11.636  -0.365  -7.843
  164    HA   SER 664           HA       SER 664   8.799  -0.114  -7.726
  165    HB2  SER 664           2HB      SER 664  10.251  -0.176 -10.329
  166    HB3  SER 664           1HB      SER 664   8.979   0.914  -9.774
  167    HG   SER 664           HG       SER 664  11.672   1.206  -9.653
  168    H    GLN 665           H        GLN 665  10.947  -2.699  -8.555
  169    HA   GLN 665           HA       GLN 665   8.982  -4.127 -10.131
  170    HB2  GLN 665           2HB      GLN 665  11.755  -4.699  -9.167
  171    HB3  GLN 665           1HB      GLN 665  10.742  -6.039  -9.686
  172    HG2  GLN 665           2HG      GLN 665  11.907  -3.808 -11.269
  173    HG3  GLN 665           1HG      GLN 665  11.848  -5.534 -11.623
  174   HE21  GLN 665          1HE2      GLN 665  10.599  -2.564 -12.394
  175   HE22  GLN 665          2HE2      GLN 665   9.169  -3.087 -13.222
  176    H    TYR 666           H        TYR 666   9.760  -3.737  -6.838
  177    HA   TYR 666           HA       TYR 666   8.423  -6.185  -6.000
  178    HB2  TYR 666           2HB      TYR 666   9.622  -3.927  -4.379
  179    HB3  TYR 666           1HB      TYR 666   8.961  -5.416  -3.710
  180    HD1  TYR 666           1HD      TYR 666  10.006  -7.590  -5.016
  181    HD2  TYR 666           2HD      TYR 666  11.912  -3.832  -4.429
  182    HE1  TYR 666           1HE      TYR 666  12.199  -8.677  -5.226
  183    HE2  TYR 666           2HE      TYR 666  14.111  -4.909  -4.643
  184    HH   TYR 666           HH       TYR 666  15.216  -6.789  -4.973
  185    H    LYS 667           H        LYS 667   7.527  -3.203  -7.009
  186    HA   LYS 667           HA       LYS 667   5.459  -2.661  -5.077
  187    HB2  LYS 667           2HB      LYS 667   6.853  -0.979  -6.485
  188    HB3  LYS 667           1HB      LYS 667   5.693  -1.333  -7.752
  189    HG2  LYS 667           2HG      LYS 667   4.233  -0.782  -5.395
  190    HG3  LYS 667           1HG      LYS 667   5.460   0.472  -5.578
  191    HD2  LYS 667           2HD      LYS 667   4.008  -0.267  -8.037
  192    HD3  LYS 667           1HD      LYS 667   3.051   0.546  -6.796
  193    HE2  LYS 667           2HE      LYS 667   5.242   2.100  -6.784
  194    HE3  LYS 667           1HE      LYS 667   5.269   1.560  -8.462
  195    HZ1  LYS 667           3HZ      LYS 667   2.756   2.578  -7.327
  196    HZ2  LYS 667           1HZ      LYS 667   3.305   2.611  -8.932
  197    HZ3  LYS 667           2HZ      LYS 667   3.955   3.682  -7.786
  198    H    MET 668           H        MET 668   3.237  -2.594  -5.554
  199    HA   MET 668           HA       MET 668   2.395  -4.264  -7.830
  200    HB2  MET 668           2HB      MET 668   0.819  -5.323  -6.533
  201    HB3  MET 668           1HB      MET 668   2.037  -5.004  -5.306
  202    HG2  MET 668           2HG      MET 668  -0.028  -2.926  -5.707
  203    HG3  MET 668           1HG      MET 668  -0.550  -4.447  -4.983
  204    HE1  MET 668           3HE      MET 668   1.156  -4.869  -1.822
  205    HE2  MET 668           1HE      MET 668   1.036  -5.625  -3.408
  206    HE3  MET 668           2HE      MET 668   2.549  -4.878  -2.902
  207    H    ASP 669           H        ASP 669   0.567  -3.549  -9.017
  208    HA   ASP 669           HA       ASP 669   0.233  -0.696  -8.998
  209    HB2  ASP 669           2HB      ASP 669   0.207  -1.937 -11.132
  210    HB3  ASP 669           1HB      ASP 669  -1.263  -2.767 -10.622
  211    H    VAL 670           H        VAL 670  -0.962   0.254  -7.544
  212    HA   VAL 670           HA       VAL 670  -3.234  -1.101  -6.350
  213    HB   VAL 670           HB       VAL 670  -2.433   1.749  -5.786
  214   HG11  VAL 670          1HG1      VAL 670  -3.184   0.531  -3.447
  215   HG12  VAL 670          2HG1      VAL 670  -4.227   1.516  -4.471
  216   HG13  VAL 670          3HG1      VAL 670  -4.234  -0.238  -4.638
  217   HG21  VAL 670          3HG2      VAL 670  -0.840   1.064  -4.184
  218   HG22  VAL 670          1HG2      VAL 670  -1.313  -0.628  -4.322
  219   HG23  VAL 670          2HG2      VAL 670  -0.458   0.159  -5.648
  220    H    THR 671           H        THR 671  -4.819  -1.207  -7.887
  221    HA   THR 671           HA       THR 671  -5.612   1.191  -9.311
  222    HB   THR 671           HB       THR 671  -7.208  -1.346  -9.350
  223    HG1  THR 671           1HG      THR 671  -4.656  -0.928 -10.551
  224   HG21  THR 671          3HG2      THR 671  -7.959  -0.612 -11.372
  225   HG22  THR 671          1HG2      THR 671  -6.435   0.179 -11.778
  226   HG23  THR 671          2HG2      THR 671  -7.559   0.950 -10.657
  227    H    VAL 672           H        VAL 672  -6.612   2.641  -8.027
  228    HA   VAL 672           HA       VAL 672  -8.500   1.753  -5.997
  229    HB   VAL 672           HB       VAL 672  -7.924   4.632  -6.655
  230   HG11  VAL 672          1HG1      VAL 672  -9.235   3.134  -4.519
  231   HG12  VAL 672          2HG1      VAL 672  -8.093   4.348  -3.939
  232   HG13  VAL 672          3HG1      VAL 672  -9.418   4.822  -5.003
  233   HG21  VAL 672          3HG2      VAL 672  -5.945   4.677  -5.454
  234   HG22  VAL 672          1HG2      VAL 672  -6.289   3.157  -4.629
  235   HG23  VAL 672          2HG2      VAL 672  -5.807   3.148  -6.325
  236    H    ILE 673           H        ILE 673 -10.553   1.460  -6.491
  237    HA   ILE 673           HA       ILE 673 -11.589   2.635  -8.960
  238    HB   ILE 673           HB       ILE 673 -12.696   0.409  -7.242
  239   HG12  ILE 673          2HG1      ILE 673 -12.176  -0.580  -9.773
  240   HG13  ILE 673          1HG1      ILE 673 -10.822   0.510  -9.486
  241   HG21  ILE 673          1HG2      ILE 673 -14.573   0.341  -8.481
  242   HG22  ILE 673          2HG2      ILE 673 -14.195   2.034  -8.809
  243   HG23  ILE 673          3HG2      ILE 673 -13.733   0.786  -9.966
  244   HD11  ILE 673          3HD1      ILE 673  -9.931  -1.319  -8.545
  245   HD12  ILE 673          1HD1      ILE 673 -10.873  -0.801  -7.147
  246   HD13  ILE 673          2HD1      ILE 673 -11.501  -2.053  -8.219
  247    H    ASP 674           H        ASP 674 -12.996   4.256  -8.949
  248    HA   ASP 674           HA       ASP 674 -13.978   5.393  -6.531
  249    HB2  ASP 674           2HB      ASP 674 -13.591   6.889  -8.353
  250    HB3  ASP 674           1HB      ASP 674 -14.573   5.923  -9.446
  251    H    THR 675           H        THR 675 -15.314   4.124  -5.378
  252    HA   THR 675           HA       THR 675 -17.309   2.481  -6.606
  253    HB   THR 675           HB       THR 675 -17.653   2.942  -3.755
  254    HG1  THR 675           1HG      THR 675 -15.647   2.351  -3.089
  255   HG21  THR 675          3HG2      THR 675 -16.866   0.498  -5.353
  256   HG22  THR 675          1HG2      THR 675 -18.518   0.997  -4.990
  257   HG23  THR 675          2HG2      THR 675 -17.437   0.512  -3.683
  258    H    LYS 676           H        LYS 676 -18.213   4.483  -7.711
  259    HA   LYS 676           HA       LYS 676 -20.034   6.091  -6.161
  260    HB2  LYS 676           2HB      LYS 676 -20.890   6.643  -8.558
  261    HB3  LYS 676           1HB      LYS 676 -19.298   7.207  -8.069
  262    HG2  LYS 676           2HG      LYS 676 -18.198   5.708  -9.425
  263    HG3  LYS 676           1HG      LYS 676 -19.554   4.582  -9.465
  264    HD2  LYS 676           2HD      LYS 676 -19.434   7.268 -10.834
  265    HD3  LYS 676           1HD      LYS 676 -19.273   5.693 -11.616
  266    HE2  LYS 676           2HE      LYS 676 -21.590   5.235 -10.493
  267    HE3  LYS 676           1HE      LYS 676 -21.687   6.995 -10.432
  268    HZ1  LYS 676           3HZ      LYS 676 -20.871   6.463 -12.978
  269    HZ2  LYS 676           1HZ      LYS 676 -22.450   6.854 -12.496
  270    HZ3  LYS 676           2HZ      LYS 676 -21.993   5.230 -12.661
  271    H    ASP 677           H        ASP 677 -20.023   2.969  -7.380
  272    HA   ASP 677           HA       ASP 677 -22.821   2.698  -7.907
  273    HB2  ASP 677           2HB      ASP 677 -20.773   1.215  -8.694
  274    HB3  ASP 677           1HB      ASP 677 -21.126   0.343  -7.203
  275    H    GLY 678           H        GLY 678 -24.113   3.135  -6.288
  276    HA2  GLY 678           1HA      GLY 678 -25.088   1.921  -4.291
  277    HA3  GLY 678           2HA      GLY 678 -23.471   2.085  -3.613
  278    H    SER 679           H        SER 679 -23.033   4.706  -4.759
  279    HA   SER 679           HA       SER 679 -24.391   6.316  -2.805
  280    HB2  SER 679           2HB      SER 679 -22.939   7.819  -4.816
  281    HB3  SER 679           1HB      SER 679 -22.604   7.653  -3.091
  282    HG   SER 679           HG       SER 679 -20.910   6.618  -3.854
  283    H    GLN 680           H        GLN 680 -24.825   5.464  -6.108
  284    HA   GLN 680           HA       GLN 680 -26.501   7.656  -6.840
  285    HB2  GLN 680           2HB      GLN 680 -27.288   5.525  -8.431
  286    HB3  GLN 680           1HB      GLN 680 -26.081   6.735  -8.837
  287    HG2  GLN 680           2HG      GLN 680 -24.526   5.060  -7.474
  288    HG3  GLN 680           1HG      GLN 680 -25.751   3.915  -8.021
  289   HE21  GLN 680          1HE2      GLN 680 -24.160   2.886  -9.327
  290   HE22  GLN 680          2HE2      GLN 680 -23.656   3.597 -10.826
  291    H    SER 681           H        SER 681 -28.249   8.047  -5.654
  292    HA   SER 681           HA       SER 681 -29.663   6.103  -4.178
  293    HB2  SER 681           2HB      SER 681 -31.268   8.431  -4.631
  294    HB3  SER 681           1HB      SER 681 -30.391   7.959  -3.173
  295    HG   SER 681           HG       SER 681 -28.803   9.276  -3.672
  296    H    LYS 682           H        LYS 682 -29.884   7.054  -7.454
  297    HA   LYS 682           HA       LYS 682 -32.615   6.205  -7.822
  298    HB2  LYS 682           2HB      LYS 682 -31.219   7.932  -9.214
  299    HB3  LYS 682           1HB      LYS 682 -30.657   6.503 -10.068
  300    HG2  LYS 682           2HG      LYS 682 -32.625   6.178 -11.105
  301    HG3  LYS 682           1HG      LYS 682 -33.571   6.718  -9.715
  302    HD2  LYS 682           2HD      LYS 682 -32.469   9.049 -10.377
  303    HD3  LYS 682           1HD      LYS 682 -32.429   8.281 -11.966
  304    HE2  LYS 682           2HE      LYS 682 -34.476   9.443 -11.860
  305    HE3  LYS 682           1HE      LYS 682 -34.877   7.745 -11.619
  306    HZ1  LYS 682           3HZ      LYS 682 -35.384   8.077  -9.431
  307    HZ2  LYS 682           1HZ      LYS 682 -35.858   9.575 -10.069
  308    HZ3  LYS 682           2HZ      LYS 682 -34.370   9.426  -9.268
  309    H    LEU 683           H        LEU 683 -29.507   4.756  -7.771
  310    HA   LEU 683           HA       LEU 683 -30.274   2.445  -9.337
  311    HB2  LEU 683           2HB      LEU 683 -27.984   3.234  -9.458
  312    HB3  LEU 683           1HB      LEU 683 -27.804   3.075  -7.723
  313    HG   LEU 683           HG       LEU 683 -28.560   0.530  -8.728
  314   HD11  LEU 683          1HD1      LEU 683 -27.375   0.144 -10.585
  315   HD12  LEU 683          2HD1      LEU 683 -27.385   1.897 -10.779
  316   HD13  LEU 683          3HD1      LEU 683 -26.006   1.103 -10.023
  317   HD21  LEU 683          3HD2      LEU 683 -25.746   0.912  -8.068
  318   HD22  LEU 683          1HD2      LEU 683 -26.846   1.605  -6.875
  319   HD23  LEU 683          2HD2      LEU 683 -26.966  -0.103  -7.295
  320    H    GLY 684           H        GLY 684 -29.567   3.210  -5.947
  321    HA2  GLY 684           1HA      GLY 684 -30.500   0.529  -5.183
  322    HA3  GLY 684           2HA      GLY 684 -29.568   1.618  -4.167
  323    H    GLY 685           H        GLY 685 -32.083   3.155  -5.841
  324    HA2  GLY 685           1HA      GLY 685 -33.827   2.956  -3.466
  325    HA3  GLY 685           2HA      GLY 685 -33.477   4.497  -4.237
  326    H    GLY 901           H        GLY 901 -33.945   1.610  -6.127
  327    HA2  GLY 901           1HA      GLY 901 -36.145   2.873  -7.512
  328    HA3  GLY 901           2HA      GLY 901 -35.408   1.325  -7.905
  329    H    GLY 902           H        GLY 902 -35.796  -0.379  -6.106
  330    HA2  GLY 902           1HA      GLY 902 -38.631  -0.177  -5.279
  331    HA3  GLY 902           2HA      GLY 902 -37.957  -1.642  -5.978
  332    H    SER 903           H        SER 903 -36.135   0.331  -3.770
  333    HA   SER 903           HA       SER 903 -35.723  -1.853  -1.989
  334    HB2  SER 903           2HB      SER 903 -34.930   0.592  -0.785
  335    HB3  SER 903           1HB      SER 903 -33.906  -0.608  -1.576
  336    HG   SER 903           HG       SER 903 -33.584   1.234  -2.715
  337    H    GLY 904           H        GLY 904 -37.211   1.357  -1.523
  338    HA2  GLY 904           1HA      GLY 904 -39.458   1.380  -0.482
  339    HA3  GLY 904           2HA      GLY 904 -38.852   0.154   0.623
  340    H    GLY 905           H        GLY 905 -39.879   2.095   1.939
  341    HA2  GLY 905           1HA      GLY 905 -37.853   4.152   2.445
  342    HA3  GLY 905           2HA      GLY 905 -39.500   4.142   3.064
  343    H    HIS 906           H        HIS 906 -36.556   2.142   3.242
  344    HA   HIS 906           HA       HIS 906 -37.051   1.887   6.134
  345    HB2  HIS 906           2HB      HIS 906 -36.864  -0.210   4.117
  346    HB3  HIS 906           1HB      HIS 906 -35.701  -0.432   5.422
  347    HD1  HIS 906           1HD      HIS 906 -36.921  -0.245   7.947
  348    HD2  HIS 906           2HD      HIS 906 -39.273  -1.223   4.655
  349    HE1  HIS 906           1HE      HIS 906 -39.028  -1.307   8.864
  350    H    MET 907           H        MET 907 -35.228   1.731   7.448
  351    HA   MET 907           HA       MET 907 -32.742   2.662   6.194
  352    HB2  MET 907           2HB      MET 907 -34.036   3.696   8.326
  353    HB3  MET 907           1HB      MET 907 -32.981   2.554   9.147
  354    HG2  MET 907           2HG      MET 907 -31.152   3.778   8.770
  355    HG3  MET 907           1HG      MET 907 -31.640   4.188   7.126
  356    HE1  MET 907           3HE      MET 907 -32.566   7.619   7.196
  357    HE2  MET 907           1HE      MET 907 -30.903   7.085   7.432
  358    HE3  MET 907           2HE      MET 907 -31.987   6.158   6.397
  359    H    GLY 908           H        GLY 908 -32.744   0.267   5.472
  360    HA2  GLY 908           1HA      GLY 908 -31.375  -1.311   7.561
  361    HA3  GLY 908           2HA      GLY 908 -32.506  -2.038   6.433
  362    H    SER 909           H        SER 909 -29.296  -1.413   7.066
  363    HA   SER 909           HA       SER 909 -28.384  -1.384   4.327
  364    HB2  SER 909           2HB      SER 909 -26.462  -2.100   6.456
  365    HB3  SER 909           1HB      SER 909 -26.344  -0.869   5.198
  366    HG   SER 909           HG       SER 909 -27.757  -0.710   7.664
  367    H    GLY 910           H        GLY 910 -28.208  -3.129   3.093
  368    HA2  GLY 910           1HA      GLY 910 -27.005  -5.485   3.495
  369    HA3  GLY 910           2HA      GLY 910 -28.556  -5.758   4.278
  370    H    GLY 911           H        GLY 911 -28.376  -7.469   2.462
  371    HA2  GLY 911           1HA      GLY 911 -29.624  -8.228   0.645
  372    HA3  GLY 911           2HA      GLY 911 -30.131  -6.574   0.333
  373    H    LEU  18           H        LEU  18 -27.538  -5.431   0.206
  374    HA   LEU  18           HA       LEU  18 -26.779  -6.252  -2.464
  375    HB2  LEU  18           2HB      LEU  18 -26.237  -3.934  -0.701
  376    HB3  LEU  18           1HB      LEU  18 -25.021  -4.321  -1.899
  377    HG   LEU  18           HG       LEU  18 -27.740  -3.199  -2.251
  378   HD11  LEU  18          1HD1      LEU  18 -26.655  -1.869  -3.891
  379   HD12  LEU  18          2HD1      LEU  18 -25.582  -1.949  -2.494
  380   HD13  LEU  18          3HD1      LEU  18 -25.249  -2.935  -3.915
  381   HD21  LEU  18          3HD2      LEU  18 -27.477  -5.565  -3.411
  382   HD22  LEU  18          1HD2      LEU  18 -28.271  -4.214  -4.220
  383   HD23  LEU  18          2HD2      LEU  18 -26.596  -4.607  -4.601
  384    H    SER  19           H        SER  19 -24.771  -7.020  -3.065
  385    HA   SER  19           HA       SER  19 -23.320  -8.364  -0.925
  386    HB2  SER  19           2HB      SER  19 -22.326  -9.073  -3.501
  387    HB3  SER  19           1HB      SER  19 -23.280 -10.057  -2.389
  388    HG   SER  19           HG       SER  19 -24.129  -9.501  -4.639
  389    H    TRP  20           H        TRP  20 -22.995  -5.759  -3.127
  390    HA   TRP  20           HA       TRP  20 -21.315  -4.351  -3.713
  391    HB2  TRP  20           2HB      TRP  20 -19.955  -5.096  -1.128
  392    HB3  TRP  20           1HB      TRP  20 -19.938  -3.545  -1.963
  393    HD1  TRP  20           HD       TRP  20 -22.868  -2.787  -2.275
  394    HE1  TRP  20           1HE      TRP  20 -24.431  -2.443  -0.258
  395    HE3  TRP  20           3HE      TRP  20 -20.274  -5.446   1.236
  396    HZ2  TRP  20           2HZ      TRP  20 -24.558  -3.197   2.442
  397    HZ3  TRP  20           3HZ      TRP  20 -21.186  -5.583   3.521
  398    HH2  TRP  20           HH       TRP  20 -23.282  -4.477   4.111
  399    H    LYS  21           H        LYS  21 -18.712  -5.600  -2.014
  400    HA   LYS  21           HA       LYS  21 -17.948  -7.488  -4.099
  401    HB2  LYS  21           2HB      LYS  21 -16.957  -4.860  -4.056
  402    HB3  LYS  21           1HB      LYS  21 -15.671  -5.856  -3.388
  403    HG2  LYS  21           2HG      LYS  21 -15.159  -5.925  -5.615
  404    HG3  LYS  21           1HG      LYS  21 -16.163  -7.369  -5.464
  405    HD2  LYS  21           2HD      LYS  21 -17.969  -5.318  -5.968
  406    HD3  LYS  21           1HD      LYS  21 -16.598  -4.960  -7.022
  407    HE2  LYS  21           2HE      LYS  21 -17.447  -6.460  -8.438
  408    HE3  LYS  21           1HE      LYS  21 -16.957  -7.697  -7.282
  409    HZ1  LYS  21           3HZ      LYS  21 -19.274  -6.962  -6.228
  410    HZ2  LYS  21           1HZ      LYS  21 -19.140  -8.196  -7.383
  411    HZ3  LYS  21           2HZ      LYS  21 -19.608  -6.636  -7.857
  412    H    ARG  22           H        ARG  22 -16.835  -9.185  -3.308
  413    HA   ARG  22           HA       ARG  22 -16.542  -9.344  -0.440
  414    HB2  ARG  22           2HB      ARG  22 -17.230 -11.412  -0.972
  415    HB3  ARG  22           1HB      ARG  22 -16.821 -11.198  -2.665
  416    HG2  ARG  22           2HG      ARG  22 -15.365 -12.845  -2.260
  417    HG3  ARG  22           1HG      ARG  22 -14.362 -11.550  -1.600
  418    HD2  ARG  22           2HD      ARG  22 -15.913 -12.166   0.545
  419    HD3  ARG  22           1HD      ARG  22 -15.766 -13.742  -0.239
  420    HE   ARG  22           HE       ARG  22 -13.610 -12.140   0.911
  421   HH11  ARG  22          2HH1      ARG  22 -14.624 -15.039  -0.777
  422   HH12  ARG  22          1HH1      ARG  22 -13.102 -15.855  -0.558
  423   HH21  ARG  22          2HH2      ARG  22 -11.614 -13.189   1.188
  424   HH22  ARG  22          1HH2      ARG  22 -11.370 -14.783   0.548
  425    H    CYS  23           H        CYS  23 -14.681  -9.208   0.689
  426    HA   CYS  23           HA       CYS  23 -12.300  -8.522  -0.869
  427    HB2  CYS  23           2HB      CYS  23 -11.537  -7.346   1.122
  428    HB3  CYS  23           1HB      CYS  23 -13.123  -6.786   0.615
  429    H    ALA  24           H        ALA  24 -10.211  -9.151  -0.075
  430    HA   ALA  24           HA       ALA  24 -10.249 -11.992   0.346
  431    HB1  ALA  24           1HB      ALA  24  -8.618 -10.277  -1.042
  432    HB2  ALA  24           2HB      ALA  24  -7.617 -10.758   0.325
  433    HB3  ALA  24           3HB      ALA  24  -8.304 -11.985  -0.737
  434    H    GLY  25           H        GLY  25  -9.017  -9.202   2.185
  435    HA2  GLY  25           1HA      GLY  25  -7.488 -10.706   4.023
  436    HA3  GLY  25           2HA      GLY  25  -8.034  -9.053   4.249
  437    H    CYS  26           H        CYS  26 -10.510  -8.947   4.752
  438    HA   CYS  26           HA       CYS  26 -10.992 -10.309   7.166
  439    HB2  CYS  26           2HB      CYS  26 -13.244  -9.221   5.499
  440    HB3  CYS  26           1HB      CYS  26 -13.066  -9.224   7.249
  441    H    GLY  27           H        GLY  27 -12.083 -10.875   3.868
  442    HA2  GLY  27           1HA      GLY  27 -12.691 -12.952   2.959
  443    HA3  GLY  27           2HA      GLY  27 -12.830 -13.602   4.588
  444    H    GLY  28           H        GLY  28 -14.261 -10.553   3.849
  445    HA2  GLY  28           1HA      GLY  28 -16.918 -11.834   3.720
  446    HA3  GLY  28           2HA      GLY  28 -16.613 -10.444   4.756
  447    H    LYS  29           H        LYS  29 -17.889  -8.929   3.818
  448    HA   LYS  29           HA       LYS  29 -17.329  -8.321   0.991
  449    HB2  LYS  29           2HB      LYS  29 -19.803  -7.324   2.344
  450    HB3  LYS  29           1HB      LYS  29 -19.526  -7.674   0.644
  451    HG2  LYS  29           2HG      LYS  29 -19.497 -10.097   1.217
  452    HG3  LYS  29           1HG      LYS  29 -19.957  -9.657   2.863
  453    HD2  LYS  29           2HD      LYS  29 -21.549  -8.904   0.416
  454    HD3  LYS  29           1HD      LYS  29 -21.866 -10.341   1.392
  455    HE2  LYS  29           2HE      LYS  29 -21.657  -7.813   2.890
  456    HE3  LYS  29           1HE      LYS  29 -23.035  -7.929   1.792
  457    HZ1  LYS  29           3HZ      LYS  29 -23.612 -10.048   2.866
  458    HZ2  LYS  29           1HZ      LYS  29 -23.648  -8.741   3.947
  459    HZ3  LYS  29           2HZ      LYS  29 -22.347  -9.832   3.970
  460    H    ILE  30           H        ILE  30 -16.770  -6.257   0.453
  461    HA   ILE  30           HA       ILE  30 -15.650  -4.623   2.477
  462    HB   ILE  30           HB       ILE  30 -16.265  -3.932  -0.406
  463   HG12  ILE  30          2HG1      ILE  30 -13.536  -4.542   0.657
  464   HG13  ILE  30          1HG1      ILE  30 -14.625  -5.875   0.286
  465   HG21  ILE  30          1HG2      ILE  30 -14.073  -2.447   0.479
  466   HG22  ILE  30          2HG2      ILE  30 -15.695  -1.848   0.128
  467   HG23  ILE  30          3HG2      ILE  30 -15.266  -2.327   1.772
  468   HD11  ILE  30          3HD1      ILE  30 -13.778  -3.730  -1.645
  469   HD12  ILE  30          1HD1      ILE  30 -13.118  -5.366  -1.565
  470   HD13  ILE  30          2HD1      ILE  30 -14.809  -5.116  -2.004
  471    H    ALA  31           H        ALA  31 -16.907  -3.683   3.931
  472    HA   ALA  31           HA       ALA  31 -19.345  -2.323   3.069
  473    HB1  ALA  31           1HB      ALA  31 -18.938  -3.925   5.218
  474    HB2  ALA  31           2HB      ALA  31 -18.690  -2.332   5.935
  475    HB3  ALA  31           3HB      ALA  31 -20.206  -2.703   5.116
  476    H    ASP  32           H        ASP  32 -16.398  -1.511   2.845
  477    HA   ASP  32           HA       ASP  32 -16.523   1.066   4.227
  478    HB2  ASP  32           2HB      ASP  32 -14.415  -0.575   3.964
  479    HB3  ASP  32           1HB      ASP  32 -14.209   0.369   2.489
  480    H    ARG  33           H        ARG  33 -15.157   2.710   2.536
  481    HA   ARG  33           HA       ARG  33 -17.215   3.135   0.525
  482    HB2  ARG  33           2HB      ARG  33 -16.297   4.940   2.106
  483    HB3  ARG  33           1HB      ARG  33 -14.893   4.971   1.048
  484    HG2  ARG  33           2HG      ARG  33 -16.535   5.379  -0.851
  485    HG3  ARG  33           1HG      ARG  33 -17.733   5.695   0.403
  486    HD2  ARG  33           2HD      ARG  33 -15.139   7.166  -0.046
  487    HD3  ARG  33           1HD      ARG  33 -16.768   7.780  -0.325
  488    HE   ARG  33           HE       ARG  33 -15.455   7.386   2.260
  489   HH11  ARG  33          2HH1      ARG  33 -18.284   8.427   0.445
  490   HH12  ARG  33          1HH1      ARG  33 -19.005   9.238   1.813
  491   HH21  ARG  33          2HH2      ARG  33 -16.419   8.444   4.039
  492   HH22  ARG  33          1HH2      ARG  33 -17.943   9.247   3.840
  493    H    PHE  34           H        PHE  34 -13.659   3.488   0.434
  494    HA   PHE  34           HA       PHE  34 -13.828   2.939  -2.439
  495    HB2  PHE  34           2HB      PHE  34 -12.193   4.710  -0.777
  496    HB3  PHE  34           1HB      PHE  34 -11.262   3.815  -1.977
  497    HD1  PHE  34           1HD      PHE  34 -14.590   5.519  -1.892
  498    HD2  PHE  34           2HD      PHE  34 -10.868   4.994  -3.890
  499    HE1  PHE  34           1HE      PHE  34 -15.307   7.103  -3.632
  500    HE2  PHE  34           2HE      PHE  34 -11.576   6.581  -5.629
  501    HZ   PHE  34           HZ       PHE  34 -13.798   7.632  -5.505
  502    H    LEU  35           H        LEU  35 -13.095   1.122  -3.253
  503    HA   LEU  35           HA       LEU  35 -11.390  -0.574  -1.579
  504    HB2  LEU  35           2HB      LEU  35 -12.059  -2.431  -2.957
  505    HB3  LEU  35           1HB      LEU  35 -13.480  -1.582  -2.386
  506    HG   LEU  35           HG       LEU  35 -12.744  -0.532  -4.945
  507   HD11  LEU  35          1HD1      LEU  35 -13.517  -3.303  -5.433
  508   HD12  LEU  35          2HD1      LEU  35 -12.321  -2.297  -6.251
  509   HD13  LEU  35          3HD1      LEU  35 -11.896  -3.135  -4.758
  510   HD21  LEU  35          3HD2      LEU  35 -15.044  -1.566  -3.510
  511   HD22  LEU  35          1HD2      LEU  35 -14.955  -0.310  -4.746
  512   HD23  LEU  35          2HD2      LEU  35 -15.068  -2.006  -5.219
  513    H    LEU  36           H        LEU  36  -9.532  -1.552  -2.442
  514    HA   LEU  36           HA       LEU  36  -8.433  -0.206  -4.816
  515    HB2  LEU  36           2HB      LEU  36  -6.411  -0.955  -2.866
  516    HB3  LEU  36           1HB      LEU  36  -6.634   0.556  -3.726
  517    HG   LEU  36           HG       LEU  36  -8.660   0.549  -1.812
  518   HD11  LEU  36          1HD1      LEU  36  -6.658  -1.234  -0.948
  519   HD12  LEU  36          2HD1      LEU  36  -6.469   0.245  -0.009
  520   HD13  LEU  36          3HD1      LEU  36  -8.020  -0.594  -0.028
  521   HD21  LEU  36          3HD2      LEU  36  -6.715   2.231  -2.702
  522   HD22  LEU  36          1HD2      LEU  36  -7.792   2.563  -1.345
  523   HD23  LEU  36          2HD2      LEU  36  -6.180   1.909  -1.053
  524    H    TYR  37           H        TYR  37  -7.012  -1.390  -6.058
  525    HA   TYR  37           HA       TYR  37  -7.219  -4.287  -5.804
  526    HB2  TYR  37           2HB      TYR  37  -6.939  -2.391  -7.946
  527    HB3  TYR  37           1HB      TYR  37  -5.622  -3.550  -8.024
  528    HD1  TYR  37           2HD      TYR  37  -6.774  -6.058  -7.264
  529    HD2  TYR  37           1HD      TYR  37  -8.500  -2.899  -9.522
  530    HE1  TYR  37           2HE      TYR  37  -8.255  -7.670  -8.372
  531    HE2  TYR  37           1HE      TYR  37  -9.987  -4.493 -10.639
  532    HH   TYR  37           HH       TYR  37  -9.482  -7.660 -10.785
  533    H    ALA  38           H        ALA  38  -5.562  -5.611  -5.338
  534    HA   ALA  38           HA       ALA  38  -2.825  -4.684  -5.536
  535    HB1  ALA  38           1HB      ALA  38  -2.207  -5.121  -3.282
  536    HB2  ALA  38           2HB      ALA  38  -3.596  -4.035  -3.239
  537    HB3  ALA  38           3HB      ALA  38  -3.810  -5.754  -2.903
  538    H    MET  39           H        MET  39  -1.781  -6.222  -6.509
  539    HA   MET  39           HA       MET  39  -0.878  -8.240  -7.001
  540    HB2  MET  39           2HB      MET  39  -2.345  -8.960  -4.502
  541    HB3  MET  39           1HB      MET  39  -1.758 -10.257  -5.531
  542    HG2  MET  39           2HG      MET  39   0.068 -10.059  -4.235
  543    HG3  MET  39           1HG      MET  39   0.469  -8.781  -5.384
  544    HE1  MET  39           3HE      MET  39   0.818  -8.246  -1.143
  545    HE2  MET  39           1HE      MET  39   0.475  -9.769  -1.961
  546    HE3  MET  39           2HE      MET  39   1.858  -8.793  -2.456
  547    H    ASP  40           H        ASP  40  -4.270  -8.867  -6.068
  548    HA   ASP  40           HA       ASP  40  -5.021  -9.624  -8.717
  549    HB2  ASP  40           2HB      ASP  40  -3.706 -11.584  -8.261
  550    HB3  ASP  40           1HB      ASP  40  -4.448 -11.782  -6.679
  551    H    SER  41           H        SER  41  -5.712  -9.043  -5.403
  552    HA   SER  41           HA       SER  41  -8.511  -9.870  -5.771
  553    HB2  SER  41           2HB      SER  41  -7.706  -9.409  -3.014
  554    HB3  SER  41           1HB      SER  41  -8.433 -10.841  -3.748
  555    HG   SER  41           HG       SER  41  -6.499 -11.681  -4.095
  556    H    TYR  42           H        TYR  42 -10.061  -8.634  -4.333
  557    HA   TYR  42           HA       TYR  42  -9.551  -5.760  -4.595
  558    HB2  TYR  42           2HB      TYR  42 -12.120  -7.091  -3.723
  559    HB3  TYR  42           1HB      TYR  42 -11.906  -5.439  -4.279
  560    HD1  TYR  42           2HD      TYR  42 -11.716  -4.946  -6.666
  561    HD2  TYR  42           1HD      TYR  42 -12.252  -8.932  -5.282
  562    HE1  TYR  42           2HE      TYR  42 -12.370  -5.642  -8.930
  563    HE2  TYR  42           1HE      TYR  42 -12.909  -9.637  -7.541
  564    HH   TYR  42           HH       TYR  42 -13.256  -7.288 -10.170
  565    H    TRP  43           H        TRP  43  -9.006  -4.569  -2.865
  566    HA   TRP  43           HA       TRP  43  -9.749  -5.596  -0.205
  567    HB2  TRP  43           2HB      TRP  43  -7.241  -3.996  -0.451
  568    HB3  TRP  43           1HB      TRP  43  -7.688  -5.193   0.739
  569    HD1  TRP  43           HD       TRP  43  -6.765  -5.216  -3.048
  570    HE1  TRP  43           1HE      TRP  43  -5.304  -7.300  -3.462
  571    HE3  TRP  43           3HE      TRP  43  -6.822  -7.135   1.639
  572    HZ2  TRP  43           2HZ      TRP  43  -4.306  -9.480  -1.971
  573    HZ3  TRP  43           3HZ      TRP  43  -5.593  -9.231   2.093
  574    HH2  TRP  43           HH       TRP  43  -4.359 -10.374   0.317
  575    H    HIS  44           H        HIS  44  -9.550  -3.848   1.478
  576    HA   HIS  44           HA       HIS  44 -10.120  -1.165   0.436
  577    HB2  HIS  44           2HB      HIS  44 -11.725  -0.884   2.423
  578    HB3  HIS  44           1HB      HIS  44 -12.311  -1.866   1.085
  579    HD1  HIS  44           1HD      HIS  44 -12.528  -1.926   4.592
  580    HD2  HIS  44           2HD      HIS  44 -11.338  -4.735   1.766
  581    HE1  HIS  44           1HE      HIS  44 -12.650  -4.210   5.726
  582    H    SER  45           H        SER  45 -10.249   0.193   2.822
  583    HA   SER  45           HA       SER  45  -7.587   0.668   3.332
  584    HB2  SER  45           2HB      SER  45  -9.258   1.364   5.598
  585    HB3  SER  45           1HB      SER  45  -8.449   2.415   4.431
  586    HG   SER  45           HG       SER  45 -10.781   2.551   4.404
  587    H    ARG  46           H        ARG  46  -9.819  -1.321   5.292
  588    HA   ARG  46           HA       ARG  46  -7.665  -1.860   7.166
  589    HB2  ARG  46           2HB      ARG  46  -9.240  -2.347   8.703
  590    HB3  ARG  46           1HB      ARG  46 -10.297  -1.488   7.595
  591    HG2  ARG  46           2HG      ARG  46 -11.575  -3.284   7.464
  592    HG3  ARG  46           1HG      ARG  46 -10.232  -4.177   6.750
  593    HD2  ARG  46           2HD      ARG  46  -9.424  -4.560   9.134
  594    HD3  ARG  46           1HD      ARG  46 -11.007  -3.978   9.650
  595    HE   ARG  46           HE       ARG  46 -11.204  -6.056   7.695
  596   HH11  ARG  46          2HH1      ARG  46 -10.700  -5.456  11.122
  597   HH12  ARG  46          1HH1      ARG  46 -11.332  -7.010  11.597
  598   HH21  ARG  46          2HH2      ARG  46 -11.997  -8.060   8.307
  599   HH22  ARG  46          1HH2      ARG  46 -12.034  -8.511   9.989
  600    H    CYS  47           H        CYS  47  -8.701  -3.254   4.310
  601    HA   CYS  47           HA       CYS  47  -7.969  -5.966   5.097
  602    HB2  CYS  47           2HB      CYS  47  -9.598  -4.882   3.058
  603    HB3  CYS  47           1HB      CYS  47  -8.236  -5.651   2.252
  604    H    LEU  48           H        LEU  48  -6.973  -3.616   2.638
  605    HA   LEU  48           HA       LEU  48  -4.477  -4.935   2.166
  606    HB2  LEU  48           2HB      LEU  48  -5.786  -3.544   0.493
  607    HB3  LEU  48           1HB      LEU  48  -5.246  -2.129   1.376
  608    HG   LEU  48           HG       LEU  48  -2.945  -2.587   0.826
  609   HD11  LEU  48          1HD1      LEU  48  -2.736  -4.910   0.877
  610   HD12  LEU  48          2HD1      LEU  48  -4.043  -5.144  -0.284
  611   HD13  LEU  48          3HD1      LEU  48  -2.496  -4.490  -0.820
  612   HD21  LEU  48          3HD2      LEU  48  -4.830  -2.727  -1.512
  613   HD22  LEU  48          1HD2      LEU  48  -4.064  -1.298  -0.816
  614   HD23  LEU  48          2HD2      LEU  48  -3.090  -2.487  -1.681
  615    H    LYS  49           H        LYS  49  -3.383  -5.014   4.102
  616    HA   LYS  49           HA       LYS  49  -2.091  -2.506   4.841
  617    HB2  LYS  49           2HB      LYS  49  -2.332  -3.628   7.316
  618    HB3  LYS  49           1HB      LYS  49  -3.361  -2.341   6.717
  619    HG2  LYS  49           2HG      LYS  49  -5.033  -3.710   7.297
  620    HG3  LYS  49           1HG      LYS  49  -4.656  -4.549   5.790
  621    HD2  LYS  49           2HD      LYS  49  -3.354  -6.174   6.907
  622    HD3  LYS  49           1HD      LYS  49  -3.320  -5.232   8.398
  623    HE2  LYS  49           2HE      LYS  49  -4.853  -7.096   8.618
  624    HE3  LYS  49           1HE      LYS  49  -5.737  -5.568   8.652
  625    HZ1  LYS  49           3HZ      LYS  49  -5.962  -7.749   6.822
  626    HZ2  LYS  49           1HZ      LYS  49  -5.680  -6.288   6.009
  627    HZ3  LYS  49           2HZ      LYS  49  -6.997  -6.426   7.061
  628    H    CYS  50           H        CYS  50  -0.236  -2.907   6.274
  629    HA   CYS  50           HA       CYS  50   1.445  -4.934   5.255
  630    HB2  CYS  50           2HB      CYS  50   2.332  -2.830   6.025
  631    HB3  CYS  50           1HB      CYS  50   1.649  -3.070   7.623
  632    H    SER  51           H        SER  51   1.718  -6.979   5.912
  633    HA   SER  51           HA       SER  51   0.029  -7.992   8.017
  634    HB2  SER  51           2HB      SER  51   2.033  -9.841   6.924
  635    HB3  SER  51           1HB      SER  51   0.279  -9.996   7.008
  636    HG   SER  51           HG       SER  51   0.603  -8.163   5.252
  637    H    SER  52           H        SER  52   2.860  -6.412   8.145
  638    HA   SER  52           HA       SER  52   4.027  -8.128  10.212
  639    HB2  SER  52           2HB      SER  52   5.599  -5.790   9.527
  640    HB3  SER  52           1HB      SER  52   6.025  -7.499   9.434
  641    HG   SER  52           HG       SER  52   4.657  -5.936   7.493
  642    H    CYS  53           H        CYS  53   3.208  -4.663   9.691
  643    HA   CYS  53           HA       CYS  53   3.239  -4.401  12.626
  644    HB2  CYS  53           2HB      CYS  53   3.706  -2.046  12.363
  645    HB3  CYS  53           1HB      CYS  53   4.885  -2.977  11.447
  646    H    GLN  54           H        GLN  54   1.196  -4.602  10.022
  647    HA   GLN  54           HA       GLN  54  -1.054  -4.559   9.878
  648    HB2  GLN  54           2HB      GLN  54  -0.631  -4.264  12.750
  649    HB3  GLN  54           1HB      GLN  54  -2.112  -3.498  12.189
  650    HG2  GLN  54           2HG      GLN  54  -1.642  -6.185  11.124
  651    HG3  GLN  54           1HG      GLN  54  -1.878  -6.103  12.869
  652   HE21  GLN  54          1HE2      GLN  54  -3.311  -3.779  10.734
  653   HE22  GLN  54          2HE2      GLN  54  -4.948  -4.325  10.905
  654    H    ALA  55           H        ALA  55   0.839  -2.105   9.669
  655    HA   ALA  55           HA       ALA  55  -0.787   0.180   9.979
  656    HB1  ALA  55           1HB      ALA  55   0.857   1.354   8.848
  657    HB2  ALA  55           2HB      ALA  55   1.765  -0.011   9.495
  658    HB3  ALA  55           3HB      ALA  55   1.260  -0.010   7.804
  659    H    GLN  56           H        GLN  56  -2.554   0.749   8.905
  660    HA   GLN  56           HA       GLN  56  -3.649  -0.775   6.817
  661    HB2  GLN  56           2HB      GLN  56  -4.386   2.098   7.296
  662    HB3  GLN  56           1HB      GLN  56  -5.412   0.764   6.795
  663    HG2  GLN  56           2HG      GLN  56  -4.120   0.824   9.497
  664    HG3  GLN  56           1HG      GLN  56  -5.660   1.620   9.184
  665   HE21  GLN  56          1HE2      GLN  56  -4.025  -1.381   9.648
  666   HE22  GLN  56          2HE2      GLN  56  -5.432  -2.393   9.637
  667    H    LEU  57           H        LEU  57  -3.183  -0.825   4.722
  668    HA   LEU  57           HA       LEU  57  -1.278   1.132   3.698
  669    HB2  LEU  57           2HB      LEU  57  -1.952  -1.671   3.148
  670    HB3  LEU  57           1HB      LEU  57  -1.633  -0.725   1.710
  671    HG   LEU  57           HG       LEU  57   0.580  -0.466   2.201
  672   HD11  LEU  57          1HD1      LEU  57   0.368  -1.158   5.088
  673   HD12  LEU  57          2HD1      LEU  57   1.569  -0.171   4.254
  674   HD13  LEU  57          3HD1      LEU  57  -0.049   0.468   4.544
  675   HD21  LEU  57          3HD2      LEU  57  -0.428  -3.064   3.161
  676   HD22  LEU  57          1HD2      LEU  57   0.706  -2.695   1.860
  677   HD23  LEU  57          2HD2      LEU  57   1.248  -2.674   3.540
  678    H    GLY  58           H        GLY  58  -4.389   1.280   3.953
  679    HA2  GLY  58           1HA      GLY  58  -5.099   1.894   1.213
  680    HA3  GLY  58           2HA      GLY  58  -6.137   2.053   2.624
  681    H    ASP  59           H        ASP  59  -4.704   3.679   4.252
  682    HA   ASP  59           HA       ASP  59  -4.849   6.200   2.762
  683    HB2  ASP  59           2HB      ASP  59  -6.026   5.429   5.133
  684    HB3  ASP  59           1HB      ASP  59  -4.641   6.364   5.683
  685    H    ILE  60           H        ILE  60  -2.620   5.632   1.942
  686    HA   ILE  60           HA       ILE  60  -0.608   6.529   3.894
  687    HB   ILE  60           HB       ILE  60   0.875   5.070   2.104
  688   HG12  ILE  60          2HG1      ILE  60  -0.711   2.839   2.635
  689   HG13  ILE  60          1HG1      ILE  60  -1.851   4.053   2.069
  690   HG21  ILE  60          1HG2      ILE  60  -0.213   4.484   4.825
  691   HG22  ILE  60          2HG2      ILE  60   0.839   3.333   3.999
  692   HG23  ILE  60          3HG2      ILE  60   1.416   4.962   4.347
  693   HD11  ILE  60          3HD1      ILE  60  -0.943   4.126  -0.029
  694   HD12  ILE  60          1HD1      ILE  60   0.646   3.593   0.521
  695   HD13  ILE  60          2HD1      ILE  60  -0.678   2.434   0.397
  696    H    GLY  61           H        GLY  61   0.377   5.741   0.733
  697    HA2  GLY  61           1HA      GLY  61   0.053   7.889  -0.855
  698    HA3  GLY  61           2HA      GLY  61   1.255   8.464   0.299
  699    H    THR  62           H        THR  62   2.901   6.477   0.734
  700    HA   THR  62           HA       THR  62   4.144   5.864  -1.806
  701    HB   THR  62           HB       THR  62   5.213   4.508   0.564
  702    HG1  THR  62           1HG      THR  62   5.346   7.357   0.525
  703   HG21  THR  62          3HG2      THR  62   6.768   4.579  -1.106
  704   HG22  THR  62          1HG2      THR  62   7.188   6.087  -0.296
  705   HG23  THR  62          2HG2      THR  62   6.173   6.115  -1.737
  706    H    SER  63           H        SER  63   4.050   3.929  -2.850
  707    HA   SER  63           HA       SER  63   1.905   2.202  -2.246
  708    HB2  SER  63           2HB      SER  63   4.039   1.256  -4.071
  709    HB3  SER  63           1HB      SER  63   2.292   1.320  -4.312
  710    HG   SER  63           HG       SER  63   2.524   3.177  -5.251
  711    H    SER  64           H        SER  64   1.914  -0.017  -1.757
  712    HA   SER  64           HA       SER  64   3.878  -0.841   0.156
  713    HB2  SER  64           2HB      SER  64   2.246  -3.025  -0.452
  714    HB3  SER  64           1HB      SER  64   2.009  -1.876   0.864
  715    HG   SER  64           HG       SER  64   0.743  -2.032  -1.628
  716    H    TYR  65           H        TYR  65   4.977  -2.939   0.009
  717    HA   TYR  65           HA       TYR  65   5.632  -3.680  -2.764
  718    HB2  TYR  65           2HB      TYR  65   7.607  -3.545  -0.470
  719    HB3  TYR  65           1HB      TYR  65   7.969  -3.952  -2.143
  720    HD1  TYR  65           1HD      TYR  65   7.525  -2.125  -3.911
  721    HD2  TYR  65           2HD      TYR  65   7.770  -1.331   0.263
  722    HE1  TYR  65           1HE      TYR  65   7.978   0.241  -4.392
  723    HE2  TYR  65           2HE      TYR  65   8.220   1.042  -0.208
  724    HH   TYR  65           HH       TYR  65   8.280   2.274  -3.546
  725    H    THR  66           H        THR  66   6.456  -5.886  -2.994
  726    HA   THR  66           HA       THR  66   5.990  -7.644  -0.721
  727    HB   THR  66           HB       THR  66   3.858  -7.452  -2.103
  728    HG1  THR  66           1HG      THR  66   4.039  -9.160  -0.717
  729   HG21  THR  66          3HG2      THR  66   4.719  -7.480  -4.332
  730   HG22  THR  66          1HG2      THR  66   3.794  -8.964  -4.097
  731   HG23  THR  66          2HG2      THR  66   5.557  -9.006  -4.049
  732    H    LYS  67           H        LYS  67   6.806  -9.803  -1.064
  733    HA   LYS  67           HA       LYS  67   8.527 -10.409  -3.255
  734    HB2  LYS  67           2HB      LYS  67   9.771  -8.688  -1.738
  735    HB3  LYS  67           1HB      LYS  67   9.969 -10.054  -0.646
  736    HG2  LYS  67           2HG      LYS  67  10.842 -11.200  -2.886
  737    HG3  LYS  67           1HG      LYS  67  11.226  -9.518  -3.268
  738    HD2  LYS  67           2HD      LYS  67  12.265  -9.489  -0.882
  739    HD3  LYS  67           1HD      LYS  67  12.270 -11.246  -1.054
  740    HE2  LYS  67           2HE      LYS  67  14.318 -10.826  -1.934
  741    HE3  LYS  67           1HE      LYS  67  13.359 -10.606  -3.397
  742    HZ1  LYS  67           3HZ      LYS  67  14.436  -8.657  -3.482
  743    HZ2  LYS  67           1HZ      LYS  67  14.826  -8.653  -1.834
  744    HZ3  LYS  67           2HZ      LYS  67  13.292  -8.148  -2.343
  745    H    SER  68           H        SER  68   7.753 -10.980   0.143
  746    HA   SER  68           HA       SER  68   8.269 -13.827  -0.118
  747    HB2  SER  68           2HB      SER  68   7.183 -13.298   2.410
  748    HB3  SER  68           1HB      SER  68   8.894 -13.475   2.013
  749    HG   SER  68           HG       SER  68   8.903 -11.486   2.780
  750    H    GLY  69           H        GLY  69   5.940 -12.317  -1.411
  751    HA2  GLY  69           1HA      GLY  69   3.768 -12.830  -1.951
  752    HA3  GLY  69           2HA      GLY  69   3.953 -14.311  -1.021
  753    H    MET  70           H        MET  70   4.596 -11.284   0.499
  754    HA   MET  70           HA       MET  70   1.954 -11.291   1.784
  755    HB2  MET  70           2HB      MET  70   4.523 -10.705   3.263
  756    HB3  MET  70           1HB      MET  70   2.915 -10.885   3.944
  757    HG2  MET  70           2HG      MET  70   2.931 -13.256   3.377
  758    HG3  MET  70           1HG      MET  70   4.534 -13.077   2.670
  759    HE1  MET  70           3HE      MET  70   6.613 -12.021   5.874
  760    HE2  MET  70           1HE      MET  70   6.754 -12.464   4.174
  761    HE3  MET  70           2HE      MET  70   5.850 -11.021   4.638
  762    H    ILE  71           H        ILE  71   1.176  -9.232   2.362
  763    HA   ILE  71           HA       ILE  71   2.358  -7.046   0.874
  764    HB   ILE  71           HB       ILE  71   0.201  -6.253   2.648
  765   HG12  ILE  71          2HG1      ILE  71  -1.403  -7.632   0.957
  766   HG13  ILE  71          1HG1      ILE  71  -0.088  -8.789   1.149
  767   HG21  ILE  71          1HG2      ILE  71   1.188  -5.725   0.048
  768   HG22  ILE  71          2HG2      ILE  71  -0.510  -6.178  -0.100
  769   HG23  ILE  71          3HG2      ILE  71  -0.042  -4.846   0.956
  770   HD11  ILE  71          3HD1      ILE  71  -0.432  -8.253   3.697
  771   HD12  ILE  71          1HD1      ILE  71  -2.046  -7.792   3.140
  772   HD13  ILE  71          2HD1      ILE  71  -1.445  -9.428   2.852
  773    H    LEU  72           H        LEU  72   3.939  -5.896   1.703
  774    HA   LEU  72           HA       LEU  72   3.993  -5.463   4.614
  775    HB2  LEU  72           2HB      LEU  72   6.059  -6.471   2.766
  776    HB3  LEU  72           1HB      LEU  72   6.604  -5.230   3.878
  777    HG   LEU  72           HG       LEU  72   5.619  -6.664   5.739
  778   HD11  LEU  72          1HD1      LEU  72   5.892  -8.945   3.833
  779   HD12  LEU  72          2HD1      LEU  72   5.061  -8.873   5.388
  780   HD13  LEU  72          3HD1      LEU  72   4.358  -8.086   3.974
  781   HD21  LEU  72          3HD2      LEU  72   8.075  -6.978   4.208
  782   HD22  LEU  72          1HD2      LEU  72   7.833  -6.870   5.952
  783   HD23  LEU  72          2HD2      LEU  72   7.640  -8.418   5.126
  784    H    CYS  73           H        CYS  73   4.575  -3.413   5.320
  785    HA   CYS  73           HA       CYS  73   4.156  -1.305   3.444
  786    HB2  CYS  73           2HB      CYS  73   4.313   0.197   5.288
  787    HB3  CYS  73           1HB      CYS  73   3.457  -1.229   5.858
  788    H    ARG  74           H        ARG  74   5.610   0.537   3.251
  789    HA   ARG  74           HA       ARG  74   8.016  -0.026   2.074
  790    HB2  ARG  74           2HB      ARG  74   8.383   2.532   3.104
  791    HB3  ARG  74           1HB      ARG  74   7.673   2.121   1.551
  792    HG2  ARG  74           2HG      ARG  74   6.021   3.445   2.387
  793    HG3  ARG  74           1HG      ARG  74   5.479   1.885   3.009
  794    HD2  ARG  74           2HD      ARG  74   7.380   3.260   4.756
  795    HD3  ARG  74           1HD      ARG  74   5.879   4.148   4.505
  796    HE   ARG  74           HE       ARG  74   5.523   1.360   5.185
  797   HH11  ARG  74          2HH1      ARG  74   5.861   4.622   6.427
  798   HH12  ARG  74          1HH1      ARG  74   5.052   4.262   7.932
  799   HH21  ARG  74          2HH2      ARG  74   4.500   0.873   7.164
  800   HH22  ARG  74          1HH2      ARG  74   4.279   2.128   8.358
  801    H    ASN  75           H        ASN  75   7.450   0.861   5.461
  802    HA   ASN  75           HA       ASN  75  10.232   1.056   6.071
  803    HB2  ASN  75           2HB      ASN  75   9.407   2.206   7.796
  804    HB3  ASN  75           1HB      ASN  75   7.778   1.742   7.333
  805   HD21  ASN  75          1HD2      ASN  75   6.715   0.180   8.482
  806   HD22  ASN  75          2HD2      ASN  75   7.323  -0.482   9.960
  807    H    ASP  76           H        ASP  76   7.825  -1.469   6.240
  808    HA   ASP  76           HA       ASP  76   9.401  -3.112   8.004
  809    HB2  ASP  76           2HB      ASP  76   6.708  -3.158   6.933
  810    HB3  ASP  76           1HB      ASP  76   7.460  -4.751   6.869
  811    H    TYR  77           H        TYR  77   8.539  -3.209   4.555
  812    HA   TYR  77           HA       TYR  77   9.705  -5.697   4.031
  813    HB2  TYR  77           2HB      TYR  77   8.240  -4.815   2.380
  814    HB3  TYR  77           1HB      TYR  77   9.196  -3.342   2.218
  815    HD1  TYR  77           1HD      TYR  77   9.988  -6.993   2.130
  816    HD2  TYR  77           2HD      TYR  77  10.244  -3.233   0.148
  817    HE1  TYR  77           1HE      TYR  77  11.293  -8.034   0.328
  818    HE2  TYR  77           2HE      TYR  77  11.547  -4.271  -1.662
  819    HH   TYR  77           HH       TYR  77  13.078  -6.292  -1.882
  820    H    ILE  78           H        ILE  78  11.102  -2.444   3.642
  821    HA   ILE  78           HA       ILE  78  13.562  -3.331   2.586
  822    HB   ILE  78           HB       ILE  78  13.036  -0.777   4.116
  823   HG12  ILE  78          2HG1      ILE  78  12.935  -1.261   1.128
  824   HG13  ILE  78          1HG1      ILE  78  11.513  -1.175   2.163
  825   HG21  ILE  78          1HG2      ILE  78  15.452  -1.752   3.413
  826   HG22  ILE  78          2HG2      ILE  78  15.031  -0.862   1.950
  827   HG23  ILE  78          3HG2      ILE  78  15.078  -0.031   3.505
  828   HD11  ILE  78          3HD1      ILE  78  11.865   0.921   1.018
  829   HD12  ILE  78          1HD1      ILE  78  12.103   1.128   2.753
  830   HD13  ILE  78          2HD1      ILE  78  13.498   1.033   1.678
  831    H    ARG  79           H        ARG  79  12.424  -2.878   5.865
  832    HA   ARG  79           HA       ARG  79  14.987  -3.141   7.099
  833    HB2  ARG  79           2HB      ARG  79  12.856  -2.054   8.044
  834    HB3  ARG  79           1HB      ARG  79  12.340  -3.691   8.426
  835    HG2  ARG  79           2HG      ARG  79  14.733  -3.773   9.559
  836    HG3  ARG  79           1HG      ARG  79  14.472  -2.029   9.638
  837    HD2  ARG  79           2HD      ARG  79  12.873  -4.239  10.893
  838    HD3  ARG  79           1HD      ARG  79  13.614  -2.835  11.661
  839    HE   ARG  79           HE       ARG  79  11.875  -1.473  10.678
  840   HH11  ARG  79          2HH1      ARG  79  11.349  -4.943  10.663
  841   HH12  ARG  79          1HH1      ARG  79   9.633  -4.797  10.380
  842   HH21  ARG  79          2HH2      ARG  79   9.624  -1.292  10.361
  843   HH22  ARG  79          1HH2      ARG  79   8.660  -2.737  10.246
  844    H    LEU  80           H        LEU  80  12.255  -5.324   6.540
  845    HA   LEU  80           HA       LEU  80  13.471  -7.512   7.921
  846    HB2  LEU  80           2HB      LEU  80  11.024  -7.205   6.204
  847    HB3  LEU  80           1HB      LEU  80  11.571  -8.794   6.708
  848    HG   LEU  80           HG       LEU  80  11.178  -6.695   8.793
  849   HD11  LEU  80          1HD1      LEU  80   9.154  -6.605   7.406
  850   HD12  LEU  80          2HD1      LEU  80   8.948  -8.343   7.619
  851   HD13  LEU  80          3HD1      LEU  80   8.840  -7.267   9.011
  852   HD21  LEU  80          3HD2      LEU  80  11.219  -9.667   8.611
  853   HD22  LEU  80          1HD2      LEU  80  12.030  -8.593   9.752
  854   HD23  LEU  80          2HD2      LEU  80  10.299  -8.894   9.901
  855    H    PHE  81           H        PHE  81  12.883  -6.813   4.479
  856    HA   PHE  81           HA       PHE  81  14.695  -9.046   3.826
  857    HB2  PHE  81           2HB      PHE  81  12.247  -8.004   2.413
  858    HB3  PHE  81           1HB      PHE  81  13.435  -9.005   1.589
  859    HD1  PHE  81           1HD      PHE  81  11.034  -8.936   4.395
  860    HD2  PHE  81           2HD      PHE  81  13.443 -11.337   1.838
  861    HE1  PHE  81           1HE      PHE  81   9.891 -10.950   5.218
  862    HE2  PHE  81           2HE      PHE  81  12.304 -13.360   2.659
  863    HZ   PHE  81           HZ       PHE  81  10.526 -13.165   4.353
  864    H    GLY  82           H        GLY  82  13.529  -6.933   1.376
  865    HA2  GLY  82           1HA      GLY  82  14.801  -4.906   0.694
  866    HA3  GLY  82           2HA      GLY  82  16.250  -5.833   1.075
  Start of MODEL    4
    1    H    SER 641           1H       SER 641   9.646 -18.155 -17.457
    2    HA   SER 641           HA       SER 641   8.162 -16.481 -18.647
    3    HB2  SER 641           2HB      SER 641   9.408 -18.407 -20.557
    4    HB3  SER 641           1HB      SER 641   9.566 -16.652 -20.465
    5    HG   SER 641           HG       SER 641  11.103 -18.593 -19.351
    6    H    LEU 642           H        LEU 642   7.429 -16.979 -21.269
    7    HA   LEU 642           HA       LEU 642   4.801 -18.171 -20.737
    8    HB2  LEU 642           2HB      LEU 642   5.776 -16.099 -22.673
    9    HB3  LEU 642           1HB      LEU 642   4.230 -16.890 -22.900
   10    HG   LEU 642           HG       LEU 642   4.370 -15.933 -20.215
   11   HD11  LEU 642          1HD1      LEU 642   4.310 -13.451 -21.517
   12   HD12  LEU 642          2HD1      LEU 642   5.509 -14.034 -20.363
   13   HD13  LEU 642          3HD1      LEU 642   5.765 -14.269 -22.091
   14   HD21  LEU 642          3HD2      LEU 642   2.235 -16.010 -20.914
   15   HD22  LEU 642          1HD2      LEU 642   2.551 -14.372 -21.481
   16   HD23  LEU 642          2HD2      LEU 642   2.666 -15.730 -22.599
   17    H    GLN 643           H        GLN 643   7.508 -18.380 -22.970
   18    HA   GLN 643           HA       GLN 643   6.043 -19.982 -24.852
   19    HB2  GLN 643           2HB      GLN 643   8.033 -20.000 -26.198
   20    HB3  GLN 643           1HB      GLN 643   7.751 -18.377 -25.606
   21    HG2  GLN 643           2HG      GLN 643   9.936 -20.295 -24.932
   22    HG3  GLN 643           1HG      GLN 643  10.041 -18.615 -25.441
   23   HE21  GLN 643          1HE2      GLN 643  10.497 -20.636 -22.951
   24   HE22  GLN 643          2HE2      GLN 643  10.349 -19.540 -21.621
   25    H    ASN 644           H        ASN 644   5.376 -21.660 -23.542
   26    HA   ASN 644           HA       ASN 644   7.044 -23.346 -22.031
   27    HB2  ASN 644           2HB      ASN 644   4.396 -23.027 -22.211
   28    HB3  ASN 644           1HB      ASN 644   4.555 -24.445 -23.238
   29   HD21  ASN 644          1HD2      ASN 644   3.094 -24.618 -21.022
   30   HD22  ASN 644          2HD2      ASN 644   3.898 -25.571 -19.819
   31    H    ASN 645           H        ASN 645   5.808 -23.636 -25.347
   32    HA   ASN 645           HA       ASN 645   7.052 -26.219 -25.724
   33    HB2  ASN 645           2HB      ASN 645   4.868 -25.402 -26.796
   34    HB3  ASN 645           1HB      ASN 645   5.889 -24.477 -27.892
   35   HD21  ASN 645          1HD2      ASN 645   5.483 -27.774 -26.643
   36   HD22  ASN 645          2HD2      ASN 645   5.861 -28.564 -28.132
   37    H    GLN 646           H        GLN 646   8.325 -23.252 -25.524
   38    HA   GLN 646           HA       GLN 646  10.548 -23.933 -27.300
   39    HB2  GLN 646           2HB      GLN 646   8.782 -21.560 -27.503
   40    HB3  GLN 646           1HB      GLN 646  10.507 -21.268 -27.680
   41    HG2  GLN 646           2HG      GLN 646   9.586 -23.536 -29.238
   42    HG3  GLN 646           1HG      GLN 646   8.767 -22.031 -29.659
   43   HE21  GLN 646          1HE2      GLN 646   9.842 -20.492 -30.762
   44   HE22  GLN 646          2HE2      GLN 646  11.482 -20.640 -31.302
   45    H    ASP 647           H        ASP 647  10.351 -24.221 -24.536
   46    HA   ASP 647           HA       ASP 647  11.221 -22.046 -23.008
   47    HB2  ASP 647           2HB      ASP 647  10.393 -24.466 -22.333
   48    HB3  ASP 647           1HB      ASP 647  12.121 -24.807 -22.298
   49    H    VAL 648           H        VAL 648  13.062 -20.974 -23.007
   50    HA   VAL 648           HA       VAL 648  15.396 -22.184 -24.311
   51    HB   VAL 648           HB       VAL 648  16.232 -19.755 -24.312
   52   HG11  VAL 648          1HG1      VAL 648  14.534 -21.223 -26.058
   53   HG12  VAL 648          2HG1      VAL 648  14.090 -19.517 -26.146
   54   HG13  VAL 648          3HG1      VAL 648  15.754 -20.015 -26.458
   55   HG21  VAL 648          3HG2      VAL 648  14.122 -18.203 -24.490
   56   HG22  VAL 648          1HG2      VAL 648  13.405 -19.404 -23.415
   57   HG23  VAL 648          2HG2      VAL 648  14.858 -18.537 -22.923
   58    H    SER 649           H        SER 649  17.526 -21.628 -23.445
   59    HA   SER 649           HA       SER 649  17.643 -22.272 -20.676
   60    HB2  SER 649           2HB      SER 649  20.143 -21.365 -21.876
   61    HB3  SER 649           1HB      SER 649  19.723 -22.943 -21.203
   62    HG   SER 649           HG       SER 649  18.836 -23.538 -23.142
   63    H    PHE 650           H        PHE 650  16.737 -20.587 -19.511
   64    HA   PHE 650           HA       PHE 650  17.700 -17.889 -19.714
   65    HB2  PHE 650           2HB      PHE 650  15.711 -19.357 -18.111
   66    HB3  PHE 650           1HB      PHE 650  16.509 -18.046 -17.250
   67    HD1  PHE 650           1HD      PHE 650  15.066 -18.617 -20.644
   68    HD2  PHE 650           2HD      PHE 650  15.408 -16.046 -17.270
   69    HE1  PHE 650           1HE      PHE 650  13.573 -16.995 -21.734
   70    HE2  PHE 650           2HE      PHE 650  13.915 -14.420 -18.354
   71    HZ   PHE 650           HZ       PHE 650  12.994 -14.892 -20.588
   72    H    GLU 651           H        GLU 651  18.555 -20.765 -18.035
   73    HA   GLU 651           HA       GLU 651  20.119 -19.670 -15.954
   74    HB2  GLU 651           2HB      GLU 651  21.320 -22.032 -16.309
   75    HB3  GLU 651           1HB      GLU 651  19.756 -21.874 -15.524
   76    HG2  GLU 651           2HG      GLU 651  19.882 -22.300 -18.474
   77    HG3  GLU 651           1HG      GLU 651  20.139 -23.660 -17.384
   78    H    ASN 652           H        ASN 652  20.636 -19.898 -19.311
   79    HA   ASN 652           HA       ASN 652  23.491 -19.784 -19.289
   80    HB2  ASN 652           2HB      ASN 652  21.949 -20.456 -21.244
   81    HB3  ASN 652           1HB      ASN 652  21.737 -18.727 -21.502
   82   HD21  ASN 652          1HD2      ASN 652  22.965 -18.007 -23.073
   83   HD22  ASN 652          2HD2      ASN 652  24.573 -18.543 -23.440
   84    H    ILE 653           H        ILE 653  20.924 -17.525 -18.881
   85    HA   ILE 653           HA       ILE 653  22.757 -15.247 -19.144
   86    HB   ILE 653           HB       ILE 653  19.955 -14.618 -18.584
   87   HG12  ILE 653          2HG1      ILE 653  20.422 -15.581 -21.373
   88   HG13  ILE 653          1HG1      ILE 653  20.034 -16.769 -20.136
   89   HG21  ILE 653          1HG2      ILE 653  20.569 -12.745 -19.600
   90   HG22  ILE 653          2HG2      ILE 653  22.187 -13.432 -19.754
   91   HG23  ILE 653          3HG2      ILE 653  21.020 -13.623 -21.062
   92   HD11  ILE 653          3HD1      ILE 653  18.019 -15.306 -19.602
   93   HD12  ILE 653          1HD1      ILE 653  18.363 -14.490 -21.127
   94   HD13  ILE 653          2HD1      ILE 653  17.988 -16.213 -21.113
   95    H    GLN 654           H        GLN 654  23.270 -16.738 -16.993
   96    HA   GLN 654           HA       GLN 654  21.888 -15.502 -14.723
   97    HB2  GLN 654           2HB      GLN 654  23.369 -18.041 -15.131
   98    HB3  GLN 654           1HB      GLN 654  23.495 -17.299 -13.542
   99    HG2  GLN 654           2HG      GLN 654  21.058 -17.304 -13.367
  100    HG3  GLN 654           1HG      GLN 654  20.960 -18.062 -14.955
  101   HE21  GLN 654          1HE2      GLN 654  22.577 -20.038 -15.046
  102   HE22  GLN 654          2HE2      GLN 654  22.353 -21.174 -13.754
  103    H    TRP 655           H        TRP 655  23.330 -13.673 -15.880
  104    HA   TRP 655           HA       TRP 655  26.015 -13.606 -14.768
  105    HB2  TRP 655           2HB      TRP 655  26.215 -11.452 -16.001
  106    HB3  TRP 655           1HB      TRP 655  25.783 -12.804 -17.040
  107    HD1  TRP 655           HD       TRP 655  22.938 -12.953 -17.471
  108    HE1  TRP 655           1HE      TRP 655  21.371 -10.999 -18.070
  109    HE3  TRP 655           3HE      TRP 655  25.856  -9.071 -15.866
  110    HZ2  TRP 655           2HZ      TRP 655  21.388  -8.188 -17.894
  111    HZ3  TRP 655           3HZ      TRP 655  25.006  -6.779 -16.126
  112    HH2  TRP 655           HH       TRP 655  22.818  -6.349 -17.120
  113    H    SER 656           H        SER 656  26.588 -11.256 -13.893
  114    HA   SER 656           HA       SER 656  25.065 -11.032 -11.474
  115    HB2  SER 656           2HB      SER 656  27.018  -8.932 -11.849
  116    HB3  SER 656           1HB      SER 656  27.014 -10.256 -10.682
  117    HG   SER 656           HG       SER 656  28.278 -11.407 -11.948
  118    H    ILE 657           H        ILE 657  23.039 -10.349 -12.334
  119    HA   ILE 657           HA       ILE 657  22.725  -7.855 -13.697
  120    HB   ILE 657           HB       ILE 657  20.334  -8.125 -13.286
  121   HG12  ILE 657          2HG1      ILE 657  20.549 -10.758 -11.992
  122   HG13  ILE 657          1HG1      ILE 657  21.060  -9.417 -10.972
  123   HG21  ILE 657          1HG2      ILE 657  20.542  -9.375 -15.114
  124   HG22  ILE 657          2HG2      ILE 657  22.014 -10.142 -14.520
  125   HG23  ILE 657          3HG2      ILE 657  20.437 -10.774 -14.043
  126   HD11  ILE 657          3HD1      ILE 657  18.957  -8.457 -10.964
  127   HD12  ILE 657          1HD1      ILE 657  18.458  -9.300 -12.430
  128   HD13  ILE 657          2HD1      ILE 657  18.603 -10.184 -10.912
  129    H    ASP 658           H        ASP 658  21.048  -6.259 -12.626
  130    HA   ASP 658           HA       ASP 658  22.277  -4.879 -10.552
  131    HB2  ASP 658           2HB      ASP 658  19.972  -4.566 -12.156
  132    HB3  ASP 658           1HB      ASP 658  19.428  -4.444 -10.486
  133    HA   PRO 659           HA       PRO 659  21.717  -7.792  -7.255
  134    HB2  PRO 659           2HB      PRO 659  22.178  -5.337  -5.621
  135    HB3  PRO 659           1HB      PRO 659  22.955  -6.923  -5.519
  136    HG2  PRO 659           2HG      PRO 659  24.227  -4.878  -6.639
  137    HG3  PRO 659           1HG      PRO 659  24.347  -6.503  -7.335
  138    HD2  PRO 659           2HD      PRO 659  22.772  -4.151  -8.272
  139    HD3  PRO 659           1HD      PRO 659  23.598  -5.407  -9.215
  140    H    GLY 660           H        GLY 660  20.268  -4.581  -6.838
  141    HA2  GLY 660           1HA      GLY 660  17.645  -5.557  -6.533
  142    HA3  GLY 660           2HA      GLY 660  18.350  -5.274  -4.948
  143    H    ALA 661           H        ALA 661  18.666  -3.505  -8.005
  144    HA   ALA 661           HA       ALA 661  18.333  -1.019  -6.563
  145    HB1  ALA 661           1HB      ALA 661  19.232   0.041  -8.397
  146    HB2  ALA 661           2HB      ALA 661  19.988  -1.549  -8.511
  147    HB3  ALA 661           3HB      ALA 661  18.604  -1.152  -9.532
  148    H    ASP 662           H        ASP 662  16.412  -3.143  -8.461
  149    HA   ASP 662           HA       ASP 662  14.384  -1.068  -8.873
  150    HB2  ASP 662           2HB      ASP 662  15.049  -2.418 -10.854
  151    HB3  ASP 662           1HB      ASP 662  14.474  -3.863 -10.026
  152    H    LEU 663           H        LEU 663  12.954  -0.899  -7.304
  153    HA   LEU 663           HA       LEU 663  11.988  -3.365  -6.013
  154    HB2  LEU 663           2HB      LEU 663  12.725  -0.862  -4.951
  155    HB3  LEU 663           1HB      LEU 663  10.980  -0.945  -4.815
  156    HG   LEU 663           HG       LEU 663  11.230  -3.125  -3.628
  157   HD11  LEU 663          1HD1      LEU 663  13.833  -3.011  -4.588
  158   HD12  LEU 663          2HD1      LEU 663  13.983  -2.709  -2.858
  159   HD13  LEU 663          3HD1      LEU 663  13.180  -4.171  -3.430
  160   HD21  LEU 663          3HD2      LEU 663  10.851  -1.548  -2.062
  161   HD22  LEU 663          1HD2      LEU 663  12.520  -1.908  -1.620
  162   HD23  LEU 663          2HD2      LEU 663  12.157  -0.510  -2.632
  163    H    SER 664           H        SER 664  11.314  -1.478  -8.525
  164    HA   SER 664           HA       SER 664   8.541  -0.948  -8.263
  165    HB2  SER 664           2HB      SER 664   9.498  -1.338 -10.996
  166    HB3  SER 664           1HB      SER 664   8.841   0.112 -10.232
  167    HG   SER 664           HG       SER 664  11.453  -0.617 -10.673
  168    H    GLN 665           H        GLN 665  10.428  -3.693  -9.288
  169    HA   GLN 665           HA       GLN 665   8.299  -5.197 -10.420
  170    HB2  GLN 665           2HB      GLN 665  10.670  -5.706 -10.834
  171    HB3  GLN 665           1HB      GLN 665  10.875  -6.140  -9.144
  172    HG2  GLN 665           2HG      GLN 665  10.678  -8.117 -10.520
  173    HG3  GLN 665           1HG      GLN 665   9.304  -7.987  -9.421
  174   HE21  GLN 665          1HE2      GLN 665   7.268  -7.528 -10.249
  175   HE22  GLN 665          2HE2      GLN 665   6.906  -7.684 -11.935
  176    H    TYR 666           H        TYR 666   9.294  -4.514  -7.192
  177    HA   TYR 666           HA       TYR 666   7.594  -6.630  -6.082
  178    HB2  TYR 666           2HB      TYR 666   9.549  -4.762  -4.721
  179    HB3  TYR 666           1HB      TYR 666   8.639  -6.040  -3.925
  180    HD1  TYR 666           2HD      TYR 666   8.924  -8.407  -5.315
  181    HD2  TYR 666           1HD      TYR 666  11.765  -5.249  -5.060
  182    HE1  TYR 666           2HE      TYR 666  10.731 -10.003  -5.785
  183    HE2  TYR 666           1HE      TYR 666  13.583  -6.838  -5.531
  184    HH   TYR 666           HH       TYR 666  13.775  -9.148  -6.714
  185    H    LYS 667           H        LYS 667   7.246  -3.590  -7.153
  186    HA   LYS 667           HA       LYS 667   5.958  -2.305  -4.949
  187    HB2  LYS 667           2HB      LYS 667   6.946  -1.515  -7.453
  188    HB3  LYS 667           1HB      LYS 667   5.214  -1.213  -7.511
  189    HG2  LYS 667           2HG      LYS 667   6.593  -0.308  -5.075
  190    HG3  LYS 667           1HG      LYS 667   7.003   0.545  -6.567
  191    HD2  LYS 667           2HD      LYS 667   4.227   0.278  -6.622
  192    HD3  LYS 667           1HD      LYS 667   4.609   0.696  -4.951
  193    HE2  LYS 667           2HE      LYS 667   5.699   2.690  -5.598
  194    HE3  LYS 667           1HE      LYS 667   5.735   2.207  -7.294
  195    HZ1  LYS 667           3HZ      LYS 667   3.269   2.812  -5.747
  196    HZ2  LYS 667           1HZ      LYS 667   3.349   2.429  -7.400
  197    HZ3  LYS 667           2HZ      LYS 667   4.023   3.875  -6.833
  198    H    MET 668           H        MET 668   3.905  -2.348  -4.368
  199    HA   MET 668           HA       MET 668   1.983  -3.745  -6.091
  200    HB2  MET 668           2HB      MET 668   2.434  -3.681  -3.256
  201    HB3  MET 668           1HB      MET 668   0.818  -3.073  -3.593
  202    HG2  MET 668           2HG      MET 668   0.512  -5.156  -5.025
  203    HG3  MET 668           1HG      MET 668   1.977  -5.758  -4.248
  204    HE1  MET 668           3HE      MET 668   0.978  -6.071  -0.535
  205    HE2  MET 668           1HE      MET 668   2.023  -6.767  -1.773
  206    HE3  MET 668           2HE      MET 668   2.062  -5.034  -1.459
  207    H    ASP 669           H        ASP 669   1.656  -2.019  -7.536
  208    HA   ASP 669           HA       ASP 669   0.990   0.595  -6.588
  209    HB2  ASP 669           2HB      ASP 669   1.831  -0.413  -9.012
  210    HB3  ASP 669           1HB      ASP 669   0.152   0.019  -9.326
  211    H    VAL 670           H        VAL 670  -0.865   1.261  -5.857
  212    HA   VAL 670           HA       VAL 670  -3.116  -0.549  -5.881
  213    HB   VAL 670           HB       VAL 670  -3.202   2.154  -4.598
  214   HG11  VAL 670          1HG1      VAL 670  -5.014   1.338  -3.611
  215   HG12  VAL 670          2HG1      VAL 670  -4.869  -0.080  -4.652
  216   HG13  VAL 670          3HG1      VAL 670  -4.134  -0.086  -3.049
  217   HG21  VAL 670          3HG2      VAL 670  -2.193   0.065  -2.843
  218   HG22  VAL 670          1HG2      VAL 670  -1.069   0.468  -4.140
  219   HG23  VAL 670          2HG2      VAL 670  -1.648   1.728  -3.050
  220    H    THR 671           H        THR 671  -4.734  -0.447  -7.244
  221    HA   THR 671           HA       THR 671  -5.250   2.035  -8.718
  222    HB   THR 671           HB       THR 671  -6.861  -0.399  -9.314
  223    HG1  THR 671           1HG      THR 671  -4.117  -0.439  -9.184
  224   HG21  THR 671          3HG2      THR 671  -7.237   0.953 -11.063
  225   HG22  THR 671          1HG2      THR 671  -5.609   0.544 -11.605
  226   HG23  THR 671          2HG2      THR 671  -5.878   1.998 -10.641
  227    H    VAL 672           H        VAL 672  -7.202   3.159  -8.486
  228    HA   VAL 672           HA       VAL 672  -8.717   2.392  -6.106
  229    HB   VAL 672           HB       VAL 672  -7.787   4.761  -6.480
  230   HG11  VAL 672          1HG1      VAL 672 -10.251   4.962  -8.210
  231   HG12  VAL 672          2HG1      VAL 672  -9.222   6.303  -7.707
  232   HG13  VAL 672          3HG1      VAL 672  -8.583   5.053  -8.779
  233   HG21  VAL 672          3HG2      VAL 672 -10.525   4.031  -5.547
  234   HG22  VAL 672          1HG2      VAL 672  -9.125   4.580  -4.623
  235   HG23  VAL 672          2HG2      VAL 672 -10.055   5.731  -5.584
  236    H    ILE 673           H        ILE 673 -10.892   1.979  -6.095
  237    HA   ILE 673           HA       ILE 673 -12.112   1.589  -8.741
  238    HB   ILE 673           HB       ILE 673 -12.534   0.184  -6.113
  239   HG12  ILE 673          2HG1      ILE 673 -12.460  -1.685  -8.111
  240   HG13  ILE 673          1HG1      ILE 673 -11.390  -0.443  -8.751
  241   HG21  ILE 673          1HG2      ILE 673 -14.729   0.870  -7.202
  242   HG22  ILE 673          2HG2      ILE 673 -14.300  -0.239  -8.506
  243   HG23  ILE 673          3HG2      ILE 673 -14.508  -0.849  -6.865
  244   HD11  ILE 673          3HD1      ILE 673  -9.911  -0.638  -6.950
  245   HD12  ILE 673          1HD1      ILE 673 -11.081  -1.528  -5.976
  246   HD13  ILE 673          2HD1      ILE 673 -10.339  -2.295  -7.381
  247    H    ASP 674           H        ASP 674 -13.689   2.878  -9.316
  248    HA   ASP 674           HA       ASP 674 -14.774   4.803  -7.467
  249    HB2  ASP 674           2HB      ASP 674 -14.460   5.850  -9.483
  250    HB3  ASP 674           1HB      ASP 674 -14.780   4.391 -10.412
  251    H    THR 675           H        THR 675 -16.526   4.493  -6.300
  252    HA   THR 675           HA       THR 675 -18.527   2.529  -7.183
  253    HB   THR 675           HB       THR 675 -18.776   3.598  -4.453
  254    HG1  THR 675           1HG      THR 675 -16.960   2.197  -3.765
  255   HG21  THR 675          3HG2      THR 675 -20.030   1.742  -4.482
  256   HG22  THR 675          1HG2      THR 675 -18.517   0.842  -4.371
  257   HG23  THR 675          2HG2      THR 675 -19.249   1.145  -5.947
  258    H    LYS 676           H        LYS 676 -20.355   3.322  -8.007
  259    HA   LYS 676           HA       LYS 676 -20.910   6.172  -7.616
  260    HB2  LYS 676           2HB      LYS 676 -20.716   4.877  -9.913
  261    HB3  LYS 676           1HB      LYS 676 -22.405   4.514  -9.590
  262    HG2  LYS 676           2HG      LYS 676 -22.598   6.428 -10.819
  263    HG3  LYS 676           1HG      LYS 676 -22.571   7.089  -9.182
  264    HD2  LYS 676           2HD      LYS 676 -20.973   8.429 -10.051
  265    HD3  LYS 676           1HD      LYS 676 -19.936   7.043  -9.703
  266    HE2  LYS 676           2HE      LYS 676 -19.620   6.580 -11.875
  267    HE3  LYS 676           1HE      LYS 676 -21.307   6.897 -12.282
  268    HZ1  LYS 676           3HZ      LYS 676 -20.158   8.550 -13.385
  269    HZ2  LYS 676           1HZ      LYS 676 -19.059   8.800 -12.121
  270    HZ3  LYS 676           2HZ      LYS 676 -20.657   9.343 -11.969
  271    H    ASP 677           H        ASP 677 -22.399   2.997  -7.221
  272    HA   ASP 677           HA       ASP 677 -24.952   4.140  -6.604
  273    HB2  ASP 677           2HB      ASP 677 -25.748   1.917  -6.354
  274    HB3  ASP 677           1HB      ASP 677 -24.626   1.883  -7.708
  275    H    GLY 678           H        GLY 678 -25.835   2.742  -4.486
  276    HA2  GLY 678           1HA      GLY 678 -25.843   2.749  -2.170
  277    HA3  GLY 678           2HA      GLY 678 -24.137   3.183  -2.211
  278    H    SER 679           H        SER 679 -23.647   5.467  -2.831
  279    HA   SER 679           HA       SER 679 -25.269   7.192  -1.192
  280    HB2  SER 679           2HB      SER 679 -23.341   8.776  -2.409
  281    HB3  SER 679           1HB      SER 679 -23.207   7.992  -0.837
  282    HG   SER 679           HG       SER 679 -21.458   7.321  -1.988
  283    H    GLN 680           H        GLN 680 -24.363   7.079  -4.641
  284    HA   GLN 680           HA       GLN 680 -26.054   9.374  -5.194
  285    HB2  GLN 680           2HB      GLN 680 -23.831   8.072  -6.494
  286    HB3  GLN 680           1HB      GLN 680 -25.162   8.280  -7.624
  287    HG2  GLN 680           2HG      GLN 680 -25.181  10.621  -7.321
  288    HG3  GLN 680           1HG      GLN 680 -24.104  10.520  -5.928
  289   HE21  GLN 680          1HE2      GLN 680 -21.993   9.260  -6.535
  290   HE22  GLN 680          2HE2      GLN 680 -21.215   9.838  -7.970
  291    H    SER 681           H        SER 681 -27.630   7.469  -4.207
  292    HA   SER 681           HA       SER 681 -28.815   5.886  -6.319
  293    HB2  SER 681           2HB      SER 681 -30.545   5.819  -4.159
  294    HB3  SER 681           1HB      SER 681 -29.229   4.679  -4.448
  295    HG   SER 681           HG       SER 681 -28.158   5.527  -2.831
  296    H    LYS 682           H        LYS 682 -29.086   9.028  -5.108
  297    HA   LYS 682           HA       LYS 682 -31.868   9.466  -5.649
  298    HB2  LYS 682           2HB      LYS 682 -30.618  10.746  -3.940
  299    HB3  LYS 682           1HB      LYS 682 -29.616  11.439  -5.206
  300    HG2  LYS 682           2HG      LYS 682 -31.211  13.071  -4.628
  301    HG3  LYS 682           1HG      LYS 682 -31.714  12.412  -6.186
  302    HD2  LYS 682           2HD      LYS 682 -33.165  10.812  -4.753
  303    HD3  LYS 682           1HD      LYS 682 -32.914  12.001  -3.473
  304    HE2  LYS 682           2HE      LYS 682 -33.591  13.518  -5.695
  305    HE3  LYS 682           1HE      LYS 682 -34.652  12.112  -5.788
  306    HZ1  LYS 682           3HZ      LYS 682 -35.364  12.540  -3.520
  307    HZ2  LYS 682           1HZ      LYS 682 -35.652  13.890  -4.504
  308    HZ3  LYS 682           2HZ      LYS 682 -34.341  13.892  -3.429
  309    H    LEU 683           H        LEU 683 -29.022   9.379  -7.524
  310    HA   LEU 683           HA       LEU 683 -29.995  11.214  -9.554
  311    HB2  LEU 683           2HB      LEU 683 -27.472   9.626  -9.209
  312    HB3  LEU 683           1HB      LEU 683 -27.854  10.390 -10.739
  313    HG   LEU 683           HG       LEU 683 -26.963  11.603  -8.190
  314   HD11  LEU 683          1HD1      LEU 683 -26.406  11.760 -11.073
  315   HD12  LEU 683          2HD1      LEU 683 -26.251  13.269 -10.175
  316   HD13  LEU 683          3HD1      LEU 683 -25.310  11.857  -9.692
  317   HD21  LEU 683          3HD2      LEU 683 -28.022  13.691  -8.514
  318   HD22  LEU 683          1HD2      LEU 683 -28.693  13.192 -10.068
  319   HD23  LEU 683          2HD2      LEU 683 -29.302  12.480  -8.574
  320    H    GLY 684           H        GLY 684 -31.814  10.243 -10.398
  321    HA2  GLY 684           1HA      GLY 684 -32.269   9.082 -12.537
  322    HA3  GLY 684           2HA      GLY 684 -31.307   7.753 -11.906
  323    H    GLY 685           H        GLY 685 -32.682   6.108 -11.659
  324    HA2  GLY 685           1HA      GLY 685 -34.336   5.799  -9.533
  325    HA3  GLY 685           2HA      GLY 685 -35.385   6.538 -10.735
  326    H    GLY 901           H        GLY 901 -35.721   5.423 -12.746
  327    HA2  GLY 901           1HA      GLY 901 -35.933   3.538 -14.077
  328    HA3  GLY 901           2HA      GLY 901 -34.848   2.684 -12.987
  329    H    GLY 902           H        GLY 902 -37.907   4.335 -12.309
  330    HA2  GLY 902           1HA      GLY 902 -39.875   3.581 -11.415
  331    HA3  GLY 902           2HA      GLY 902 -39.527   2.036 -12.176
  332    H    SER 903           H        SER 903 -38.775   0.372 -10.967
  333    HA   SER 903           HA       SER 903 -38.979   0.654  -8.094
  334    HB2  SER 903           2HB      SER 903 -38.153  -1.929  -9.283
  335    HB3  SER 903           1HB      SER 903 -39.413  -1.586  -8.094
  336    HG   SER 903           HG       SER 903 -40.724  -0.811  -9.785
  337    H    GLY 904           H        GLY 904 -36.548   0.729 -10.454
  338    HA2  GLY 904           1HA      GLY 904 -34.423   1.551  -9.187
  339    HA3  GLY 904           2HA      GLY 904 -34.452  -0.100  -8.579
  340    H    GLY 905           H        GLY 905 -33.596   1.959 -11.171
  341    HA2  GLY 905           1HA      GLY 905 -33.285   0.072 -13.250
  342    HA3  GLY 905           2HA      GLY 905 -32.395   1.583 -13.101
  343    H    HIS 906           H        HIS 906 -30.941   1.285 -10.880
  344    HA   HIS 906           HA       HIS 906 -29.456  -1.225 -11.244
  345    HB2  HIS 906           2HB      HIS 906 -28.446   1.250 -11.778
  346    HB3  HIS 906           1HB      HIS 906 -27.994   1.065 -10.086
  347    HD1  HIS 906           1HD      HIS 906 -25.486   1.055 -11.198
  348    HD2  HIS 906           2HD      HIS 906 -27.889  -2.271 -11.869
  349    HE1  HIS 906           1HE      HIS 906 -23.941  -0.803 -11.950
  350    H    MET 907           H        MET 907 -29.286  -2.456  -9.477
  351    HA   MET 907           HA       MET 907 -30.655  -1.703  -7.097
  352    HB2  MET 907           2HB      MET 907 -28.778  -4.039  -7.269
  353    HB3  MET 907           1HB      MET 907 -30.261  -3.883  -6.338
  354    HG2  MET 907           2HG      MET 907 -31.108  -5.175  -7.955
  355    HG3  MET 907           1HG      MET 907 -31.238  -3.655  -8.837
  356    HE1  MET 907           3HE      MET 907 -27.747  -6.157  -8.494
  357    HE2  MET 907           1HE      MET 907 -29.350  -6.644  -7.943
  358    HE3  MET 907           2HE      MET 907 -28.716  -7.262  -9.469
  359    H    GLY 908           H        GLY 908 -29.851  -0.314  -5.687
  360    HA2  GLY 908           1HA      GLY 908 -27.086   0.257  -5.396
  361    HA3  GLY 908           2HA      GLY 908 -28.368   0.769  -4.303
  362    H    SER 909           H        SER 909 -25.585  -0.494  -4.000
  363    HA   SER 909           HA       SER 909 -26.059  -3.072  -2.850
  364    HB2  SER 909           2HB      SER 909 -23.593  -1.433  -2.357
  365    HB3  SER 909           1HB      SER 909 -23.746  -3.180  -2.538
  366    HG   SER 909           HG       SER 909 -24.025  -1.204  -4.572
  367    H    GLY 910           H        GLY 910 -27.850  -1.848  -1.478
  368    HA2  GLY 910           1HA      GLY 910 -26.854  -0.626   0.952
  369    HA3  GLY 910           2HA      GLY 910 -28.531  -0.986   0.572
  370    H    GLY 911           H        GLY 911 -25.860  -1.876   2.397
  371    HA2  GLY 911           1HA      GLY 911 -25.462  -3.581   3.883
  372    HA3  GLY 911           2HA      GLY 911 -27.195  -3.866   3.849
  373    H    LEU  18           H        LEU  18 -25.129  -4.128   1.029
  374    HA   LEU  18           HA       LEU  18 -25.998  -6.906   0.780
  375    HB2  LEU  18           2HB      LEU  18 -25.375  -4.731  -1.077
  376    HB3  LEU  18           1HB      LEU  18 -24.696  -6.273  -1.562
  377    HG   LEU  18           HG       LEU  18 -26.683  -6.605  -2.562
  378   HD11  LEU  18          1HD1      LEU  18 -28.520  -7.405  -0.998
  379   HD12  LEU  18          2HD1      LEU  18 -26.973  -8.246  -0.904
  380   HD13  LEU  18          3HD1      LEU  18 -27.402  -7.050   0.320
  381   HD21  LEU  18          3HD2      LEU  18 -27.334  -4.295  -2.363
  382   HD22  LEU  18          1HD2      LEU  18 -28.725  -5.323  -2.011
  383   HD23  LEU  18          2HD2      LEU  18 -27.845  -4.547  -0.692
  384    H    SER  19           H        SER  19 -23.969  -7.694  -1.067
  385    HA   SER  19           HA       SER  19 -21.875  -8.357   0.818
  386    HB2  SER  19           2HB      SER  19 -21.398  -9.464  -1.763
  387    HB3  SER  19           1HB      SER  19 -21.941 -10.295  -0.304
  388    HG   SER  19           HG       SER  19 -23.478 -10.582  -1.921
  389    H    TRP  20           H        TRP  20 -22.415  -6.274  -1.857
  390    HA   TRP  20           HA       TRP  20 -21.135  -4.765  -2.974
  391    HB2  TRP  20           2HB      TRP  20 -19.191  -4.907  -0.675
  392    HB3  TRP  20           1HB      TRP  20 -19.558  -3.529  -1.709
  393    HD1  TRP  20           HD       TRP  20 -22.546  -3.151  -1.508
  394    HE1  TRP  20           1HE      TRP  20 -23.741  -2.626   0.701
  395    HE3  TRP  20           3HE      TRP  20 -19.027  -4.908   1.738
  396    HZ2  TRP  20           2HZ      TRP  20 -23.277  -2.935   3.453
  397    HZ3  TRP  20           3HZ      TRP  20 -19.479  -4.756   4.152
  398    HH2  TRP  20           HH       TRP  20 -21.558  -3.785   4.992
  399    H    LYS  21           H        LYS  21 -18.101  -5.396  -1.716
  400    HA   LYS  21           HA       LYS  21 -17.463  -7.232  -3.914
  401    HB2  LYS  21           2HB      LYS  21 -16.423  -4.612  -3.425
  402    HB3  LYS  21           1HB      LYS  21 -15.130  -5.783  -3.195
  403    HG2  LYS  21           2HG      LYS  21 -14.950  -5.276  -5.433
  404    HG3  LYS  21           1HG      LYS  21 -15.929  -6.744  -5.462
  405    HD2  LYS  21           2HD      LYS  21 -17.897  -4.968  -5.305
  406    HD3  LYS  21           1HD      LYS  21 -16.682  -3.939  -6.064
  407    HE2  LYS  21           2HE      LYS  21 -16.379  -5.930  -7.695
  408    HE3  LYS  21           1HE      LYS  21 -17.956  -6.442  -7.095
  409    HZ1  LYS  21           3HZ      LYS  21 -17.376  -3.786  -8.291
  410    HZ2  LYS  21           1HZ      LYS  21 -18.897  -4.355  -7.791
  411    HZ3  LYS  21           2HZ      LYS  21 -18.110  -5.079  -9.109
  412    H    ARG  22           H        ARG  22 -16.695  -9.100  -3.257
  413    HA   ARG  22           HA       ARG  22 -16.185  -9.697  -0.551
  414    HB2  ARG  22           2HB      ARG  22 -16.696 -11.188  -2.753
  415    HB3  ARG  22           1HB      ARG  22 -14.965 -11.447  -2.604
  416    HG2  ARG  22           2HG      ARG  22 -16.658 -11.783  -0.182
  417    HG3  ARG  22           1HG      ARG  22 -16.690 -13.036  -1.425
  418    HD2  ARG  22           2HD      ARG  22 -14.048 -12.023  -0.514
  419    HD3  ARG  22           1HD      ARG  22 -14.946 -13.086   0.568
  420    HE   ARG  22           HE       ARG  22 -15.007 -14.385  -1.825
  421   HH11  ARG  22          2HH1      ARG  22 -12.397 -13.064   0.116
  422   HH12  ARG  22          1HH1      ARG  22 -11.255 -14.288  -0.373
  423   HH21  ARG  22          2HH2      ARG  22 -13.510 -15.963  -2.478
  424   HH22  ARG  22          1HH2      ARG  22 -11.888 -15.934  -1.840
  425    H    CYS  23           H        CYS  23 -14.394  -9.534   0.644
  426    HA   CYS  23           HA       CYS  23 -12.038  -8.440  -0.664
  427    HB2  CYS  23           2HB      CYS  23 -11.487  -7.454   1.349
  428    HB3  CYS  23           1HB      CYS  23 -13.242  -7.445   1.404
  429    H    ALA  24           H        ALA  24  -9.892  -9.196  -0.028
  430    HA   ALA  24           HA       ALA  24  -9.939 -12.083  -0.341
  431    HB1  ALA  24           1HB      ALA  24  -8.695 -10.598  -1.896
  432    HB2  ALA  24           2HB      ALA  24  -7.572 -10.244  -0.581
  433    HB3  ALA  24           3HB      ALA  24  -7.727 -11.892  -1.192
  434    H    GLY  25           H        GLY  25  -8.456  -9.717   1.861
  435    HA2  GLY  25           1HA      GLY  25  -6.777 -11.597   3.177
  436    HA3  GLY  25           2HA      GLY  25  -7.191  -9.991   3.758
  437    H    CYS  26           H        CYS  26  -9.436  -9.798   4.721
  438    HA   CYS  26           HA       CYS  26  -9.860 -11.682   6.751
  439    HB2  CYS  26           2HB      CYS  26 -12.200 -10.089   5.866
  440    HB3  CYS  26           1HB      CYS  26 -11.533 -10.305   7.477
  441    H    GLY  27           H        GLY  27 -11.495 -11.182   3.654
  442    HA2  GLY  27           1HA      GLY  27 -12.356 -12.939   2.312
  443    HA3  GLY  27           2HA      GLY  27 -12.422 -13.963   3.746
  444    H    GLY  28           H        GLY  28 -13.570 -10.657   3.491
  445    HA2  GLY  28           1HA      GLY  28 -16.315 -11.682   3.859
  446    HA3  GLY  28           2HA      GLY  28 -15.688 -10.323   4.782
  447    H    LYS  29           H        LYS  29 -16.239  -8.403   4.066
  448    HA   LYS  29           HA       LYS  29 -16.564  -7.971   1.198
  449    HB2  LYS  29           2HB      LYS  29 -18.660  -6.512   2.289
  450    HB3  LYS  29           1HB      LYS  29 -18.798  -7.986   1.343
  451    HG2  LYS  29           2HG      LYS  29 -18.635  -9.265   3.494
  452    HG3  LYS  29           1HG      LYS  29 -18.759  -7.722   4.338
  453    HD2  LYS  29           2HD      LYS  29 -20.823  -7.927   2.353
  454    HD3  LYS  29           1HD      LYS  29 -20.855  -9.343   3.407
  455    HE2  LYS  29           2HE      LYS  29 -20.943  -7.899   5.367
  456    HE3  LYS  29           1HE      LYS  29 -20.848  -6.471   4.337
  457    HZ1  LYS  29           3HZ      LYS  29 -23.071  -8.430   4.499
  458    HZ2  LYS  29           1HZ      LYS  29 -22.956  -7.236   3.294
  459    HZ3  LYS  29           2HZ      LYS  29 -23.099  -6.787   4.925
  460    H    ILE  30           H        ILE  30 -15.929  -6.002   0.535
  461    HA   ILE  30           HA       ILE  30 -14.498  -4.350   2.361
  462    HB   ILE  30           HB       ILE  30 -15.233  -3.944  -0.540
  463   HG12  ILE  30          2HG1      ILE  30 -12.423  -4.246   0.256
  464   HG13  ILE  30          1HG1      ILE  30 -13.419  -5.657   0.605
  465   HG21  ILE  30          1HG2      ILE  30 -14.776  -1.845   0.960
  466   HG22  ILE  30          2HG2      ILE  30 -13.096  -2.366   0.806
  467   HG23  ILE  30          3HG2      ILE  30 -14.036  -1.988  -0.638
  468   HD11  ILE  30          3HD1      ILE  30 -13.349  -4.341  -2.091
  469   HD12  ILE  30          1HD1      ILE  30 -12.260  -5.648  -1.620
  470   HD13  ILE  30          2HD1      ILE  30 -14.001  -5.924  -1.664
  471    H    ALA  31           H        ALA  31 -15.517  -3.166   3.798
  472    HA   ALA  31           HA       ALA  31 -17.970  -1.752   3.024
  473    HB1  ALA  31           1HB      ALA  31 -18.700  -2.615   4.950
  474    HB2  ALA  31           2HB      ALA  31 -17.071  -3.043   5.470
  475    HB3  ALA  31           3HB      ALA  31 -17.681  -1.412   5.743
  476    H    ASP  32           H        ASP  32 -15.086  -1.066   2.495
  477    HA   ASP  32           HA       ASP  32 -14.687   1.378   4.019
  478    HB2  ASP  32           2HB      ASP  32 -13.055  -0.357   2.361
  479    HB3  ASP  32           1HB      ASP  32 -12.839   1.338   1.945
  480    H    ARG  33           H        ARG  33 -16.729   0.673   1.678
  481    HA   ARG  33           HA       ARG  33 -17.938   1.867   0.171
  482    HB2  ARG  33           2HB      ARG  33 -17.122   3.828   1.850
  483    HB3  ARG  33           1HB      ARG  33 -16.349   4.358   0.362
  484    HG2  ARG  33           2HG      ARG  33 -18.655   4.070  -0.713
  485    HG3  ARG  33           1HG      ARG  33 -19.265   4.020   0.943
  486    HD2  ARG  33           2HD      ARG  33 -17.459   6.195   0.748
  487    HD3  ARG  33           1HD      ARG  33 -18.558   6.284  -0.628
  488    HE   ARG  33           HE       ARG  33 -20.397   6.327   0.947
  489   HH11  ARG  33          2HH1      ARG  33 -17.205   6.923   2.268
  490   HH12  ARG  33          1HH1      ARG  33 -17.811   7.712   3.689
  491   HH21  ARG  33          2HH2      ARG  33 -21.182   7.395   2.810
  492   HH22  ARG  33          1HH2      ARG  33 -20.051   7.998   3.994
  493    H    PHE  34           H        PHE  34 -14.635   3.185  -0.093
  494    HA   PHE  34           HA       PHE  34 -14.594   2.371  -2.916
  495    HB2  PHE  34           2HB      PHE  34 -13.222   4.496  -1.341
  496    HB3  PHE  34           1HB      PHE  34 -12.310   3.766  -2.658
  497    HD1  PHE  34           2HD      PHE  34 -15.884   4.775  -2.238
  498    HD2  PHE  34           1HD      PHE  34 -12.294   5.133  -4.500
  499    HE1  PHE  34           2HE      PHE  34 -17.046   6.228  -3.849
  500    HE2  PHE  34           1HE      PHE  34 -13.452   6.585  -6.112
  501    HZ   PHE  34           HZ       PHE  34 -15.827   7.130  -5.794
  502    H    LEU  35           H        LEU  35 -13.369   0.685  -3.535
  503    HA   LEU  35           HA       LEU  35 -11.828  -0.637  -1.435
  504    HB2  LEU  35           2HB      LEU  35 -11.806  -2.447  -3.430
  505    HB3  LEU  35           1HB      LEU  35 -13.045  -2.360  -2.195
  506    HG   LEU  35           HG       LEU  35 -13.506  -0.757  -4.646
  507   HD11  LEU  35          1HD1      LEU  35 -12.810  -2.597  -5.839
  508   HD12  LEU  35          2HD1      LEU  35 -13.318  -3.735  -4.591
  509   HD13  LEU  35          3HD1      LEU  35 -14.522  -2.946  -5.610
  510   HD21  LEU  35          3HD2      LEU  35 -15.219  -2.510  -2.890
  511   HD22  LEU  35          1HD2      LEU  35 -15.153  -0.748  -2.889
  512   HD23  LEU  35          2HD2      LEU  35 -15.803  -1.605  -4.287
  513    H    LEU  36           H        LEU  36  -9.810  -1.699  -2.009
  514    HA   LEU  36           HA       LEU  36  -8.223   0.047  -3.762
  515    HB2  LEU  36           2HB      LEU  36  -7.537  -1.518  -1.283
  516    HB3  LEU  36           1HB      LEU  36  -6.303  -0.875  -2.347
  517    HG   LEU  36           HG       LEU  36  -6.408   0.749  -0.732
  518   HD11  LEU  36          1HD1      LEU  36  -6.873   2.577  -1.920
  519   HD12  LEU  36          2HD1      LEU  36  -7.352   1.454  -3.195
  520   HD13  LEU  36          3HD1      LEU  36  -8.571   2.131  -2.112
  521   HD21  LEU  36          3HD2      LEU  36  -8.015   0.882   0.786
  522   HD22  LEU  36          1HD2      LEU  36  -9.224   1.275  -0.436
  523   HD23  LEU  36          2HD2      LEU  36  -8.844  -0.409  -0.081
  524    H    TYR  37           H        TYR  37  -7.114  -0.791  -5.404
  525    HA   TYR  37           HA       TYR  37  -7.199  -3.689  -5.856
  526    HB2  TYR  37           2HB      TYR  37  -7.567  -1.439  -7.500
  527    HB3  TYR  37           1HB      TYR  37  -6.027  -2.130  -7.987
  528    HD1  TYR  37           2HD      TYR  37  -7.384  -4.973  -6.967
  529    HD2  TYR  37           1HD      TYR  37  -8.166  -1.982  -9.881
  530    HE1  TYR  37           2HE      TYR  37  -8.565  -6.632  -8.341
  531    HE2  TYR  37           1HE      TYR  37  -9.343  -3.617 -11.263
  532    HH   TYR  37           HH       TYR  37  -9.233  -7.008 -10.617
  533    H    ALA  38           H        ALA  38  -5.474  -4.594  -4.812
  534    HA   ALA  38           HA       ALA  38  -2.836  -3.388  -5.305
  535    HB1  ALA  38           1HB      ALA  38  -3.394  -3.659  -2.944
  536    HB2  ALA  38           2HB      ALA  38  -3.641  -5.387  -3.192
  537    HB3  ALA  38           3HB      ALA  38  -2.033  -4.687  -3.397
  538    H    MET  39           H        MET  39  -2.712  -6.603  -4.244
  539    HA   MET  39           HA       MET  39  -1.563  -7.422  -6.743
  540    HB2  MET  39           2HB      MET  39  -1.362  -9.675  -5.521
  541    HB3  MET  39           1HB      MET  39  -0.422  -8.321  -4.929
  542    HG2  MET  39           2HG      MET  39  -2.625  -8.061  -3.409
  543    HG3  MET  39           1HG      MET  39  -2.610  -9.805  -3.659
  544    HE1  MET  39           3HE      MET  39  -2.044  -9.487  -0.454
  545    HE2  MET  39           1HE      MET  39  -2.320 -10.709  -1.697
  546    HE3  MET  39           2HE      MET  39  -0.852 -10.763  -0.714
  547    H    ASP  40           H        ASP  40  -3.821  -6.890  -7.695
  548    HA   ASP  40           HA       ASP  40  -5.263  -7.784  -9.212
  549    HB2  ASP  40           2HB      ASP  40  -3.625  -9.648  -9.424
  550    HB3  ASP  40           1HB      ASP  40  -4.476 -10.501  -8.143
  551    H    SER  41           H        SER  41  -5.529  -8.359  -5.869
  552    HA   SER  41           HA       SER  41  -8.262  -9.385  -6.138
  553    HB2  SER  41           2HB      SER  41  -7.361  -9.199  -3.414
  554    HB3  SER  41           1HB      SER  41  -7.772 -10.638  -4.347
  555    HG   SER  41           HG       SER  41  -5.577 -10.363  -5.281
  556    H    TYR  42           H        TYR  42  -9.800  -8.553  -4.403
  557    HA   TYR  42           HA       TYR  42  -9.764  -5.640  -4.435
  558    HB2  TYR  42           2HB      TYR  42 -11.900  -7.551  -3.462
  559    HB3  TYR  42           1HB      TYR  42 -12.075  -5.810  -3.633
  560    HD1  TYR  42           2HD      TYR  42 -11.203  -5.087  -6.202
  561    HD2  TYR  42           1HD      TYR  42 -13.081  -8.717  -5.026
  562    HE1  TYR  42           2HE      TYR  42 -12.047  -5.390  -8.494
  563    HE2  TYR  42           1HE      TYR  42 -13.926  -9.029  -7.311
  564    HH   TYR  42           HH       TYR  42 -12.816  -7.262  -9.959
  565    H    TRP  43           H        TRP  43  -9.323  -4.424  -2.672
  566    HA   TRP  43           HA       TRP  43  -9.299  -5.755  -0.052
  567    HB2  TRP  43           2HB      TRP  43  -7.191  -3.743  -0.835
  568    HB3  TRP  43           1HB      TRP  43  -7.202  -4.830   0.548
  569    HD1  TRP  43           HD       TRP  43  -6.530  -4.807  -3.222
  570    HE1  TRP  43           1HE      TRP  43  -5.155  -6.899  -3.811
  571    HE3  TRP  43           3HE      TRP  43  -6.659  -7.172   1.300
  572    HZ2  TRP  43           2HZ      TRP  43  -4.226  -9.226  -2.529
  573    HZ3  TRP  43           3HZ      TRP  43  -5.503  -9.324   1.541
  574    HH2  TRP  43           HH       TRP  43  -4.312 -10.333  -0.334
  575    H    HIS  44           H        HIS  44  -9.165  -4.173   1.741
  576    HA   HIS  44           HA       HIS  44 -10.204  -1.500   1.131
  577    HB2  HIS  44           2HB      HIS  44 -11.659  -1.682   3.227
  578    HB3  HIS  44           1HB      HIS  44 -12.223  -2.583   1.826
  579    HD1  HIS  44           1HD      HIS  44 -12.345  -3.081   5.240
  580    HD2  HIS  44           2HD      HIS  44 -10.714  -5.324   2.144
  581    HE1  HIS  44           1HE      HIS  44 -12.037  -5.454   6.136
  582    H    SER  45           H        SER  45 -10.276  -0.552   3.792
  583    HA   SER  45           HA       SER  45  -7.483  -0.077   4.083
  584    HB2  SER  45           2HB      SER  45  -9.794   0.718   5.867
  585    HB3  SER  45           1HB      SER  45  -8.150   1.345   5.993
  586    HG   SER  45           HG       SER  45 -10.151   1.924   4.158
  587    H    ARG  46           H        ARG  46  -9.572  -2.449   5.388
  588    HA   ARG  46           HA       ARG  46  -7.724  -2.999   7.594
  589    HB2  ARG  46           2HB      ARG  46 -10.544  -3.257   7.283
  590    HB3  ARG  46           1HB      ARG  46  -9.872  -4.859   7.561
  591    HG2  ARG  46           2HG      ARG  46  -8.616  -3.771   9.518
  592    HG3  ARG  46           1HG      ARG  46  -9.767  -2.445   9.325
  593    HD2  ARG  46           2HD      ARG  46 -10.634  -5.309   9.624
  594    HD3  ARG  46           1HD      ARG  46 -10.371  -4.253  11.012
  595    HE   ARG  46           HE       ARG  46 -12.388  -3.799   8.898
  596   HH11  ARG  46          2HH1      ARG  46 -11.274  -3.458  12.207
  597   HH12  ARG  46          1HH1      ARG  46 -12.705  -2.619  12.730
  598   HH21  ARG  46          2HH2      ARG  46 -14.241  -2.677   9.576
  599   HH22  ARG  46          1HH2      ARG  46 -14.370  -2.125  11.221
  600    H    CYS  47           H        CYS  47  -8.235  -3.905   4.426
  601    HA   CYS  47           HA       CYS  47  -7.098  -6.570   4.851
  602    HB2  CYS  47           2HB      CYS  47  -8.943  -5.501   2.935
  603    HB3  CYS  47           1HB      CYS  47  -7.519  -6.102   2.090
  604    H    LEU  48           H        LEU  48  -6.654  -3.751   2.734
  605    HA   LEU  48           HA       LEU  48  -3.959  -4.465   2.079
  606    HB2  LEU  48           2HB      LEU  48  -5.901  -2.460   1.281
  607    HB3  LEU  48           1HB      LEU  48  -4.310  -1.761   1.489
  608    HG   LEU  48           HG       LEU  48  -5.306  -3.621  -0.577
  609   HD11  LEU  48          1HD1      LEU  48  -4.218  -1.077  -0.451
  610   HD12  LEU  48          2HD1      LEU  48  -2.934  -2.074  -1.138
  611   HD13  LEU  48          3HD1      LEU  48  -4.522  -2.029  -1.905
  612   HD21  LEU  48          3HD2      LEU  48  -3.764  -5.161   0.304
  613   HD22  LEU  48          1HD2      LEU  48  -2.900  -4.352  -1.001
  614   HD23  LEU  48          2HD2      LEU  48  -2.588  -3.902   0.675
  615    H    LYS  49           H        LYS  49  -3.225  -4.699   4.267
  616    HA   LYS  49           HA       LYS  49  -2.107  -2.197   5.272
  617    HB2  LYS  49           2HB      LYS  49  -2.635  -3.179   7.651
  618    HB3  LYS  49           1HB      LYS  49  -3.863  -2.256   6.797
  619    HG2  LYS  49           2HG      LYS  49  -5.158  -3.998   7.407
  620    HG3  LYS  49           1HG      LYS  49  -4.497  -4.706   5.932
  621    HD2  LYS  49           2HD      LYS  49  -2.795  -5.863   7.212
  622    HD3  LYS  49           1HD      LYS  49  -3.355  -5.093   8.697
  623    HE2  LYS  49           2HE      LYS  49  -4.427  -7.099   8.883
  624    HE3  LYS  49           1HE      LYS  49  -5.648  -6.195   7.989
  625    HZ1  LYS  49           3HZ      LYS  49  -3.635  -7.670   6.453
  626    HZ2  LYS  49           1HZ      LYS  49  -5.268  -7.375   6.097
  627    HZ3  LYS  49           2HZ      LYS  49  -4.849  -8.565   7.228
  628    H    CYS  50           H        CYS  50  -0.323  -2.570   6.761
  629    HA   CYS  50           HA       CYS  50   1.390  -4.652   5.924
  630    HB2  CYS  50           2HB      CYS  50   2.174  -2.472   6.810
  631    HB3  CYS  50           1HB      CYS  50   1.571  -2.918   8.401
  632    H    SER  51           H        SER  51   1.656  -6.673   6.683
  633    HA   SER  51           HA       SER  51  -0.182  -7.758   8.562
  634    HB2  SER  51           2HB      SER  51   2.379  -9.034   7.583
  635    HB3  SER  51           1HB      SER  51   0.934  -9.850   8.181
  636    HG   SER  51           HG       SER  51   1.261  -8.407   5.757
  637    H    SER  52           H        SER  52   2.604  -5.978   8.936
  638    HA   SER  52           HA       SER  52   3.180  -7.109  11.585
  639    HB2  SER  52           2HB      SER  52   5.073  -5.113  10.700
  640    HB3  SER  52           1HB      SER  52   5.349  -6.810  11.094
  641    HG   SER  52           HG       SER  52   4.597  -5.677   8.609
  642    H    CYS  53           H        CYS  53   2.711  -4.012   9.879
  643    HA   CYS  53           HA       CYS  53   2.634  -2.523  12.351
  644    HB2  CYS  53           2HB      CYS  53   2.096  -1.755   9.484
  645    HB3  CYS  53           1HB      CYS  53   1.980  -0.618  10.822
  646    H    GLN  54           H        GLN  54   0.331  -3.861  10.097
  647    HA   GLN  54           HA       GLN  54  -1.927  -3.964  10.021
  648    HB2  GLN  54           2HB      GLN  54  -1.744  -3.296  12.968
  649    HB3  GLN  54           1HB      GLN  54  -3.190  -3.867  12.144
  650    HG2  GLN  54           2HG      GLN  54  -0.720  -5.506  11.964
  651    HG3  GLN  54           1HG      GLN  54  -1.618  -5.497  13.478
  652   HE21  GLN  54          1HE2      GLN  54  -4.100  -4.996  11.709
  653   HE22  GLN  54          2HE2      GLN  54  -4.519  -6.594  11.192
  654    H    ALA  55           H        ALA  55  -0.449  -1.474   9.597
  655    HA   ALA  55           HA       ALA  55  -2.421   0.570  10.284
  656    HB1  ALA  55           1HB      ALA  55  -0.643   2.063   9.131
  657    HB2  ALA  55           2HB      ALA  55  -0.284   1.391  10.723
  658    HB3  ALA  55           3HB      ALA  55   0.402   0.649   9.276
  659    H    GLN  56           H        GLN  56  -3.234   1.991   8.609
  660    HA   GLN  56           HA       GLN  56  -4.319   0.501   6.463
  661    HB2  GLN  56           2HB      GLN  56  -4.439   3.321   7.391
  662    HB3  GLN  56           1HB      GLN  56  -4.914   3.000   5.730
  663    HG2  GLN  56           2HG      GLN  56  -6.845   2.980   7.174
  664    HG3  GLN  56           1HG      GLN  56  -6.562   1.372   6.515
  665   HE21  GLN  56          1HE2      GLN  56  -6.271  -0.298   7.882
  666   HE22  GLN  56          2HE2      GLN  56  -6.218  -0.154   9.607
  667    H    LEU  57           H        LEU  57  -2.920  -0.276   5.006
  668    HA   LEU  57           HA       LEU  57  -0.670   1.227   4.053
  669    HB2  LEU  57           2HB      LEU  57  -1.529  -1.492   4.070
  670    HB3  LEU  57           1HB      LEU  57  -1.181  -1.040   2.412
  671    HG   LEU  57           HG       LEU  57   1.065  -0.442   2.981
  672   HD11  LEU  57          1HD1      LEU  57   1.189   0.504   5.040
  673   HD12  LEU  57          2HD1      LEU  57   0.072  -0.655   5.760
  674   HD13  LEU  57          3HD1      LEU  57   1.743  -1.120   5.440
  675   HD21  LEU  57          3HD2      LEU  57   0.245  -2.908   2.744
  676   HD22  LEU  57          1HD2      LEU  57   1.909  -2.556   3.205
  677   HD23  LEU  57          2HD2      LEU  57   0.730  -3.009   4.435
  678    H    GLY  58           H        GLY  58  -3.932   0.797   3.052
  679    HA2  GLY  58           1HA      GLY  58  -3.467   1.550   0.306
  680    HA3  GLY  58           2HA      GLY  58  -5.030   1.365   1.089
  681    H    ASP  59           H        ASP  59  -3.765   3.216   3.257
  682    HA   ASP  59           HA       ASP  59  -4.749   5.649   1.947
  683    HB2  ASP  59           2HB      ASP  59  -5.560   4.539   4.279
  684    HB3  ASP  59           1HB      ASP  59  -4.336   5.655   4.873
  685    H    ILE  60           H        ILE  60  -2.085   4.819   1.438
  686    HA   ILE  60           HA       ILE  60  -0.736   7.216   2.429
  687    HB   ILE  60           HB       ILE  60   1.382   5.479   2.262
  688   HG12  ILE  60          2HG1      ILE  60  -0.615   4.031   3.977
  689   HG13  ILE  60          1HG1      ILE  60  -0.474   3.649   2.262
  690   HG21  ILE  60          1HG2      ILE  60   0.581   7.289   3.982
  691   HG22  ILE  60          2HG2      ILE  60   0.056   5.879   4.898
  692   HG23  ILE  60          3HG2      ILE  60   1.751   6.057   4.448
  693   HD11  ILE  60          3HD1      ILE  60   0.950   2.112   3.149
  694   HD12  ILE  60          1HD1      ILE  60   2.075   3.440   2.858
  695   HD13  ILE  60          2HD1      ILE  60   1.434   3.162   4.479
  696    H    GLY  61           H        GLY  61   0.656   8.164   1.005
  697    HA2  GLY  61           1HA      GLY  61   0.249   7.734  -1.739
  698    HA3  GLY  61           2HA      GLY  61   1.504   8.744  -1.040
  699    H    THR  62           H        THR  62   2.891   6.706   0.380
  700    HA   THR  62           HA       THR  62   4.331   5.461  -1.779
  701    HB   THR  62           HB       THR  62   4.984   4.456   0.867
  702    HG1  THR  62           1HG      THR  62   5.125   7.284   0.457
  703   HG21  THR  62          3HG2      THR  62   6.872   6.259  -0.440
  704   HG22  THR  62          1HG2      THR  62   6.278   4.985  -1.507
  705   HG23  THR  62          2HG2      THR  62   7.061   4.565   0.019
  706    H    SER  63           H        SER  63   3.800   3.579  -2.657
  707    HA   SER  63           HA       SER  63   1.618   2.062  -1.616
  708    HB2  SER  63           2HB      SER  63   3.395   1.104  -3.835
  709    HB3  SER  63           1HB      SER  63   1.648   0.928  -3.651
  710    HG   SER  63           HG       SER  63   1.675   3.349  -3.833
  711    H    SER  64           H        SER  64   1.695  -0.283  -1.291
  712    HA   SER  64           HA       SER  64   3.809  -0.996   0.509
  713    HB2  SER  64           2HB      SER  64   2.081  -3.198  -0.161
  714    HB3  SER  64           1HB      SER  64   2.188  -2.293   1.354
  715    HG   SER  64           HG       SER  64   0.608  -0.969   0.703
  716    H    TYR  65           H        TYR  65   4.783  -3.259   0.302
  717    HA   TYR  65           HA       TYR  65   5.435  -3.862  -2.502
  718    HB2  TYR  65           2HB      TYR  65   7.377  -3.712  -0.188
  719    HB3  TYR  65           1HB      TYR  65   7.771  -4.341  -1.782
  720    HD1  TYR  65           2HD      TYR  65   7.992  -2.833  -3.693
  721    HD2  TYR  65           1HD      TYR  65   7.129  -1.341   0.196
  722    HE1  TYR  65           2HE      TYR  65   8.584  -0.564  -4.435
  723    HE2  TYR  65           1HE      TYR  65   7.718   0.930  -0.535
  724    HH   TYR  65           HH       TYR  65   9.473   1.668  -3.011
  725    H    THR  66           H        THR  66   6.135  -6.050  -2.871
  726    HA   THR  66           HA       THR  66   5.676  -7.922  -0.679
  727    HB   THR  66           HB       THR  66   3.526  -7.580  -2.032
  728    HG1  THR  66           1HG      THR  66   3.506  -9.335  -0.760
  729   HG21  THR  66          3HG2      THR  66   5.304  -8.406  -4.140
  730   HG22  THR  66          1HG2      THR  66   3.637  -7.838  -4.246
  731   HG23  THR  66          2HG2      THR  66   3.972  -9.549  -3.977
  732    H    LYS  67           H        LYS  67   6.209 -10.191  -1.414
  733    HA   LYS  67           HA       LYS  67   7.994 -10.570  -3.595
  734    HB2  LYS  67           2HB      LYS  67   9.354  -9.250  -1.847
  735    HB3  LYS  67           1HB      LYS  67   9.304 -10.716  -0.883
  736    HG2  LYS  67           2HG      LYS  67  10.578 -11.920  -2.448
  737    HG3  LYS  67           1HG      LYS  67  10.344 -10.698  -3.699
  738    HD2  LYS  67           2HD      LYS  67  11.885  -9.259  -2.772
  739    HD3  LYS  67           1HD      LYS  67  11.694  -9.930  -1.151
  740    HE2  LYS  67           2HE      LYS  67  13.503 -11.171  -1.489
  741    HE3  LYS  67           1HE      LYS  67  12.650 -12.015  -2.779
  742    HZ1  LYS  67           3HZ      LYS  67  14.559 -11.212  -3.796
  743    HZ2  LYS  67           1HZ      LYS  67  14.504  -9.720  -2.990
  744    HZ3  LYS  67           2HZ      LYS  67  13.395 -10.061  -4.228
  745    H    SER  68           H        SER  68   7.611 -11.714  -0.259
  746    HA   SER  68           HA       SER  68   7.524 -14.465  -1.158
  747    HB2  SER  68           2HB      SER  68   7.050 -13.803   1.689
  748    HB3  SER  68           1HB      SER  68   8.147 -14.987   0.969
  749    HG   SER  68           HG       SER  68   9.678 -13.496   0.787
  750    H    GLY  69           H        GLY  69   5.290 -12.445  -1.638
  751    HA2  GLY  69           1HA      GLY  69   3.019 -12.715  -1.956
  752    HA3  GLY  69           2HA      GLY  69   3.136 -14.280  -1.164
  753    H    MET  70           H        MET  70   4.332 -11.453   0.427
  754    HA   MET  70           HA       MET  70   2.055 -11.593   2.287
  755    HB2  MET  70           2HB      MET  70   4.985 -11.415   2.735
  756    HB3  MET  70           1HB      MET  70   3.963 -10.474   3.811
  757    HG2  MET  70           2HG      MET  70   2.690 -12.591   4.278
  758    HG3  MET  70           1HG      MET  70   3.951 -13.449   3.395
  759    HE1  MET  70           3HE      MET  70   6.429 -11.696   4.094
  760    HE2  MET  70           1HE      MET  70   7.101 -12.345   5.589
  761    HE3  MET  70           2HE      MET  70   6.630 -13.439   4.288
  762    H    ILE  71           H        ILE  71   1.302  -9.641   3.191
  763    HA   ILE  71           HA       ILE  71   1.903  -7.278   1.563
  764    HB   ILE  71           HB       ILE  71  -0.245  -7.377   3.659
  765   HG12  ILE  71          2HG1      ILE  71  -0.968  -8.033   0.853
  766   HG13  ILE  71          1HG1      ILE  71  -0.209  -9.311   1.799
  767   HG21  ILE  71          1HG2      ILE  71  -0.319  -5.257   2.914
  768   HG22  ILE  71          2HG2      ILE  71   0.514  -5.646   1.409
  769   HG23  ILE  71          3HG2      ILE  71  -1.213  -5.960   1.567
  770   HD11  ILE  71          3HD1      ILE  71  -2.845  -8.899   1.727
  771   HD12  ILE  71          1HD1      ILE  71  -2.008  -9.581   3.123
  772   HD13  ILE  71          2HD1      ILE  71  -2.425  -7.867   3.095
  773    H    LEU  72           H        LEU  72   3.526  -6.095   2.311
  774    HA   LEU  72           HA       LEU  72   3.544  -5.398   5.166
  775    HB2  LEU  72           2HB      LEU  72   6.058  -5.832   3.558
  776    HB3  LEU  72           1HB      LEU  72   5.922  -5.569   5.287
  777    HG   LEU  72           HG       LEU  72   4.650  -7.991   4.079
  778   HD11  LEU  72          1HD1      LEU  72   7.215  -8.689   5.042
  779   HD12  LEU  72          2HD1      LEU  72   6.569  -8.872   3.412
  780   HD13  LEU  72          3HD1      LEU  72   7.421  -7.396   3.861
  781   HD21  LEU  72          3HD2      LEU  72   5.294  -6.970   6.716
  782   HD22  LEU  72          1HD2      LEU  72   4.183  -8.254   6.241
  783   HD23  LEU  72          2HD2      LEU  72   5.893  -8.611   6.466
  784    H    CYS  73           H        CYS  73   4.510  -3.339   5.627
  785    HA   CYS  73           HA       CYS  73   3.872  -1.371   3.672
  786    HB2  CYS  73           2HB      CYS  73   4.587   0.245   5.338
  787    HB3  CYS  73           1HB      CYS  73   3.612  -0.999   6.108
  788    H    ARG  74           H        ARG  74   5.513   0.447   3.220
  789    HA   ARG  74           HA       ARG  74   7.616  -0.620   1.685
  790    HB2  ARG  74           2HB      ARG  74   8.210   1.611   1.151
  791    HB3  ARG  74           1HB      ARG  74   6.465   1.613   1.340
  792    HG2  ARG  74           2HG      ARG  74   6.616   3.231   2.836
  793    HG3  ARG  74           1HG      ARG  74   7.638   2.219   3.858
  794    HD2  ARG  74           2HD      ARG  74   9.163   3.212   1.644
  795    HD3  ARG  74           1HD      ARG  74   8.359   4.553   2.456
  796    HE   ARG  74           HE       ARG  74   9.398   3.658   4.550
  797   HH11  ARG  74          2HH1      ARG  74  10.838   3.042   1.412
  798   HH12  ARG  74          1HH1      ARG  74  12.442   2.831   2.060
  799   HH21  ARG  74          2HH2      ARG  74  11.481   3.351   5.400
  800   HH22  ARG  74          1HH2      ARG  74  12.809   3.009   4.328
  801    H    ASN  75           H        ASN  75   7.436   0.309   4.997
  802    HA   ASN  75           HA       ASN  75  10.296   0.565   5.348
  803    HB2  ASN  75           2HB      ASN  75   7.956   0.596   7.256
  804    HB3  ASN  75           1HB      ASN  75   9.627   0.639   7.816
  805   HD21  ASN  75          1HD2      ASN  75   7.016   2.469   6.995
  806   HD22  ASN  75          2HD2      ASN  75   7.816   3.979   6.693
  807    H    ASP  76           H        ASP  76   7.748  -1.730   6.224
  808    HA   ASP  76           HA       ASP  76   9.423  -3.456   7.705
  809    HB2  ASP  76           2HB      ASP  76   6.651  -3.418   6.846
  810    HB3  ASP  76           1HB      ASP  76   7.333  -5.041   6.768
  811    H    TYR  77           H        TYR  77   8.358  -3.509   4.322
  812    HA   TYR  77           HA       TYR  77   9.408  -6.036   3.714
  813    HB2  TYR  77           2HB      TYR  77   7.943  -5.129   2.094
  814    HB3  TYR  77           1HB      TYR  77   8.871  -3.635   1.971
  815    HD1  TYR  77           2HD      TYR  77   9.541  -7.305   1.623
  816    HD2  TYR  77           1HD      TYR  77  10.089  -3.398   0.020
  817    HE1  TYR  77           2HE      TYR  77  10.866  -8.248  -0.222
  818    HE2  TYR  77           1HE      TYR  77  11.424  -4.336  -1.815
  819    HH   TYR  77           HH       TYR  77  12.924  -6.721  -1.949
  820    H    ILE  78           H        ILE  78  10.883  -2.814   3.447
  821    HA   ILE  78           HA       ILE  78  13.308  -3.790   2.321
  822    HB   ILE  78           HB       ILE  78  12.665  -1.154   3.656
  823   HG12  ILE  78          2HG1      ILE  78  13.008  -1.950   0.754
  824   HG13  ILE  78          1HG1      ILE  78  11.480  -1.588   1.553
  825   HG21  ILE  78          1HG2      ILE  78  14.808  -0.559   3.603
  826   HG22  ILE  78          2HG2      ILE  78  15.215  -2.230   3.210
  827   HG23  ILE  78          3HG2      ILE  78  14.954  -1.056   1.917
  828   HD11  ILE  78          3HD1      ILE  78  13.701   0.420   1.354
  829   HD12  ILE  78          1HD1      ILE  78  12.475   0.228   0.101
  830   HD13  ILE  78          2HD1      ILE  78  12.001   0.693   1.734
  831    H    ARG  79           H        ARG  79  12.244  -3.035   5.584
  832    HA   ARG  79           HA       ARG  79  14.707  -3.426   6.890
  833    HB2  ARG  79           2HB      ARG  79  12.204  -2.642   7.647
  834    HB3  ARG  79           1HB      ARG  79  12.283  -4.255   8.344
  835    HG2  ARG  79           2HG      ARG  79  14.515  -3.513   9.346
  836    HG3  ARG  79           1HG      ARG  79  14.006  -1.873   8.931
  837    HD2  ARG  79           2HD      ARG  79  13.463  -2.669  11.280
  838    HD3  ARG  79           1HD      ARG  79  12.128  -1.989  10.353
  839    HE   ARG  79           HE       ARG  79  12.570  -4.868  10.823
  840   HH11  ARG  79          2HH1      ARG  79  10.433  -2.158  10.135
  841   HH12  ARG  79          1HH1      ARG  79   9.000  -3.141  10.166
  842   HH21  ARG  79          2HH2      ARG  79  10.663  -6.127  10.894
  843   HH22  ARG  79          1HH2      ARG  79   9.129  -5.372  10.550
  844    H    LEU  80           H        LEU  80  12.077  -5.640   6.057
  845    HA   LEU  80           HA       LEU  80  13.288  -7.903   7.334
  846    HB2  LEU  80           2HB      LEU  80  10.775  -7.276   6.367
  847    HB3  LEU  80           1HB      LEU  80  11.338  -8.496   5.240
  848    HG   LEU  80           HG       LEU  80  11.270  -8.860   8.242
  849   HD11  LEU  80          1HD1      LEU  80   9.303  -9.638   6.106
  850   HD12  LEU  80          2HD1      LEU  80   9.345 -10.387   7.704
  851   HD13  LEU  80          3HD1      LEU  80   9.015  -8.660   7.546
  852   HD21  LEU  80          3HD2      LEU  80  11.181 -11.277   6.743
  853   HD22  LEU  80          1HD2      LEU  80  12.554 -10.316   6.185
  854   HD23  LEU  80          2HD2      LEU  80  12.402 -10.733   7.894
  855    H    PHE  81           H        PHE  81  12.594  -7.239   3.890
  856    HA   PHE  81           HA       PHE  81  14.772  -9.099   3.201
  857    HB2  PHE  81           2HB      PHE  81  12.486  -8.182   1.445
  858    HB3  PHE  81           1HB      PHE  81  13.659  -9.438   1.075
  859    HD1  PHE  81           2HD      PHE  81  13.666 -11.528   2.498
  860    HD2  PHE  81           1HD      PHE  81  10.502  -8.680   2.568
  861    HE1  PHE  81           2HE      PHE  81  12.165 -13.219   3.469
  862    HE2  PHE  81           1HE      PHE  81   8.996 -10.374   3.534
  863    HZ   PHE  81           HZ       PHE  81   9.831 -12.642   3.991
  864    H    GLY  82           H        GLY  82  13.180  -6.251   1.755
  865    HA2  GLY  82           1HA      GLY  82  14.119  -4.329   0.870
  866    HA3  GLY  82           2HA      GLY  82  15.694  -4.886   1.416
  Start of MODEL    5
    1    H    SER 641           1H       SER 641  31.423 -23.192 -10.972
    2    HA   SER 641           HA       SER 641  33.269 -22.195  -9.943
    3    HB2  SER 641           2HB      SER 641  33.120 -19.561 -11.156
    4    HB3  SER 641           1HB      SER 641  34.508 -20.634 -10.990
    5    HG   SER 641           HG       SER 641  34.147 -20.395 -13.159
    6    H    LEU 642           H        LEU 642  33.167 -19.559  -9.063
    7    HA   LEU 642           HA       LEU 642  31.132 -19.539  -7.193
    8    HB2  LEU 642           2HB      LEU 642  33.344 -18.038  -7.677
    9    HB3  LEU 642           1HB      LEU 642  32.076 -16.890  -8.062
   10    HG   LEU 642           HG       LEU 642  31.695 -18.310  -5.514
   11   HD11  LEU 642          1HD1      LEU 642  34.113 -18.085  -5.462
   12   HD12  LEU 642          2HD1      LEU 642  33.976 -16.376  -5.874
   13   HD13  LEU 642          3HD1      LEU 642  33.361 -16.961  -4.330
   14   HD21  LEU 642          3HD2      LEU 642  31.348 -15.871  -4.833
   15   HD22  LEU 642          1HD2      LEU 642  31.490 -15.503  -6.552
   16   HD23  LEU 642          2HD2      LEU 642  30.205 -16.568  -5.981
   17    H    GLN 643           H        GLN 643  29.110 -19.863  -7.960
   18    HA   GLN 643           HA       GLN 643  27.525 -17.701  -8.712
   19    HB2  GLN 643           2HB      GLN 643  28.930 -18.464 -10.911
   20    HB3  GLN 643           1HB      GLN 643  27.527 -19.515 -11.055
   21    HG2  GLN 643           2HG      GLN 643  26.211 -17.849 -11.699
   22    HG3  GLN 643           1HG      GLN 643  26.806 -16.772 -10.437
   23   HE21  GLN 643          1HE2      GLN 643  29.402 -16.458 -11.012
   24   HE22  GLN 643          2HE2      GLN 643  29.602 -15.736 -12.574
   25    H    ASN 644           H        ASN 644  27.725 -21.109  -9.699
   26    HA   ASN 644           HA       ASN 644  25.259 -21.625  -8.163
   27    HB2  ASN 644           2HB      ASN 644  25.233 -21.839 -10.757
   28    HB3  ASN 644           1HB      ASN 644  26.147 -23.319 -10.486
   29   HD21  ASN 644          1HD2      ASN 644  23.455 -21.879  -8.665
   30   HD22  ASN 644          2HD2      ASN 644  22.391 -23.232  -8.860
   31    H    ASN 645           H        ASN 645  28.438 -21.935  -8.076
   32    HA   ASN 645           HA       ASN 645  28.303 -24.271  -6.338
   33    HB2  ASN 645           2HB      ASN 645  29.238 -25.443  -8.092
   34    HB3  ASN 645           1HB      ASN 645  29.964 -24.009  -8.803
   35   HD21  ASN 645          1HD2      ASN 645  30.278 -26.400  -6.240
   36   HD22  ASN 645          2HD2      ASN 645  31.987 -26.205  -6.023
   37    H    GLN 646           H        GLN 646  29.188 -23.787  -4.440
   38    HA   GLN 646           HA       GLN 646  30.233 -22.608  -2.793
   39    HB2  GLN 646           2HB      GLN 646  32.252 -22.570  -5.011
   40    HB3  GLN 646           1HB      GLN 646  32.581 -21.733  -3.500
   41    HG2  GLN 646           2HG      GLN 646  31.878 -24.061  -2.475
   42    HG3  GLN 646           1HG      GLN 646  32.379 -24.637  -4.065
   43   HE21  GLN 646          1HE2      GLN 646  34.257 -25.608  -3.669
   44   HE22  GLN 646          2HE2      GLN 646  35.623 -24.859  -2.903
   45    H    ASP 647           H        ASP 647  28.292 -21.179  -4.123
   46    HA   ASP 647           HA       ASP 647  29.236 -18.617  -4.964
   47    HB2  ASP 647           2HB      ASP 647  26.702 -18.058  -4.737
   48    HB3  ASP 647           1HB      ASP 647  27.225 -19.177  -5.988
   49    H    VAL 648           H        VAL 648  30.321 -17.537  -3.462
   50    HA   VAL 648           HA       VAL 648  28.872 -16.801  -1.003
   51    HB   VAL 648           HB       VAL 648  31.159 -16.376   0.001
   52   HG11  VAL 648          1HG1      VAL 648  30.104 -18.226   0.885
   53   HG12  VAL 648          2HG1      VAL 648  30.113 -19.097  -0.647
   54   HG13  VAL 648          3HG1      VAL 648  31.606 -18.921   0.274
   55   HG21  VAL 648          3HG2      VAL 648  32.966 -16.555  -1.278
   56   HG22  VAL 648          1HG2      VAL 648  32.636 -18.276  -1.491
   57   HG23  VAL 648          2HG2      VAL 648  31.979 -17.103  -2.632
   58    H    SER 649           H        SER 649  30.043 -14.663  -0.111
   59    HA   SER 649           HA       SER 649  30.080 -12.789  -2.362
   60    HB2  SER 649           2HB      SER 649  30.110 -11.600   0.304
   61    HB3  SER 649           1HB      SER 649  28.983 -11.340  -1.027
   62    HG   SER 649           HG       SER 649  28.930 -13.356   0.966
   63    H    PHE 650           H        PHE 650  31.857 -11.565  -2.821
   64    HA   PHE 650           HA       PHE 650  34.183 -11.779  -1.039
   65    HB2  PHE 650           2HB      PHE 650  33.915 -13.315  -3.360
   66    HB3  PHE 650           1HB      PHE 650  34.969 -11.986  -3.831
   67    HD1  PHE 650           2HD      PHE 650  34.684 -13.801  -0.597
   68    HD2  PHE 650           1HD      PHE 650  37.091 -12.868  -3.973
   69    HE1  PHE 650           2HE      PHE 650  36.589 -14.947   0.452
   70    HE2  PHE 650           1HE      PHE 650  39.007 -14.010  -2.930
   71    HZ   PHE 650           HZ       PHE 650  38.756 -15.054  -0.714
   72    H    GLU 651           H        GLU 651  35.506 -10.027  -1.030
   73    HA   GLU 651           HA       GLU 651  34.469  -7.570  -2.007
   74    HB2  GLU 651           2HB      GLU 651  37.235  -8.141  -0.927
   75    HB3  GLU 651           1HB      GLU 651  36.461  -6.566  -1.034
   76    HG2  GLU 651           2HG      GLU 651  35.970  -6.952   1.115
   77    HG3  GLU 651           1HG      GLU 651  34.639  -7.887   0.434
   78    H    ASN 652           H        ASN 652  36.389  -9.946  -3.461
   79    HA   ASN 652           HA       ASN 652  37.895  -8.200  -5.182
   80    HB2  ASN 652           2HB      ASN 652  38.406 -10.670  -4.378
   81    HB3  ASN 652           1HB      ASN 652  37.498 -11.087  -5.829
   82   HD21  ASN 652          1HD2      ASN 652  38.411 -10.807  -7.806
   83   HD22  ASN 652          2HD2      ASN 652  40.043 -10.250  -8.046
   84    H    ILE 653           H        ILE 653  34.739  -9.455  -5.182
   85    HA   ILE 653           HA       ILE 653  34.440  -8.707  -8.012
   86    HB   ILE 653           HB       ILE 653  32.327 -10.425  -7.533
   87   HG12  ILE 653          2HG1      ILE 653  34.703 -12.035  -6.737
   88   HG13  ILE 653          1HG1      ILE 653  33.921 -11.071  -5.490
   89   HG21  ILE 653          1HG2      ILE 653  34.040 -12.008  -8.880
   90   HG22  ILE 653          2HG2      ILE 653  33.150 -10.673  -9.610
   91   HG23  ILE 653          3HG2      ILE 653  34.820 -10.440  -9.093
   92   HD11  ILE 653          3HD1      ILE 653  31.753 -12.195  -6.275
   93   HD12  ILE 653          1HD1      ILE 653  32.817 -13.357  -7.070
   94   HD13  ILE 653          2HD1      ILE 653  32.894 -13.140  -5.321
   95    H    GLN 654           H        GLN 654  33.767  -6.642  -7.513
   96    HA   GLN 654           HA       GLN 654  31.309  -6.417  -5.907
   97    HB2  GLN 654           2HB      GLN 654  33.714  -4.762  -6.133
   98    HB3  GLN 654           1HB      GLN 654  32.220  -3.842  -6.270
   99    HG2  GLN 654           2HG      GLN 654  32.741  -5.772  -4.031
  100    HG3  GLN 654           1HG      GLN 654  33.196  -4.071  -3.957
  101   HE21  GLN 654          1HE2      GLN 654  31.663  -4.597  -2.026
  102   HE22  GLN 654          2HE2      GLN 654  30.004  -4.159  -2.290
  103    H    TRP 655           H        TRP 655  30.899  -7.354  -8.351
  104    HA   TRP 655           HA       TRP 655  30.227  -5.158 -10.132
  105    HB2  TRP 655           2HB      TRP 655  29.505  -6.971 -11.694
  106    HB3  TRP 655           1HB      TRP 655  31.185  -7.106 -11.198
  107    HD1  TRP 655           HD       TRP 655  31.450  -8.929  -8.941
  108    HE1  TRP 655           1HE      TRP 655  30.426 -11.283  -8.788
  109    HE3  TRP 655           3HE      TRP 655  27.761  -8.441 -12.447
  110    HZ2  TRP 655           2HZ      TRP 655  28.337 -12.743  -9.986
  111    HZ3  TRP 655           3HZ      TRP 655  26.296 -10.372 -12.888
  112    HH2  TRP 655           HH       TRP 655  26.580 -12.474 -11.685
  113    H    SER 656           H        SER 656  27.883  -6.436 -11.256
  114    HA   SER 656           HA       SER 656  25.908  -5.510  -9.397
  115    HB2  SER 656           2HB      SER 656  24.851  -7.032 -11.636
  116    HB3  SER 656           1HB      SER 656  24.648  -5.321 -11.251
  117    HG   SER 656           HG       SER 656  26.242  -4.806 -12.560
  118    H    ILE 657           H        ILE 657  26.466  -7.029  -7.659
  119    HA   ILE 657           HA       ILE 657  25.795  -9.821  -8.117
  120    HB   ILE 657           HB       ILE 657  26.218  -9.382  -5.345
  121   HG12  ILE 657          2HG1      ILE 657  28.782  -8.611  -6.016
  122   HG13  ILE 657          1HG1      ILE 657  27.789  -7.578  -7.037
  123   HG21  ILE 657          1HG2      ILE 657  28.219 -10.790  -5.758
  124   HG22  ILE 657          2HG2      ILE 657  26.743 -11.432  -6.476
  125   HG23  ILE 657          3HG2      ILE 657  27.934 -10.620  -7.491
  126   HD11  ILE 657          3HD1      ILE 657  26.539  -7.393  -4.609
  127   HD12  ILE 657          1HD1      ILE 657  28.242  -7.503  -4.165
  128   HD13  ILE 657          2HD1      ILE 657  27.696  -6.237  -5.264
  129    H    ASP 658           H        ASP 658  24.225  -7.027  -7.309
  130    HA   ASP 658           HA       ASP 658  22.241  -8.124  -5.540
  131    HB2  ASP 658           2HB      ASP 658  22.621  -5.523  -6.970
  132    HB3  ASP 658           1HB      ASP 658  21.010  -5.934  -6.394
  133    HA   PRO 659           HA       PRO 659  19.995 -10.073  -8.880
  134    HB2  PRO 659           2HB      PRO 659  17.899 -10.951  -7.412
  135    HB3  PRO 659           1HB      PRO 659  19.489 -11.718  -7.358
  136    HG2  PRO 659           2HG      PRO 659  18.263  -9.772  -5.440
  137    HG3  PRO 659           1HG      PRO 659  19.204 -11.236  -5.104
  138    HD2  PRO 659           2HD      PRO 659  20.274  -8.736  -5.011
  139    HD3  PRO 659           1HD      PRO 659  21.214 -10.177  -5.446
  140    H    GLY 660           H        GLY 660  19.216  -7.284  -7.250
  141    HA2  GLY 660           1HA      GLY 660  17.876  -5.872  -9.009
  142    HA3  GLY 660           2HA      GLY 660  16.589  -6.950  -8.485
  143    H    ALA 661           H        ALA 661  18.774  -4.391  -7.503
  144    HA   ALA 661           HA       ALA 661  17.751  -4.182  -4.833
  145    HB1  ALA 661           1HB      ALA 661  19.847  -2.967  -6.384
  146    HB2  ALA 661           2HB      ALA 661  18.927  -1.737  -5.517
  147    HB3  ALA 661           3HB      ALA 661  19.667  -3.074  -4.634
  148    H    ASP 662           H        ASP 662  17.002  -2.757  -7.922
  149    HA   ASP 662           HA       ASP 662  15.225  -0.757  -6.882
  150    HB2  ASP 662           2HB      ASP 662  16.208  -0.293  -9.002
  151    HB3  ASP 662           1HB      ASP 662  15.738  -1.864  -9.643
  152    H    LEU 663           H        LEU 663  13.283  -1.186  -6.057
  153    HA   LEU 663           HA       LEU 663  12.097  -3.805  -6.562
  154    HB2  LEU 663           2HB      LEU 663  10.936  -1.840  -4.637
  155    HB3  LEU 663           1HB      LEU 663  10.957  -3.590  -4.564
  156    HG   LEU 663           HG       LEU 663  13.543  -2.119  -4.302
  157   HD11  LEU 663          1HD1      LEU 663  11.290  -2.067  -2.376
  158   HD12  LEU 663          2HD1      LEU 663  12.908  -2.335  -1.731
  159   HD13  LEU 663          3HD1      LEU 663  12.563  -0.881  -2.669
  160   HD21  LEU 663          3HD2      LEU 663  12.483  -4.589  -2.938
  161   HD22  LEU 663          1HD2      LEU 663  13.415  -4.603  -4.435
  162   HD23  LEU 663          2HD2      LEU 663  14.145  -4.001  -2.947
  163    H    SER 664           H        SER 664  11.853  -2.336  -8.782
  164    HA   SER 664           HA       SER 664   9.511  -0.748  -8.954
  165    HB2  SER 664           2HB      SER 664   9.827  -1.619 -11.481
  166    HB3  SER 664           1HB      SER 664  10.828  -0.348 -10.775
  167    HG   SER 664           HG       SER 664  12.490  -1.624 -10.871
  168    H    GLN 665           H        GLN 665  10.177  -4.095  -9.935
  169    HA   GLN 665           HA       GLN 665   7.475  -4.674 -10.620
  170    HB2  GLN 665           2HB      GLN 665   9.351  -6.879  -9.929
  171    HB3  GLN 665           1HB      GLN 665   8.238  -6.734 -11.281
  172    HG2  GLN 665           2HG      GLN 665  10.650  -4.982 -11.134
  173    HG3  GLN 665           1HG      GLN 665  10.791  -6.646 -11.697
  174   HE21  GLN 665          1HE2      GLN 665  10.597  -3.635 -12.772
  175   HE22  GLN 665          2HE2      GLN 665   9.752  -3.875 -14.267
  176    H    TYR 666           H        TYR 666   9.141  -4.490  -7.692
  177    HA   TYR 666           HA       TYR 666   7.469  -6.390  -6.284
  178    HB2  TYR 666           2HB      TYR 666   9.777  -4.628  -5.537
  179    HB3  TYR 666           1HB      TYR 666   8.752  -5.295  -4.274
  180    HD1  TYR 666           2HD      TYR 666   8.264  -7.927  -5.971
  181    HD2  TYR 666           1HD      TYR 666  11.720  -5.812  -4.679
  182    HE1  TYR 666           2HE      TYR 666   9.552 -10.018  -6.012
  183    HE2  TYR 666           1HE      TYR 666  13.016  -7.900  -4.711
  184    HH   TYR 666           HH       TYR 666  11.461 -11.007  -5.472
  185    H    LYS 667           H        LYS 667   7.311  -3.160  -7.219
  186    HA   LYS 667           HA       LYS 667   5.922  -2.081  -4.965
  187    HB2  LYS 667           2HB      LYS 667   6.576  -1.166  -7.725
  188    HB3  LYS 667           1HB      LYS 667   5.242  -0.374  -6.902
  189    HG2  LYS 667           2HG      LYS 667   6.933  -0.100  -4.957
  190    HG3  LYS 667           1HG      LYS 667   8.143  -0.398  -6.206
  191    HD2  LYS 667           2HD      LYS 667   6.364   1.461  -7.306
  192    HD3  LYS 667           1HD      LYS 667   6.637   1.992  -5.647
  193    HE2  LYS 667           2HE      LYS 667   8.774   2.556  -6.047
  194    HE3  LYS 667           1HE      LYS 667   9.055   1.149  -7.072
  195    HZ1  LYS 667           3HZ      LYS 667   9.027   3.567  -8.058
  196    HZ2  LYS 667           1HZ      LYS 667   7.350   3.295  -8.109
  197    HZ3  LYS 667           2HZ      LYS 667   8.403   2.258  -8.941
  198    H    MET 668           H        MET 668   3.870  -2.433  -4.435
  199    HA   MET 668           HA       MET 668   2.066  -3.600  -6.389
  200    HB2  MET 668           2HB      MET 668   0.432  -3.631  -4.473
  201    HB3  MET 668           1HB      MET 668   1.886  -4.581  -4.226
  202    HG2  MET 668           2HG      MET 668   2.807  -2.904  -2.781
  203    HG3  MET 668           1HG      MET 668   1.469  -1.812  -3.130
  204    HE1  MET 668           3HE      MET 668   2.873  -4.759  -1.644
  205    HE2  MET 668           1HE      MET 668   2.156  -4.701  -0.035
  206    HE3  MET 668           2HE      MET 668   1.503  -5.799  -1.250
  207    H    ASP 669           H        ASP 669   1.275  -2.225  -7.815
  208    HA   ASP 669           HA       ASP 669   0.931   0.542  -7.370
  209    HB2  ASP 669           2HB      ASP 669   1.224  -0.638  -9.609
  210    HB3  ASP 669           1HB      ASP 669  -0.479  -1.075  -9.493
  211    H    VAL 670           H        VAL 670  -0.524   1.417  -6.075
  212    HA   VAL 670           HA       VAL 670  -2.792  -0.143  -5.211
  213    HB   VAL 670           HB       VAL 670  -2.539   2.678  -4.327
  214   HG11  VAL 670          1HG1      VAL 670  -4.040   0.585  -3.528
  215   HG12  VAL 670          2HG1      VAL 670  -2.674   0.430  -2.423
  216   HG13  VAL 670          3HG1      VAL 670  -3.597   1.932  -2.478
  217   HG21  VAL 670          3HG2      VAL 670  -0.276   0.909  -4.289
  218   HG22  VAL 670          1HG2      VAL 670  -0.398   2.576  -3.729
  219   HG23  VAL 670          2HG2      VAL 670  -0.806   1.249  -2.641
  220    H    THR 671           H        THR 671  -4.211  -0.255  -6.872
  221    HA   THR 671           HA       THR 671  -5.204   2.194  -8.107
  222    HB   THR 671           HB       THR 671  -6.413  -0.464  -8.712
  223    HG1  THR 671           1HG      THR 671  -3.728   0.103  -8.868
  224   HG21  THR 671          3HG2      THR 671  -6.324   0.433 -11.011
  225   HG22  THR 671          1HG2      THR 671  -5.516   1.876 -10.398
  226   HG23  THR 671          2HG2      THR 671  -7.171   1.517  -9.908
  227    H    VAL 672           H        VAL 672  -6.761   3.268  -7.104
  228    HA   VAL 672           HA       VAL 672  -8.430   1.927  -5.133
  229    HB   VAL 672           HB       VAL 672  -8.771   4.814  -5.835
  230   HG11  VAL 672          1HG1      VAL 672  -9.746   4.976  -3.809
  231   HG12  VAL 672          2HG1      VAL 672  -9.915   3.227  -3.963
  232   HG13  VAL 672          3HG1      VAL 672  -8.570   3.905  -3.047
  233   HG21  VAL 672          3HG2      VAL 672  -6.260   4.081  -5.584
  234   HG22  VAL 672          1HG2      VAL 672  -6.854   5.546  -4.801
  235   HG23  VAL 672          2HG2      VAL 672  -6.663   4.062  -3.868
  236    H    ILE 673           H        ILE 673 -10.576   1.553  -5.314
  237    HA   ILE 673           HA       ILE 673 -11.804   2.178  -7.913
  238    HB   ILE 673           HB       ILE 673 -12.344  -0.097  -6.021
  239   HG12  ILE 673          2HG1      ILE 673 -12.001  -0.938  -8.687
  240   HG13  ILE 673          1HG1      ILE 673 -10.761   0.276  -8.398
  241   HG21  ILE 673          1HG2      ILE 673 -14.316  -0.582  -7.035
  242   HG22  ILE 673          2HG2      ILE 673 -14.334   1.165  -7.298
  243   HG23  ILE 673          3HG2      ILE 673 -13.804   0.081  -8.588
  244   HD11  ILE 673          3HD1      ILE 673 -11.175  -2.349  -7.041
  245   HD12  ILE 673          1HD1      ILE 673  -9.730  -1.711  -7.825
  246   HD13  ILE 673          2HD1      ILE 673 -10.251  -1.060  -6.272
  247    H    ASP 674           H        ASP 674 -13.599   3.375  -8.006
  248    HA   ASP 674           HA       ASP 674 -14.507   4.745  -5.682
  249    HB2  ASP 674           2HB      ASP 674 -14.524   5.575  -8.123
  250    HB3  ASP 674           1HB      ASP 674 -16.010   4.645  -8.288
  251    H    THR 675           H        THR 675 -15.274   3.293  -4.229
  252    HA   THR 675           HA       THR 675 -16.956   2.328  -3.072
  253    HB   THR 675           HB       THR 675 -18.788   2.407  -5.452
  254    HG1  THR 675           1HG      THR 675 -17.863   4.506  -5.256
  255   HG21  THR 675          3HG2      THR 675 -20.035   1.473  -3.804
  256   HG22  THR 675          1HG2      THR 675 -20.227   3.147  -3.287
  257   HG23  THR 675          2HG2      THR 675 -19.013   2.120  -2.520
  258    H    LYS 676           H        LYS 676 -18.060   0.300  -2.858
  259    HA   LYS 676           HA       LYS 676 -16.595  -1.859  -3.925
  260    HB2  LYS 676           2HB      LYS 676 -18.502  -3.199  -2.793
  261    HB3  LYS 676           1HB      LYS 676 -17.435  -2.226  -1.789
  262    HG2  LYS 676           2HG      LYS 676 -19.062  -0.552  -1.489
  263    HG3  LYS 676           1HG      LYS 676 -20.059  -1.180  -2.801
  264    HD2  LYS 676           2HD      LYS 676 -19.583  -3.163  -0.734
  265    HD3  LYS 676           1HD      LYS 676 -20.365  -1.714  -0.104
  266    HE2  LYS 676           2HE      LYS 676 -21.314  -3.386  -2.431
  267    HE3  LYS 676           1HE      LYS 676 -22.019  -3.354  -0.817
  268    HZ1  LYS 676           3HZ      LYS 676 -22.339  -1.503  -3.012
  269    HZ2  LYS 676           1HZ      LYS 676 -22.077  -0.750  -1.510
  270    HZ3  LYS 676           2HZ      LYS 676 -23.370  -1.827  -1.703
  271    H    ASP 677           H        ASP 677 -19.210  -0.151  -5.186
  272    HA   ASP 677           HA       ASP 677 -20.406  -2.434  -6.545
  273    HB2  ASP 677           2HB      ASP 677 -21.260   0.462  -6.521
  274    HB3  ASP 677           1HB      ASP 677 -22.183  -0.891  -7.171
  275    H    GLY 678           H        GLY 678 -21.389  -0.836  -8.724
  276    HA2  GLY 678           1HA      GLY 678 -20.570   0.332 -10.649
  277    HA3  GLY 678           2HA      GLY 678 -18.948  -0.199 -10.231
  278    H    SER 679           H        SER 679 -19.204  -2.862  -9.919
  279    HA   SER 679           HA       SER 679 -19.518  -3.749 -12.634
  280    HB2  SER 679           2HB      SER 679 -19.109  -5.771 -10.520
  281    HB3  SER 679           1HB      SER 679 -18.206  -5.496 -12.011
  282    HG   SER 679           HG       SER 679 -17.157  -3.749 -11.006
  283    H    GLN 680           H        GLN 680 -21.257  -4.063  -9.614
  284    HA   GLN 680           HA       GLN 680 -23.326  -5.654 -10.929
  285    HB2  GLN 680           2HB      GLN 680 -23.809  -4.765  -8.162
  286    HB3  GLN 680           1HB      GLN 680 -23.994  -6.357  -8.878
  287    HG2  GLN 680           2HG      GLN 680 -22.307  -6.809  -7.445
  288    HG3  GLN 680           1HG      GLN 680 -21.347  -6.278  -8.826
  289   HE21  GLN 680          1HE2      GLN 680 -23.041  -4.889  -6.036
  290   HE22  GLN 680          2HE2      GLN 680 -21.801  -3.745  -5.630
  291    H    SER 681           H        SER 681 -24.220  -4.171 -12.327
  292    HA   SER 681           HA       SER 681 -24.851  -1.499 -11.531
  293    HB2  SER 681           2HB      SER 681 -26.227  -2.274 -13.924
  294    HB3  SER 681           1HB      SER 681 -24.824  -1.218 -13.751
  295    HG   SER 681           HG       SER 681 -24.911  -3.649 -14.799
  296    H    LYS 682           H        LYS 682 -26.115  -3.410  -9.839
  297    HA   LYS 682           HA       LYS 682 -28.962  -3.116 -10.516
  298    HB2  LYS 682           2HB      LYS 682 -27.592  -5.305  -9.574
  299    HB3  LYS 682           1HB      LYS 682 -28.257  -4.628  -8.094
  300    HG2  LYS 682           2HG      LYS 682 -30.488  -4.782  -8.947
  301    HG3  LYS 682           1HG      LYS 682 -29.891  -5.268 -10.537
  302    HD2  LYS 682           2HD      LYS 682 -29.290  -6.859  -8.062
  303    HD3  LYS 682           1HD      LYS 682 -30.766  -7.108  -8.996
  304    HE2  LYS 682           2HE      LYS 682 -29.201  -7.358 -11.017
  305    HE3  LYS 682           1HE      LYS 682 -27.914  -7.541  -9.826
  306    HZ1  LYS 682           3HZ      LYS 682 -30.023  -9.223  -9.085
  307    HZ2  LYS 682           1HZ      LYS 682 -28.469  -9.656  -9.614
  308    HZ3  LYS 682           2HZ      LYS 682 -29.732  -9.471 -10.738
  309    H    LEU 683           H        LEU 683 -26.635  -1.456  -9.047
  310    HA   LEU 683           HA       LEU 683 -28.376  -0.463  -6.896
  311    HB2  LEU 683           2HB      LEU 683 -25.570  -1.164  -6.956
  312    HB3  LEU 683           1HB      LEU 683 -25.783   0.507  -6.470
  313    HG   LEU 683           HG       LEU 683 -27.664  -0.857  -4.954
  314   HD11  LEU 683          1HD1      LEU 683 -25.089  -2.413  -4.872
  315   HD12  LEU 683          2HD1      LEU 683 -26.560  -2.712  -3.948
  316   HD13  LEU 683          3HD1      LEU 683 -26.547  -2.969  -5.694
  317   HD21  LEU 683          3HD2      LEU 683 -24.961   0.309  -4.460
  318   HD22  LEU 683          1HD2      LEU 683 -26.546   0.879  -3.934
  319   HD23  LEU 683          2HD2      LEU 683 -25.806  -0.521  -3.156
  320    H    GLY 684           H        GLY 684 -29.276   0.640  -8.928
  321    HA2  GLY 684           1HA      GLY 684 -27.809   3.170  -9.368
  322    HA3  GLY 684           2HA      GLY 684 -28.881   2.436 -10.556
  323    H    GLY 685           H        GLY 685 -30.956   1.695  -8.768
  324    HA2  GLY 685           1HA      GLY 685 -32.382   2.790  -7.118
  325    HA3  GLY 685           2HA      GLY 685 -31.887   4.330  -7.806
  326    H    GLY 901           H        GLY 901 -33.423   5.259  -8.947
  327    HA2  GLY 901           1HA      GLY 901 -34.947   5.510 -10.678
  328    HA3  GLY 901           2HA      GLY 901 -34.820   3.787 -11.001
  329    H    GLY 902           H        GLY 902 -35.551   5.070  -7.832
  330    HA2  GLY 902           1HA      GLY 902 -37.557   5.186  -6.668
  331    HA3  GLY 902           2HA      GLY 902 -38.408   4.757  -8.146
  332    H    SER 903           H        SER 903 -38.145   2.464  -8.857
  333    HA   SER 903           HA       SER 903 -37.898   0.656  -6.546
  334    HB2  SER 903           2HB      SER 903 -39.702   0.136  -8.912
  335    HB3  SER 903           1HB      SER 903 -39.703  -0.668  -7.343
  336    HG   SER 903           HG       SER 903 -40.162   2.098  -7.450
  337    H    GLY 904           H        GLY 904 -36.393  -0.872  -6.752
  338    HA2  GLY 904           1HA      GLY 904 -34.950  -1.068  -9.269
  339    HA3  GLY 904           2HA      GLY 904 -34.475  -1.773  -7.731
  340    H    GLY 905           H        GLY 905 -37.642  -2.220  -9.179
  341    HA2  GLY 905           1HA      GLY 905 -38.538  -4.050 -10.298
  342    HA3  GLY 905           2HA      GLY 905 -36.952  -4.813 -10.268
  343    H    HIS 906           H        HIS 906 -36.238  -5.724  -8.223
  344    HA   HIS 906           HA       HIS 906 -38.514  -6.824  -6.720
  345    HB2  HIS 906           2HB      HIS 906 -35.817  -7.886  -7.453
  346    HB3  HIS 906           1HB      HIS 906 -36.566  -8.454  -5.964
  347    HD1  HIS 906           1HD      HIS 906 -36.888  -8.678  -9.699
  348    HD2  HIS 906           2HD      HIS 906 -38.823 -10.049  -6.283
  349    HE1  HIS 906           1HE      HIS 906 -38.493 -10.477 -10.465
  350    H    MET 907           H        MET 907 -38.438  -6.892  -4.457
  351    HA   MET 907           HA       MET 907 -37.128  -4.607  -3.309
  352    HB2  MET 907           2HB      MET 907 -39.328  -6.329  -2.630
  353    HB3  MET 907           1HB      MET 907 -38.242  -6.184  -1.255
  354    HG2  MET 907           2HG      MET 907 -40.030  -4.512  -1.221
  355    HG3  MET 907           1HG      MET 907 -38.427  -3.787  -1.299
  356    HE1  MET 907           3HE      MET 907 -41.053  -5.189  -4.088
  357    HE2  MET 907           1HE      MET 907 -41.822  -4.267  -2.796
  358    HE3  MET 907           2HE      MET 907 -41.746  -3.604  -4.429
  359    H    GLY 908           H        GLY 908 -35.139  -4.596  -2.563
  360    HA2  GLY 908           1HA      GLY 908 -33.696  -5.591  -0.784
  361    HA3  GLY 908           2HA      GLY 908 -34.003  -7.137  -1.563
  362    H    SER 909           H        SER 909 -31.486  -5.647  -1.048
  363    HA   SER 909           HA       SER 909 -30.514  -4.820  -3.616
  364    HB2  SER 909           2HB      SER 909 -28.723  -5.523  -1.316
  365    HB3  SER 909           1HB      SER 909 -28.557  -4.227  -2.501
  366    HG   SER 909           HG       SER 909 -30.379  -3.207  -1.500
  367    H    GLY 910           H        GLY 910 -30.322  -6.326  -5.150
  368    HA2  GLY 910           1HA      GLY 910 -29.805  -9.078  -4.639
  369    HA3  GLY 910           2HA      GLY 910 -29.817  -8.297  -6.214
  370    H    GLY 911           H        GLY 911 -27.989 -10.314  -5.151
  371    HA2  GLY 911           1HA      GLY 911 -25.734 -10.756  -5.380
  372    HA3  GLY 911           2HA      GLY 911 -25.506  -9.096  -5.918
  373    H    LEU  18           H        LEU  18 -26.217 -10.987  -3.002
  374    HA   LEU  18           HA       LEU  18 -25.429  -8.818  -1.275
  375    HB2  LEU  18           2HB      LEU  18 -26.607 -11.515  -0.936
  376    HB3  LEU  18           1HB      LEU  18 -25.687 -10.886   0.419
  377    HG   LEU  18           HG       LEU  18 -27.958  -9.369  -0.860
  378   HD11  LEU  18          1HD1      LEU  18 -28.473 -10.522   1.755
  379   HD12  LEU  18          2HD1      LEU  18 -29.469 -10.523   0.299
  380   HD13  LEU  18          3HD1      LEU  18 -28.217 -11.746   0.512
  381   HD21  LEU  18          3HD2      LEU  18 -26.514  -7.930   0.362
  382   HD22  LEU  18          1HD2      LEU  18 -27.920  -8.233   1.381
  383   HD23  LEU  18          2HD2      LEU  18 -26.402  -9.072   1.703
  384    H    SER  19           H        SER  19 -23.561 -10.627  -3.089
  385    HA   SER  19           HA       SER  19 -21.544 -11.272  -1.095
  386    HB2  SER  19           2HB      SER  19 -20.573 -11.542  -3.778
  387    HB3  SER  19           1HB      SER  19 -20.949 -12.814  -2.616
  388    HG   SER  19           HG       SER  19 -22.737 -13.217  -3.648
  389    H    TRP  20           H        TRP  20 -22.388  -8.787  -3.320
  390    HA   TRP  20           HA       TRP  20 -21.391  -6.895  -4.085
  391    HB2  TRP  20           2HB      TRP  20 -19.881  -6.729  -1.494
  392    HB3  TRP  20           1HB      TRP  20 -20.637  -5.437  -2.420
  393    HD1  TRP  20           HD       TRP  20 -23.579  -6.137  -2.573
  394    HE1  TRP  20           1HE      TRP  20 -25.051  -6.429  -0.482
  395    HE3  TRP  20           3HE      TRP  20 -19.917  -7.106   0.861
  396    HZ2  TRP  20           2HZ      TRP  20 -24.698  -6.999   2.270
  397    HZ3  TRP  20           3HZ      TRP  20 -20.567  -7.513   3.198
  398    HH2  TRP  20           HH       TRP  20 -22.907  -7.459   3.887
  399    H    LYS  21           H        LYS  21 -18.599  -6.730  -2.289
  400    HA   LYS  21           HA       LYS  21 -17.001  -8.030  -4.391
  401    HB2  LYS  21           2HB      LYS  21 -16.940  -5.329  -3.472
  402    HB3  LYS  21           1HB      LYS  21 -15.444  -6.108  -2.973
  403    HG2  LYS  21           2HG      LYS  21 -15.313  -4.982  -5.179
  404    HG3  LYS  21           1HG      LYS  21 -14.917  -6.700  -5.230
  405    HD2  LYS  21           2HD      LYS  21 -16.821  -7.246  -6.382
  406    HD3  LYS  21           1HD      LYS  21 -17.737  -5.886  -5.731
  407    HE2  LYS  21           2HE      LYS  21 -15.588  -4.839  -7.255
  408    HE3  LYS  21           1HE      LYS  21 -16.365  -6.094  -8.217
  409    HZ1  LYS  21           3HZ      LYS  21 -17.501  -3.585  -7.181
  410    HZ2  LYS  21           1HZ      LYS  21 -18.523  -4.898  -7.487
  411    HZ3  LYS  21           2HZ      LYS  21 -17.593  -4.243  -8.742
  412    H    ARG  22           H        ARG  22 -14.936  -8.933  -3.607
  413    HA   ARG  22           HA       ARG  22 -15.237  -9.849  -0.828
  414    HB2  ARG  22           2HB      ARG  22 -14.346 -11.599  -3.119
  415    HB3  ARG  22           1HB      ARG  22 -14.737 -12.095  -1.477
  416    HG2  ARG  22           2HG      ARG  22 -17.077 -11.043  -2.095
  417    HG3  ARG  22           1HG      ARG  22 -16.533 -11.412  -3.735
  418    HD2  ARG  22           2HD      ARG  22 -17.611 -13.356  -3.152
  419    HD3  ARG  22           1HD      ARG  22 -15.940 -13.726  -2.729
  420    HE   ARG  22           HE       ARG  22 -16.667 -12.985  -0.391
  421   HH11  ARG  22          2HH1      ARG  22 -18.797 -14.533  -2.715
  422   HH12  ARG  22          1HH1      ARG  22 -19.761 -15.309  -1.490
  423   HH21  ARG  22          2HH2      ARG  22 -17.943 -14.032   1.215
  424   HH22  ARG  22          1HH2      ARG  22 -19.290 -15.020   0.714
  425    H    CYS  23           H        CYS  23 -13.519  -9.340   0.339
  426    HA   CYS  23           HA       CYS  23 -10.975  -8.857  -0.959
  427    HB2  CYS  23           2HB      CYS  23 -10.280  -8.239   1.420
  428    HB3  CYS  23           1HB      CYS  23 -11.490  -7.222   0.657
  429    H    ALA  24           H        ALA  24  -9.024  -9.868  -0.244
  430    HA   ALA  24           HA       ALA  24  -9.452 -12.681   0.400
  431    HB1  ALA  24           1HB      ALA  24  -7.022 -12.881  -0.220
  432    HB2  ALA  24           2HB      ALA  24  -8.086 -12.327  -1.512
  433    HB3  ALA  24           3HB      ALA  24  -7.068 -11.171  -0.652
  434    H    GLY  25           H        GLY  25  -9.240 -10.103   2.237
  435    HA2  GLY  25           1HA      GLY  25  -7.116 -11.096   4.008
  436    HA3  GLY  25           2HA      GLY  25  -7.744  -9.459   3.999
  437    H    CYS  26           H        CYS  26  -9.936  -9.138   4.823
  438    HA   CYS  26           HA       CYS  26 -10.107 -10.596   7.288
  439    HB2  CYS  26           2HB      CYS  26 -11.523  -8.862   8.096
  440    HB3  CYS  26           1HB      CYS  26 -10.226  -8.111   7.190
  441    H    GLY  27           H        GLY  27 -13.126  -9.419   6.091
  442    HA2  GLY  27           1HA      GLY  27 -14.272 -11.974   6.803
  443    HA3  GLY  27           2HA      GLY  27 -15.153 -10.528   6.343
  444    H    GLY  28           H        GLY  28 -13.227 -10.564   3.875
  445    HA2  GLY  28           1HA      GLY  28 -13.246 -11.487   1.753
  446    HA3  GLY  28           2HA      GLY  28 -14.178 -12.838   2.386
  447    H    LYS  29           H        LYS  29 -15.488  -9.881   3.225
  448    HA   LYS  29           HA       LYS  29 -17.123  -9.624   0.830
  449    HB2  LYS  29           2HB      LYS  29 -18.065 -10.597   3.430
  450    HB3  LYS  29           1HB      LYS  29 -18.968  -9.202   2.851
  451    HG2  LYS  29           2HG      LYS  29 -19.676 -10.325   0.918
  452    HG3  LYS  29           1HG      LYS  29 -18.474 -11.603   1.123
  453    HD2  LYS  29           2HD      LYS  29 -20.420 -12.633   1.841
  454    HD3  LYS  29           1HD      LYS  29 -19.718 -12.064   3.356
  455    HE2  LYS  29           2HE      LYS  29 -21.470 -10.746   3.762
  456    HE3  LYS  29           1HE      LYS  29 -21.392 -10.040   2.148
  457    HZ1  LYS  29           3HZ      LYS  29 -23.276 -11.830   3.149
  458    HZ2  LYS  29           1HZ      LYS  29 -22.404 -12.661   1.956
  459    HZ3  LYS  29           2HZ      LYS  29 -23.174 -11.198   1.578
  460    H    ILE  30           H        ILE  30 -16.510  -7.631   0.281
  461    HA   ILE  30           HA       ILE  30 -15.709  -5.715   2.264
  462    HB   ILE  30           HB       ILE  30 -16.017  -5.439  -0.729
  463   HG12  ILE  30          2HG1      ILE  30 -13.453  -5.502   0.845
  464   HG13  ILE  30          1HG1      ILE  30 -14.229  -6.989   0.311
  465   HG21  ILE  30          1HG2      ILE  30 -14.791  -3.354  -0.535
  466   HG22  ILE  30          2HG2      ILE  30 -16.273  -3.276   0.415
  467   HG23  ILE  30          3HG2      ILE  30 -14.722  -3.530   1.218
  468   HD11  ILE  30          3HD1      ILE  30 -14.164  -5.955  -2.027
  469   HD12  ILE  30          1HD1      ILE  30 -13.012  -4.811  -1.338
  470   HD13  ILE  30          2HD1      ILE  30 -12.651  -6.538  -1.331
  471    H    ALA  31           H        ALA  31 -17.256  -4.895   3.477
  472    HA   ALA  31           HA       ALA  31 -19.568  -3.640   2.168
  473    HB1  ALA  31           1HB      ALA  31 -20.769  -4.120   3.999
  474    HB2  ALA  31           2HB      ALA  31 -19.432  -5.170   4.469
  475    HB3  ALA  31           3HB      ALA  31 -19.512  -3.518   5.079
  476    H    ASP  32           H        ASP  32 -16.677  -2.833   2.337
  477    HA   ASP  32           HA       ASP  32 -16.674  -0.433   3.943
  478    HB2  ASP  32           2HB      ASP  32 -14.695  -2.105   3.182
  479    HB3  ASP  32           1HB      ASP  32 -14.549  -0.880   1.928
  480    H    ARG  33           H        ARG  33 -15.522   1.485   2.582
  481    HA   ARG  33           HA       ARG  33 -17.600   2.299   0.750
  482    HB2  ARG  33           2HB      ARG  33 -15.626   3.605   2.405
  483    HB3  ARG  33           1HB      ARG  33 -15.587   4.251   0.772
  484    HG2  ARG  33           2HG      ARG  33 -18.273   4.144   1.320
  485    HG3  ARG  33           1HG      ARG  33 -17.569   4.598   2.871
  486    HD2  ARG  33           2HD      ARG  33 -16.735   6.580   2.067
  487    HD3  ARG  33           1HD      ARG  33 -16.632   5.987   0.409
  488    HE   ARG  33           HE       ARG  33 -19.145   6.768   1.747
  489   HH11  ARG  33          2HH1      ARG  33 -17.140   6.481  -1.101
  490   HH12  ARG  33          1HH1      ARG  33 -18.319   7.177  -2.171
  491   HH21  ARG  33          2HH2      ARG  33 -20.700   7.718   0.355
  492   HH22  ARG  33          1HH2      ARG  33 -20.341   7.893  -1.331
  493    H    PHE  34           H        PHE  34 -14.051   2.558   0.495
  494    HA   PHE  34           HA       PHE  34 -14.360   2.309  -2.416
  495    HB2  PHE  34           2HB      PHE  34 -12.601   3.874  -0.653
  496    HB3  PHE  34           1HB      PHE  34 -11.789   3.146  -2.038
  497    HD1  PHE  34           2HD      PHE  34 -15.240   4.487  -1.729
  498    HD2  PHE  34           1HD      PHE  34 -11.401   4.879  -3.519
  499    HE1  PHE  34           2HE      PHE  34 -16.111   6.249  -3.200
  500    HE2  PHE  34           1HE      PHE  34 -12.266   6.640  -5.001
  501    HZ   PHE  34           HZ       PHE  34 -14.627   7.315  -4.848
  502    H    LEU  35           H        LEU  35 -12.894   1.037  -3.650
  503    HA   LEU  35           HA       LEU  35 -11.820  -1.240  -2.140
  504    HB2  LEU  35           2HB      LEU  35 -11.997  -1.091  -5.133
  505    HB3  LEU  35           1HB      LEU  35 -11.896  -2.513  -4.121
  506    HG   LEU  35           HG       LEU  35 -14.283  -0.739  -4.557
  507   HD11  LEU  35          1HD1      LEU  35 -13.386  -3.382  -5.486
  508   HD12  LEU  35          2HD1      LEU  35 -15.076  -3.278  -4.988
  509   HD13  LEU  35          3HD1      LEU  35 -14.461  -2.211  -6.250
  510   HD21  LEU  35          3HD2      LEU  35 -14.958  -1.240  -2.508
  511   HD22  LEU  35          1HD2      LEU  35 -15.061  -2.923  -3.030
  512   HD23  LEU  35          2HD2      LEU  35 -13.593  -2.328  -2.256
  513    H    LEU  36           H        LEU  36  -9.725  -2.083  -2.717
  514    HA   LEU  36           HA       LEU  36  -7.948  -0.168  -4.047
  515    HB2  LEU  36           2HB      LEU  36  -7.553  -1.395  -1.325
  516    HB3  LEU  36           1HB      LEU  36  -6.235  -0.708  -2.255
  517    HG   LEU  36           HG       LEU  36  -8.636   0.981  -1.729
  518   HD11  LEU  36          1HD1      LEU  36  -6.971   1.651   0.317
  519   HD12  LEU  36          2HD1      LEU  36  -8.430   0.674   0.475
  520   HD13  LEU  36          3HD1      LEU  36  -6.854  -0.108   0.316
  521   HD21  LEU  36          3HD2      LEU  36  -7.317   2.559  -2.575
  522   HD22  LEU  36          1HD2      LEU  36  -6.067   2.209  -1.379
  523   HD23  LEU  36          2HD2      LEU  36  -6.106   1.320  -2.901
  524    H    TYR  37           H        TYR  37  -6.537  -1.085  -5.386
  525    HA   TYR  37           HA       TYR  37  -6.314  -4.012  -5.462
  526    HB2  TYR  37           2HB      TYR  37  -6.062  -1.815  -7.402
  527    HB3  TYR  37           1HB      TYR  37  -4.801  -3.033  -7.545
  528    HD1  TYR  37           2HD      TYR  37  -6.071  -5.536  -7.085
  529    HD2  TYR  37           1HD      TYR  37  -7.632  -2.100  -9.039
  530    HE1  TYR  37           2HE      TYR  37  -7.594  -6.971  -8.367
  531    HE2  TYR  37           1HE      TYR  37  -9.161  -3.518 -10.334
  532    HH   TYR  37           HH       TYR  37 -10.158  -5.664 -10.300
  533    H    ALA  38           H        ALA  38  -4.393  -5.055  -5.142
  534    HA   ALA  38           HA       ALA  38  -2.048  -3.392  -4.531
  535    HB1  ALA  38           1HB      ALA  38  -1.539  -4.571  -2.617
  536    HB2  ALA  38           2HB      ALA  38  -3.301  -4.570  -2.553
  537    HB3  ALA  38           3HB      ALA  38  -2.441  -5.998  -3.129
  538    H    MET  39           H        MET  39  -2.504  -6.900  -4.625
  539    HA   MET  39           HA       MET  39  -0.409  -7.047  -6.663
  540    HB2  MET  39           2HB      MET  39  -1.566  -9.424  -5.236
  541    HB3  MET  39           1HB      MET  39   0.021  -9.249  -5.967
  542    HG2  MET  39           2HG      MET  39   0.596  -9.096  -3.780
  543    HG3  MET  39           1HG      MET  39   0.280  -7.392  -4.110
  544    HE1  MET  39           3HE      MET  39   0.058  -8.611  -0.897
  545    HE2  MET  39           1HE      MET  39   0.261  -7.045  -1.685
  546    HE3  MET  39           2HE      MET  39  -1.120  -7.327  -0.625
  547    H    ASP  40           H        ASP  40  -3.670  -8.277  -5.981
  548    HA   ASP  40           HA       ASP  40  -4.405  -8.334  -8.725
  549    HB2  ASP  40           2HB      ASP  40  -3.756 -10.382  -9.344
  550    HB3  ASP  40           1HB      ASP  40  -2.998 -10.614  -7.775
  551    H    SER  41           H        SER  41  -5.043  -8.865  -5.388
  552    HA   SER  41           HA       SER  41  -7.736  -9.839  -5.865
  553    HB2  SER  41           2HB      SER  41  -7.243  -9.425  -3.104
  554    HB3  SER  41           1HB      SER  41  -7.287 -10.957  -3.979
  555    HG   SER  41           HG       SER  41  -5.203 -11.074  -3.810
  556    H    TYR  42           H        TYR  42  -9.531  -8.879  -4.661
  557    HA   TYR  42           HA       TYR  42  -9.519  -5.989  -4.750
  558    HB2  TYR  42           2HB      TYR  42 -11.614  -8.064  -4.122
  559    HB3  TYR  42           1HB      TYR  42 -11.914  -6.349  -3.876
  560    HD1  TYR  42           2HD      TYR  42 -10.648  -5.145  -6.235
  561    HD2  TYR  42           1HD      TYR  42 -12.958  -8.699  -5.887
  562    HE1  TYR  42           2HE      TYR  42 -11.333  -4.924  -8.585
  563    HE2  TYR  42           1HE      TYR  42 -13.647  -8.491  -8.236
  564    HH   TYR  42           HH       TYR  42 -12.666  -5.698 -10.200
  565    H    TRP  43           H        TRP  43  -9.067  -4.722  -3.042
  566    HA   TRP  43           HA       TRP  43  -9.476  -5.844  -0.353
  567    HB2  TRP  43           2HB      TRP  43  -7.318  -3.834  -0.969
  568    HB3  TRP  43           1HB      TRP  43  -7.517  -4.806   0.482
  569    HD1  TRP  43           HD       TRP  43  -6.280  -5.056  -3.137
  570    HE1  TRP  43           1HE      TRP  43  -4.764  -7.121  -3.333
  571    HE3  TRP  43           3HE      TRP  43  -6.997  -7.060   1.516
  572    HZ2  TRP  43           2HZ      TRP  43  -3.957  -9.290  -1.744
  573    HZ3  TRP  43           3HZ      TRP  43  -5.802  -9.135   2.097
  574    HH2  TRP  43           HH       TRP  43  -4.318 -10.225   0.491
  575    H    HIS  44           H        HIS  44  -9.275  -3.900   1.250
  576    HA   HIS  44           HA       HIS  44 -10.368  -1.411   0.233
  577    HB2  HIS  44           2HB      HIS  44 -12.095  -1.363   2.085
  578    HB3  HIS  44           1HB      HIS  44 -12.431  -2.516   0.801
  579    HD1  HIS  44           1HD      HIS  44 -12.760  -2.341   4.293
  580    HD2  HIS  44           2HD      HIS  44 -11.140  -5.179   1.698
  581    HE1  HIS  44           1HE      HIS  44 -12.662  -4.551   5.575
  582    H    SER  45           H        SER  45 -10.594   0.066   2.423
  583    HA   SER  45           HA       SER  45  -7.928   0.560   3.069
  584    HB2  SER  45           2HB      SER  45  -9.689   1.669   5.058
  585    HB3  SER  45           1HB      SER  45  -8.813   2.486   3.761
  586    HG   SER  45           HG       SER  45 -11.395   2.132   3.937
  587    H    ARG  46           H        ARG  46 -10.301  -1.393   4.754
  588    HA   ARG  46           HA       ARG  46  -8.712  -1.540   7.168
  589    HB2  ARG  46           2HB      ARG  46 -11.355  -2.611   6.287
  590    HB3  ARG  46           1HB      ARG  46 -10.534  -3.415   7.618
  591    HG2  ARG  46           2HG      ARG  46 -10.650  -0.497   7.841
  592    HG3  ARG  46           1HG      ARG  46 -12.215  -1.309   7.884
  593    HD2  ARG  46           2HD      ARG  46 -11.615  -2.592   9.763
  594    HD3  ARG  46           1HD      ARG  46  -9.902  -2.216   9.573
  595    HE   ARG  46           HE       ARG  46 -10.802   0.202  10.043
  596   HH11  ARG  46          2HH1      ARG  46 -11.723  -2.801  11.599
  597   HH12  ARG  46          1HH1      ARG  46 -12.182  -2.032  13.092
  598   HH21  ARG  46          2HH2      ARG  46 -11.411   1.214  11.997
  599   HH22  ARG  46          1HH2      ARG  46 -12.014   0.255  13.315
  600    H    CYS  47           H        CYS  47  -8.856  -3.263   4.200
  601    HA   CYS  47           HA       CYS  47  -7.602  -5.618   5.419
  602    HB2  CYS  47           2HB      CYS  47  -9.356  -5.241   3.160
  603    HB3  CYS  47           1HB      CYS  47  -7.887  -6.076   2.663
  604    H    LEU  48           H        LEU  48  -7.047  -3.137   2.954
  605    HA   LEU  48           HA       LEU  48  -4.447  -4.180   2.309
  606    HB2  LEU  48           2HB      LEU  48  -6.257  -2.268   1.190
  607    HB3  LEU  48           1HB      LEU  48  -4.693  -1.510   1.405
  608    HG   LEU  48           HG       LEU  48  -5.523  -3.632  -0.472
  609   HD11  LEU  48          1HD1      LEU  48  -4.448  -1.064  -0.574
  610   HD12  LEU  48          2HD1      LEU  48  -3.160  -2.136  -1.124
  611   HD13  LEU  48          3HD1      LEU  48  -4.731  -2.165  -1.923
  612   HD21  LEU  48          3HD2      LEU  48  -3.387  -4.680  -0.626
  613   HD22  LEU  48          1HD2      LEU  48  -2.701  -3.594   0.585
  614   HD23  LEU  48          2HD2      LEU  48  -3.911  -4.789   1.053
  615    H    LYS  49           H        LYS  49  -4.017  -4.110   4.699
  616    HA   LYS  49           HA       LYS  49  -2.590  -1.613   5.319
  617    HB2  LYS  49           2HB      LYS  49  -2.919  -2.642   7.780
  618    HB3  LYS  49           1HB      LYS  49  -4.065  -1.517   7.066
  619    HG2  LYS  49           2HG      LYS  49  -5.521  -3.104   7.753
  620    HG3  LYS  49           1HG      LYS  49  -5.133  -3.777   6.169
  621    HD2  LYS  49           2HD      LYS  49  -3.336  -5.129   7.302
  622    HD3  LYS  49           1HD      LYS  49  -4.001  -4.586   8.844
  623    HE2  LYS  49           2HE      LYS  49  -5.214  -6.479   8.670
  624    HE3  LYS  49           1HE      LYS  49  -6.248  -5.469   7.660
  625    HZ1  LYS  49           3HZ      LYS  49  -4.112  -7.311   6.709
  626    HZ2  LYS  49           1HZ      LYS  49  -5.038  -6.296   5.712
  627    HZ3  LYS  49           2HZ      LYS  49  -5.791  -7.551   6.567
  628    H    CYS  50           H        CYS  50  -0.712  -1.992   6.752
  629    HA   CYS  50           HA       CYS  50   0.969  -4.005   5.770
  630    HB2  CYS  50           2HB      CYS  50   1.779  -1.905   6.772
  631    HB3  CYS  50           1HB      CYS  50   1.214  -2.448   8.349
  632    H    SER  51           H        SER  51   1.517  -5.966   6.485
  633    HA   SER  51           HA       SER  51  -0.203  -7.273   8.390
  634    HB2  SER  51           2HB      SER  51   2.231  -8.636   7.363
  635    HB3  SER  51           1HB      SER  51   0.578  -9.234   7.492
  636    HG   SER  51           HG       SER  51   1.583  -7.419   5.542
  637    H    SER  52           H        SER  52   2.528  -5.384   8.644
  638    HA   SER  52           HA       SER  52   3.461  -6.793  11.055
  639    HB2  SER  52           2HB      SER  52   5.384  -4.879  10.171
  640    HB3  SER  52           1HB      SER  52   5.524  -6.636  10.217
  641    HG   SER  52           HG       SER  52   4.350  -5.132   8.105
  642    H    CYS  53           H        CYS  53   3.113  -3.477   9.713
  643    HA   CYS  53           HA       CYS  53   3.100  -2.428  12.444
  644    HB2  CYS  53           2HB      CYS  53   2.720  -0.722  10.003
  645    HB3  CYS  53           1HB      CYS  53   3.433  -0.292  11.551
  646    H    GLN  54           H        GLN  54   0.959  -3.266   9.916
  647    HA   GLN  54           HA       GLN  54  -1.281  -3.294   9.694
  648    HB2  GLN  54           2HB      GLN  54  -0.889  -3.208  12.549
  649    HB3  GLN  54           1HB      GLN  54  -2.344  -2.323  12.102
  650    HG2  GLN  54           2HG      GLN  54  -2.074  -4.888  10.736
  651    HG3  GLN  54           1HG      GLN  54  -2.177  -5.024  12.491
  652   HE21  GLN  54          1HE2      GLN  54  -3.674  -2.684  10.303
  653   HE22  GLN  54          2HE2      GLN  54  -5.306  -3.072  10.721
  654    H    ALA  55           H        ALA  55   0.299  -0.911   9.136
  655    HA   ALA  55           HA       ALA  55  -1.571   1.271   9.571
  656    HB1  ALA  55           1HB      ALA  55   0.183   2.596   9.169
  657    HB2  ALA  55           2HB      ALA  55   1.177   1.141   9.111
  658    HB3  ALA  55           3HB      ALA  55   0.505   1.811   7.624
  659    H    GLN  56           H        GLN  56  -2.873   2.178   7.974
  660    HA   GLN  56           HA       GLN  56  -3.727   0.355   5.939
  661    HB2  GLN  56           2HB      GLN  56  -4.546   3.240   6.247
  662    HB3  GLN  56           1HB      GLN  56  -5.447   1.944   5.484
  663    HG2  GLN  56           2HG      GLN  56  -5.475   0.851   7.797
  664    HG3  GLN  56           1HG      GLN  56  -4.984   2.436   8.396
  665   HE21  GLN  56          1HE2      GLN  56  -6.430   4.032   6.616
  666   HE22  GLN  56          2HE2      GLN  56  -8.121   3.845   6.945
  667    H    LEU  57           H        LEU  57  -1.817   0.154   4.680
  668    HA   LEU  57           HA       LEU  57  -0.448   2.329   3.530
  669    HB2  LEU  57           2HB      LEU  57  -0.583  -0.575   2.725
  670    HB3  LEU  57           1HB      LEU  57   0.515   0.588   2.002
  671    HG   LEU  57           HG       LEU  57   0.488  -0.136   4.932
  672   HD11  LEU  57          1HD1      LEU  57   2.853  -0.933   3.553
  673   HD12  LEU  57          2HD1      LEU  57   1.710  -1.919   4.470
  674   HD13  LEU  57          3HD1      LEU  57   1.445  -1.632   2.750
  675   HD21  LEU  57          3HD2      LEU  57   1.964   1.812   3.279
  676   HD22  LEU  57          1HD2      LEU  57   1.544   1.859   4.991
  677   HD23  LEU  57          2HD2      LEU  57   2.917   0.896   4.446
  678    H    GLY  58           H        GLY  58  -3.388   0.776   2.668
  679    HA2  GLY  58           1HA      GLY  58  -3.370   1.688  -0.073
  680    HA3  GLY  58           2HA      GLY  58  -4.709   0.926   0.772
  681    H    ASP  59           H        ASP  59  -4.230   3.025   2.979
  682    HA   ASP  59           HA       ASP  59  -5.956   5.013   1.725
  683    HB2  ASP  59           2HB      ASP  59  -7.205   4.659   3.556
  684    HB3  ASP  59           1HB      ASP  59  -5.920   3.741   4.318
  685    H    ILE  60           H        ILE  60  -2.905   4.550   2.895
  686    HA   ILE  60           HA       ILE  60  -2.301   7.422   2.913
  687    HB   ILE  60           HB       ILE  60  -0.414   5.168   3.641
  688   HG12  ILE  60          2HG1      ILE  60  -2.042   6.862   5.547
  689   HG13  ILE  60          1HG1      ILE  60  -2.460   5.214   5.095
  690   HG21  ILE  60          1HG2      ILE  60  -0.300   8.134   3.724
  691   HG22  ILE  60          2HG2      ILE  60   0.491   7.241   5.024
  692   HG23  ILE  60          3HG2      ILE  60   0.959   6.960   3.347
  693   HD11  ILE  60          3HD1      ILE  60  -1.196   5.627   7.298
  694   HD12  ILE  60          1HD1      ILE  60  -0.674   4.308   6.248
  695   HD13  ILE  60          2HD1      ILE  60   0.220   5.829   6.264
  696    H    GLY  61           H        GLY  61  -0.832   8.273   1.423
  697    HA2  GLY  61           1HA      GLY  61  -0.758   6.948  -1.109
  698    HA3  GLY  61           2HA      GLY  61  -0.008   8.487  -0.722
  699    H    THR  62           H        THR  62   0.470   5.087   0.241
  700    HA   THR  62           HA       THR  62   3.365   5.496   0.013
  701    HB   THR  62           HB       THR  62   2.133   3.026   1.161
  702    HG1  THR  62           1HG      THR  62   1.105   4.330   2.504
  703   HG21  THR  62          3HG2      THR  62   4.627   3.375   0.791
  704   HG22  THR  62          1HG2      THR  62   4.129   2.882   2.408
  705   HG23  THR  62          2HG2      THR  62   4.545   4.565   2.090
  706    H    SER  63           H        SER  63   4.564   4.438  -1.471
  707    HA   SER  63           HA       SER  63   3.266   2.537  -3.251
  708    HB2  SER  63           2HB      SER  63   6.094   2.858  -3.736
  709    HB3  SER  63           1HB      SER  63   4.737   3.308  -4.767
  710    HG   SER  63           HG       SER  63   4.567   5.251  -3.470
  711    H    SER  64           H        SER  64   2.943   0.929  -1.612
  712    HA   SER  64           HA       SER  64   5.091  -0.127  -0.081
  713    HB2  SER  64           2HB      SER  64   2.985  -2.023  -0.271
  714    HB3  SER  64           1HB      SER  64   3.320  -0.904   1.053
  715    HG   SER  64           HG       SER  64   1.219  -0.875  -0.409
  716    H    TYR  65           H        TYR  65   5.868  -2.333  -0.178
  717    HA   TYR  65           HA       TYR  65   6.001  -3.353  -2.938
  718    HB2  TYR  65           2HB      TYR  65   8.200  -3.842  -0.956
  719    HB3  TYR  65           1HB      TYR  65   8.271  -3.846  -2.714
  720    HD1  TYR  65           2HD      TYR  65   8.131  -1.621  -3.926
  721    HD2  TYR  65           1HD      TYR  65   8.737  -1.919   0.272
  722    HE1  TYR  65           2HE      TYR  65   8.977   0.685  -3.892
  723    HE2  TYR  65           1HE      TYR  65   9.591   0.387   0.319
  724    HH   TYR  65           HH       TYR  65  10.726   1.975  -2.082
  725    H    THR  66           H        THR  66   6.526  -5.697  -3.042
  726    HA   THR  66           HA       THR  66   5.843  -7.243  -0.698
  727    HB   THR  66           HB       THR  66   3.663  -6.580  -1.853
  728    HG1  THR  66           1HG      THR  66   3.557  -8.231  -0.414
  729   HG21  THR  66          3HG2      THR  66   4.932  -7.488  -4.126
  730   HG22  THR  66          1HG2      THR  66   3.198  -7.209  -3.954
  731   HG23  THR  66          2HG2      THR  66   3.859  -8.825  -3.707
  732    H    LYS  67           H        LYS  67   5.868  -9.598  -1.211
  733    HA   LYS  67           HA       LYS  67   7.559 -10.313  -3.483
  734    HB2  LYS  67           2HB      LYS  67   8.590 -10.006  -0.919
  735    HB3  LYS  67           1HB      LYS  67   8.328 -11.740  -1.057
  736    HG2  LYS  67           2HG      LYS  67   9.853 -11.966  -2.777
  737    HG3  LYS  67           1HG      LYS  67   9.741 -10.267  -3.239
  738    HD2  LYS  67           2HD      LYS  67  11.094  -9.577  -1.471
  739    HD3  LYS  67           1HD      LYS  67  10.843 -11.070  -0.569
  740    HE2  LYS  67           2HE      LYS  67  12.799 -11.751  -1.382
  741    HE3  LYS  67           1HE      LYS  67  11.996 -11.907  -2.945
  742    HZ1  LYS  67           3HZ      LYS  67  13.010  -9.265  -2.173
  743    HZ2  LYS  67           1HZ      LYS  67  12.909  -9.985  -3.709
  744    HZ3  LYS  67           2HZ      LYS  67  14.134 -10.443  -2.636
  745    H    SER  68           H        SER  68   6.322 -11.872  -0.537
  746    HA   SER  68           HA       SER  68   5.201 -14.024  -2.146
  747    HB2  SER  68           2HB      SER  68   4.914 -14.062   0.798
  748    HB3  SER  68           1HB      SER  68   5.473 -15.327  -0.298
  749    HG   SER  68           HG       SER  68   7.485 -14.535  -0.237
  750    H    GLY  69           H        GLY  69   4.007 -11.266  -2.003
  751    HA2  GLY  69           1HA      GLY  69   1.803 -10.559  -2.222
  752    HA3  GLY  69           2HA      GLY  69   1.277 -12.137  -1.649
  753    H    MET  70           H        MET  70   3.600 -10.643   0.325
  754    HA   MET  70           HA       MET  70   1.591 -10.181   2.380
  755    HB2  MET  70           2HB      MET  70   4.474 -10.724   2.311
  756    HB3  MET  70           1HB      MET  70   4.022  -9.504   3.496
  757    HG2  MET  70           2HG      MET  70   2.300 -11.147   4.342
  758    HG3  MET  70           1HG      MET  70   3.079 -12.353   3.319
  759    HE1  MET  70           3HE      MET  70   4.617 -13.930   4.222
  760    HE2  MET  70           1HE      MET  70   5.235 -13.885   5.874
  761    HE3  MET  70           2HE      MET  70   3.495 -13.891   5.583
  762    H    ILE  71           H        ILE  71   0.969  -8.207   3.089
  763    HA   ILE  71           HA       ILE  71   1.881  -5.882   1.603
  764    HB   ILE  71           HB       ILE  71  -0.034  -5.572   3.858
  765   HG12  ILE  71          2HG1      ILE  71  -1.756  -6.224   1.849
  766   HG13  ILE  71          1HG1      ILE  71  -0.465  -7.387   1.571
  767   HG21  ILE  71          1HG2      ILE  71  -0.997  -4.428   1.497
  768   HG22  ILE  71          2HG2      ILE  71  -0.203  -3.605   2.841
  769   HG23  ILE  71          3HG2      ILE  71   0.749  -4.179   1.470
  770   HD11  ILE  71          3HD1      ILE  71  -2.439  -7.236   3.734
  771   HD12  ILE  71          1HD1      ILE  71  -1.615  -8.631   3.036
  772   HD13  ILE  71          2HD1      ILE  71  -0.795  -7.633   4.242
  773    H    LEU  72           H        LEU  72   3.603  -4.797   2.275
  774    HA   LEU  72           HA       LEU  72   3.984  -4.312   5.132
  775    HB2  LEU  72           2HB      LEU  72   5.697  -5.953   3.386
  776    HB3  LEU  72           1HB      LEU  72   6.558  -4.746   4.322
  777    HG   LEU  72           HG       LEU  72   5.169  -5.779   6.319
  778   HD11  LEU  72          1HD1      LEU  72   5.492  -8.230   4.634
  779   HD12  LEU  72          2HD1      LEU  72   4.596  -8.020   6.140
  780   HD13  LEU  72          3HD1      LEU  72   3.985  -7.313   4.642
  781   HD21  LEU  72          3HD2      LEU  72   7.306  -7.623   5.583
  782   HD22  LEU  72          1HD2      LEU  72   7.757  -5.922   5.458
  783   HD23  LEU  72          2HD2      LEU  72   7.154  -6.563   6.986
  784    H    CYS  73           H        CYS  73   5.546  -2.547   5.538
  785    HA   CYS  73           HA       CYS  73   5.222  -0.500   3.517
  786    HB2  CYS  73           2HB      CYS  73   6.625  -0.092   6.143
  787    HB3  CYS  73           1HB      CYS  73   5.775   1.087   5.155
  788    H    ARG  74           H        ARG  74   7.419   1.096   3.967
  789    HA   ARG  74           HA       ARG  74   9.127  -0.018   2.012
  790    HB2  ARG  74           2HB      ARG  74   9.900   2.347   3.683
  791    HB3  ARG  74           1HB      ARG  74  10.221   2.041   1.981
  792    HG2  ARG  74           2HG      ARG  74   7.376   2.265   2.690
  793    HG3  ARG  74           1HG      ARG  74   8.333   3.733   2.905
  794    HD2  ARG  74           2HD      ARG  74   9.234   3.051   0.512
  795    HD3  ARG  74           1HD      ARG  74   7.671   2.241   0.424
  796    HE   ARG  74           HE       ARG  74   7.123   4.788   1.310
  797   HH11  ARG  74          2HH1      ARG  74   8.687   3.365  -1.481
  798   HH12  ARG  74          1HH1      ARG  74   8.219   4.645  -2.564
  799   HH21  ARG  74          2HH2      ARG  74   6.492   6.484  -0.110
  800   HH22  ARG  74          1HH2      ARG  74   6.991   6.433  -1.781
  801    H    ASN  75           H        ASN  75   9.756   0.793   5.442
  802    HA   ASN  75           HA       ASN  75  12.453  -0.181   5.231
  803    HB2  ASN  75           2HB      ASN  75  12.747   1.194   6.965
  804    HB3  ASN  75           1HB      ASN  75  11.021   1.515   6.988
  805   HD21  ASN  75          1HD2      ASN  75   9.741   0.548   8.519
  806   HD22  ASN  75          2HD2      ASN  75  10.380  -0.328   9.871
  807    H    ASP  76           H        ASP  76   9.468  -1.340   6.731
  808    HA   ASP  76           HA       ASP  76  10.710  -3.487   8.103
  809    HB2  ASP  76           2HB      ASP  76   8.131  -4.319   7.948
  810    HB3  ASP  76           1HB      ASP  76   8.732  -3.181   9.145
  811    H    TYR  77           H        TYR  77   9.249  -3.204   4.907
  812    HA   TYR  77           HA       TYR  77   9.183  -5.982   4.369
  813    HB2  TYR  77           2HB      TYR  77   7.880  -4.698   2.906
  814    HB3  TYR  77           1HB      TYR  77   9.177  -3.542   2.615
  815    HD1  TYR  77           2HD      TYR  77   8.377  -7.158   2.106
  816    HD2  TYR  77           1HD      TYR  77  10.375  -3.689   0.652
  817    HE1  TYR  77           2HE      TYR  77   9.033  -8.387   0.079
  818    HE2  TYR  77           1HE      TYR  77  11.043  -4.911  -1.373
  819    HH   TYR  77           HH       TYR  77  11.410  -7.623  -1.820
  820    H    ILE  78           H        ILE  78  11.623  -3.483   3.775
  821    HA   ILE  78           HA       ILE  78  13.450  -5.089   2.367
  822    HB   ILE  78           HB       ILE  78  13.899  -2.644   4.085
  823   HG12  ILE  78          2HG1      ILE  78  12.576  -2.194   2.122
  824   HG13  ILE  78          1HG1      ILE  78  14.192  -1.548   1.864
  825   HG21  ILE  78          1HG2      ILE  78  16.042  -3.374   4.116
  826   HG22  ILE  78          2HG2      ILE  78  15.838  -4.382   2.683
  827   HG23  ILE  78          3HG2      ILE  78  16.058  -2.640   2.511
  828   HD11  ILE  78          3HD1      ILE  78  13.172  -4.160   0.773
  829   HD12  ILE  78          1HD1      ILE  78  13.296  -2.648  -0.126
  830   HD13  ILE  78          2HD1      ILE  78  14.753  -3.442   0.467
  831    H    ARG  79           H        ARG  79  13.019  -4.467   5.813
  832    HA   ARG  79           HA       ARG  79  15.277  -5.917   6.701
  833    HB2  ARG  79           2HB      ARG  79  14.263  -4.378   8.203
  834    HB3  ARG  79           1HB      ARG  79  12.685  -5.133   8.027
  835    HG2  ARG  79           2HG      ARG  79  13.127  -6.234   9.897
  836    HG3  ARG  79           1HG      ARG  79  14.304  -7.169   8.976
  837    HD2  ARG  79           2HD      ARG  79  15.985  -5.372   9.513
  838    HD3  ARG  79           1HD      ARG  79  14.793  -4.697  10.623
  839    HE   ARG  79           HE       ARG  79  15.494  -7.504  10.978
  840   HH11  ARG  79          2HH1      ARG  79  15.920  -4.179  12.007
  841   HH12  ARG  79          1HH1      ARG  79  16.561  -4.607  13.558
  842   HH21  ARG  79          2HH2      ARG  79  16.356  -8.075  13.023
  843   HH22  ARG  79          1HH2      ARG  79  16.802  -6.818  14.146
  844    H    LEU  80           H        LEU  80  11.876  -6.832   6.274
  845    HA   LEU  80           HA       LEU  80  12.214  -9.457   7.323
  846    HB2  LEU  80           2HB      LEU  80  10.091  -7.793   6.831
  847    HB3  LEU  80           1HB      LEU  80   9.906  -9.003   5.572
  848    HG   LEU  80           HG       LEU  80  10.407 -10.057   8.287
  849   HD11  LEU  80          1HD1      LEU  80   8.852  -8.819   9.289
  850   HD12  LEU  80          2HD1      LEU  80   8.280  -8.152   7.761
  851   HD13  LEU  80          3HD1      LEU  80   7.680  -9.713   8.322
  852   HD21  LEU  80          3HD2      LEU  80   8.441 -11.502   7.470
  853   HD22  LEU  80          1HD2      LEU  80   8.714 -10.722   5.912
  854   HD23  LEU  80          2HD2      LEU  80  10.000 -11.667   6.659
  855    H    PHE  81           H        PHE  81  11.548  -8.287   4.013
  856    HA   PHE  81           HA       PHE  81  12.394 -10.927   3.017
  857    HB2  PHE  81           2HB      PHE  81  10.607  -8.827   1.787
  858    HB3  PHE  81           1HB      PHE  81  11.157 -10.266   0.938
  859    HD1  PHE  81           1HD      PHE  81  10.427 -12.507   1.722
  860    HD2  PHE  81           2HD      PHE  81   8.818  -8.905   3.307
  861    HE1  PHE  81           1HE      PHE  81   8.501 -13.763   2.601
  862    HE2  PHE  81           2HE      PHE  81   6.889 -10.152   4.193
  863    HZ   PHE  81           HZ       PHE  81   6.730 -12.590   3.841
  864    H    GLY  82           H        GLY  82  12.396  -7.535   1.909
  865    HA2  GLY  82           1HA      GLY  82  14.004  -6.337   0.774
  866    HA3  GLY  82           2HA      GLY  82  15.154  -7.613   1.156
  Start of MODEL    6
    1    H    SER 641           1H       SER 641  21.514  21.780 -22.681
    2    HA   SER 641           HA       SER 641  21.717  22.911 -20.205
    3    HB2  SER 641           2HB      SER 641  20.839  20.158 -20.121
    4    HB3  SER 641           1HB      SER 641  19.880  21.636 -20.001
    5    HG   SER 641           HG       SER 641  19.333  20.293 -21.835
    6    H    LEU 642           H        LEU 642  22.588  22.280 -18.233
    7    HA   LEU 642           HA       LEU 642  24.790  20.322 -18.410
    8    HB2  LEU 642           2HB      LEU 642  24.625  22.995 -17.066
    9    HB3  LEU 642           1HB      LEU 642  25.711  21.768 -16.440
   10    HG   LEU 642           HG       LEU 642  25.972  22.177 -19.326
   11   HD11  LEU 642          1HD1      LEU 642  26.424  24.361 -19.449
   12   HD12  LEU 642          2HD1      LEU 642  25.514  24.491 -17.943
   13   HD13  LEU 642          3HD1      LEU 642  27.273  24.364 -17.902
   14   HD21  LEU 642          3HD2      LEU 642  27.453  20.938 -17.556
   15   HD22  LEU 642          1HD2      LEU 642  28.198  21.806 -18.900
   16   HD23  LEU 642          2HD2      LEU 642  28.129  22.548 -17.303
   17    H    GLN 643           H        GLN 643  21.934  21.310 -16.792
   18    HA   GLN 643           HA       GLN 643  22.404  19.254 -14.736
   19    HB2  GLN 643           2HB      GLN 643  22.165  21.459 -13.735
   20    HB3  GLN 643           1HB      GLN 643  20.660  21.721 -14.603
   21    HG2  GLN 643           2HG      GLN 643  20.334  21.148 -12.229
   22    HG3  GLN 643           1HG      GLN 643  19.559  20.013 -13.331
   23   HE21  GLN 643          1HE2      GLN 643  19.513  18.296 -11.968
   24   HE22  GLN 643          2HE2      GLN 643  20.932  17.479 -11.387
   25    H    ASN 644           H        ASN 644  21.243  17.497 -14.943
   26    HA   ASN 644           HA       ASN 644  18.469  17.533 -15.621
   27    HB2  ASN 644           2HB      ASN 644  18.467  16.389 -17.675
   28    HB3  ASN 644           1HB      ASN 644  19.702  17.624 -17.877
   29   HD21  ASN 644          1HD2      ASN 644  19.001  14.490 -18.452
   30   HD22  ASN 644          2HD2      ASN 644  20.604  13.842 -18.546
   31    H    ASN 645           H        ASN 645  21.416  15.777 -15.019
   32    HA   ASN 645           HA       ASN 645  21.917  14.062 -13.644
   33    HB2  ASN 645           2HB      ASN 645  20.341  15.241 -12.077
   34    HB3  ASN 645           1HB      ASN 645  19.070  14.162 -12.650
   35   HD21  ASN 645          1HD2      ASN 645  22.486  13.575 -11.910
   36   HD22  ASN 645          2HD2      ASN 645  22.197  12.349 -10.724
   37    H    GLN 646           H        GLN 646  22.092  12.879 -15.629
   38    HA   GLN 646           HA       GLN 646  20.672  10.405 -15.466
   39    HB2  GLN 646           2HB      GLN 646  19.267  12.152 -16.917
   40    HB3  GLN 646           1HB      GLN 646  20.386  11.631 -18.170
   41    HG2  GLN 646           2HG      GLN 646  18.808  10.070 -18.528
   42    HG3  GLN 646           1HG      GLN 646  19.645   9.241 -17.216
   43   HE21  GLN 646          1HE2      GLN 646  17.323  11.920 -17.364
   44   HE22  GLN 646          2HE2      GLN 646  16.187  11.220 -16.255
   45    H    ASP 647           H        ASP 647  22.967   9.993 -15.066
   46    HA   ASP 647           HA       ASP 647  24.918  10.229 -17.104
   47    HB2  ASP 647           2HB      ASP 647  25.268   9.751 -14.596
   48    HB3  ASP 647           1HB      ASP 647  24.923   8.072 -14.998
   49    H    VAL 648           H        VAL 648  24.786   9.301 -19.032
   50    HA   VAL 648           HA       VAL 648  23.168   6.878 -19.317
   51    HB   VAL 648           HB       VAL 648  23.336   7.420 -21.797
   52   HG11  VAL 648          1HG1      VAL 648  21.519   8.086 -19.964
   53   HG12  VAL 648          2HG1      VAL 648  21.995   9.704 -20.478
   54   HG13  VAL 648          3HG1      VAL 648  21.377   8.549 -21.659
   55   HG21  VAL 648          3HG2      VAL 648  24.673   9.066 -22.462
   56   HG22  VAL 648          1HG2      VAL 648  23.711  10.215 -21.532
   57   HG23  VAL 648          2HG2      VAL 648  25.098   9.420 -20.789
   58    H    SER 649           H        SER 649  26.258   7.370 -18.691
   59    HA   SER 649           HA       SER 649  27.535   5.801 -20.711
   60    HB2  SER 649           2HB      SER 649  28.676   5.995 -17.958
   61    HB3  SER 649           1HB      SER 649  29.483   6.122 -19.521
   62    HG   SER 649           HG       SER 649  28.118   8.068 -18.035
   63    H    PHE 650           H        PHE 650  27.237   3.702 -20.999
   64    HA   PHE 650           HA       PHE 650  25.763   2.147 -19.131
   65    HB2  PHE 650           2HB      PHE 650  27.173   1.517 -21.708
   66    HB3  PHE 650           1HB      PHE 650  26.439   0.247 -20.736
   67    HD1  PHE 650           1HD      PHE 650  23.956   0.549 -20.119
   68    HD2  PHE 650           2HD      PHE 650  25.892   2.684 -23.246
   69    HE1  PHE 650           1HE      PHE 650  21.768   1.043 -21.128
   70    HE2  PHE 650           2HE      PHE 650  23.708   3.182 -24.265
   71    HZ   PHE 650           HZ       PHE 650  21.645   2.364 -23.204
   72    H    GLU 651           H        GLU 651  29.023   2.942 -19.321
   73    HA   GLU 651           HA       GLU 651  30.248   0.671 -18.203
   74    HB2  GLU 651           2HB      GLU 651  30.918   3.609 -18.038
   75    HB3  GLU 651           1HB      GLU 651  31.946   2.353 -17.363
   76    HG2  GLU 651           2HG      GLU 651  31.137   2.152 -20.215
   77    HG3  GLU 651           1HG      GLU 651  32.370   3.326 -19.761
   78    H    ASN 652           H        ASN 652  28.308   3.218 -16.857
   79    HA   ASN 652           HA       ASN 652  28.938   2.791 -14.116
   80    HB2  ASN 652           2HB      ASN 652  27.385   4.601 -15.583
   81    HB3  ASN 652           1HB      ASN 652  26.235   3.752 -14.559
   82   HD21  ASN 652          1HD2      ASN 652  27.166   6.526 -14.496
   83   HD22  ASN 652          2HD2      ASN 652  27.792   6.781 -12.905
   84    H    ILE 653           H        ILE 653  26.879   1.235 -16.402
   85    HA   ILE 653           HA       ILE 653  25.935  -0.577 -14.285
   86    HB   ILE 653           HB       ILE 653  24.192  -0.622 -16.591
   87   HG12  ILE 653          2HG1      ILE 653  23.487   1.836 -15.250
   88   HG13  ILE 653          1HG1      ILE 653  25.092   1.972 -15.962
   89   HG21  ILE 653          1HG2      ILE 653  24.012  -1.299 -14.021
   90   HG22  ILE 653          2HG2      ILE 653  23.251   0.290 -13.941
   91   HG23  ILE 653          3HG2      ILE 653  22.600  -0.946 -15.018
   92   HD11  ILE 653          3HD1      ILE 653  22.858   2.532 -17.297
   93   HD12  ILE 653          1HD1      ILE 653  24.306   1.897 -18.079
   94   HD13  ILE 653          2HD1      ILE 653  22.977   0.812 -17.667
   95    H    GLN 654           H        GLN 654  28.254  -1.154 -15.374
   96    HA   GLN 654           HA       GLN 654  27.872  -2.923 -17.663
   97    HB2  GLN 654           2HB      GLN 654  30.181  -1.700 -16.272
   98    HB3  GLN 654           1HB      GLN 654  30.454  -3.301 -16.945
   99    HG2  GLN 654           2HG      GLN 654  29.119  -1.807 -18.918
  100    HG3  GLN 654           1HG      GLN 654  30.392  -0.777 -18.259
  101   HE21  GLN 654          1HE2      GLN 654  32.385  -1.053 -18.985
  102   HE22  GLN 654          2HE2      GLN 654  32.938  -2.409 -19.915
  103    H    TRP 655           H        TRP 655  27.472  -3.096 -14.421
  104    HA   TRP 655           HA       TRP 655  28.387  -5.857 -14.169
  105    HB2  TRP 655           2HB      TRP 655  27.894  -5.494 -11.703
  106    HB3  TRP 655           1HB      TRP 655  29.234  -4.570 -12.367
  107    HD1  TRP 655           HD       TRP 655  28.126  -1.933 -13.305
  108    HE1  TRP 655           1HE      TRP 655  26.821  -0.319 -11.788
  109    HE3  TRP 655           3HE      TRP 655  26.650  -5.245  -9.695
  110    HZ2  TRP 655           2HZ      TRP 655  25.373  -0.436  -9.363
  111    HZ3  TRP 655           3HZ      TRP 655  25.314  -4.405  -7.805
  112    HH2  TRP 655           HH       TRP 655  24.691  -2.047  -7.647
  113    H    SER 656           H        SER 656  26.863  -7.161 -12.639
  114    HA   SER 656           HA       SER 656  24.243  -7.065 -13.949
  115    HB2  SER 656           2HB      SER 656  24.574  -9.449 -12.433
  116    HB3  SER 656           1HB      SER 656  24.533  -9.267 -14.188
  117    HG   SER 656           HG       SER 656  26.852  -8.908 -12.573
  118    H    ILE 657           H        ILE 657  22.642  -6.183 -12.837
  119    HA   ILE 657           HA       ILE 657  22.595  -6.544  -9.912
  120    HB   ILE 657           HB       ILE 657  20.718  -4.554 -10.628
  121   HG12  ILE 657          2HG1      ILE 657  22.953  -3.043 -11.360
  122   HG13  ILE 657          1HG1      ILE 657  23.057  -4.504 -12.342
  123   HG21  ILE 657          1HG2      ILE 657  23.340  -4.503  -9.168
  124   HG22  ILE 657          2HG2      ILE 657  22.247  -3.121  -9.245
  125   HG23  ILE 657          3HG2      ILE 657  21.716  -4.627  -8.493
  126   HD11  ILE 657          3HD1      ILE 657  20.376  -3.688 -12.424
  127   HD12  ILE 657          1HD1      ILE 657  21.351  -2.235 -12.650
  128   HD13  ILE 657          2HD1      ILE 657  21.573  -3.620 -13.718
  129    H    ASP 658           H        ASP 658  20.171  -6.175  -9.182
  130    HA   ASP 658           HA       ASP 658  18.728  -8.439 -10.085
  131    HB2  ASP 658           2HB      ASP 658  18.667  -7.318  -7.769
  132    HB3  ASP 658           1HB      ASP 658  17.565  -6.154  -8.493
  133    HA   PRO 659           HA       PRO 659  16.386  -6.849 -13.548
  134    HB2  PRO 659           2HB      PRO 659  13.973  -8.099 -12.855
  135    HB3  PRO 659           1HB      PRO 659  15.231  -8.768 -13.897
  136    HG2  PRO 659           2HG      PRO 659  14.701  -9.268 -11.004
  137    HG3  PRO 659           1HG      PRO 659  15.295 -10.381 -12.252
  138    HD2  PRO 659           2HD      PRO 659  16.942  -9.345 -10.416
  139    HD3  PRO 659           1HD      PRO 659  17.472  -9.595 -12.093
  140    H    GLY 660           H        GLY 660  15.135  -6.751 -10.259
  141    HA2  GLY 660           1HA      GLY 660  13.785  -4.202 -10.925
  142    HA3  GLY 660           2HA      GLY 660  13.204  -5.315  -9.690
  143    H    ALA 661           H        ALA 661  16.334  -3.833 -10.516
  144    HA   ALA 661           HA       ALA 661  17.268  -3.792  -7.847
  145    HB1  ALA 661           1HB      ALA 661  18.954  -2.107  -8.866
  146    HB2  ALA 661           2HB      ALA 661  18.957  -3.777  -9.434
  147    HB3  ALA 661           3HB      ALA 661  18.182  -2.521 -10.399
  148    H    ASP 662           H        ASP 662  15.302  -1.612  -9.666
  149    HA   ASP 662           HA       ASP 662  15.545   0.440  -7.589
  150    HB2  ASP 662           2HB      ASP 662  14.369   1.932  -9.116
  151    HB3  ASP 662           1HB      ASP 662  15.745   1.201  -9.931
  152    H    LEU 663           H        LEU 663  14.089  -2.246  -7.611
  153    HA   LEU 663           HA       LEU 663  12.251  -3.171  -6.683
  154    HB2  LEU 663           2HB      LEU 663  11.924  -0.416  -5.499
  155    HB3  LEU 663           1HB      LEU 663  11.049  -1.843  -4.976
  156    HG   LEU 663           HG       LEU 663  14.037  -1.430  -4.786
  157   HD11  LEU 663          1HD1      LEU 663  12.462  -0.145  -3.228
  158   HD12  LEU 663          2HD1      LEU 663  12.108  -1.717  -2.510
  159   HD13  LEU 663          3HD1      LEU 663  13.758  -1.093  -2.496
  160   HD21  LEU 663          3HD2      LEU 663  12.360  -3.813  -4.594
  161   HD22  LEU 663          1HD2      LEU 663  14.106  -3.666  -4.780
  162   HD23  LEU 663          2HD2      LEU 663  13.378  -3.550  -3.179
  163    H    SER 664           H        SER 664  11.975  -2.115  -9.312
  164    HA   SER 664           HA       SER 664   9.649  -0.570  -9.659
  165    HB2  SER 664           2HB      SER 664   9.945  -2.036 -11.989
  166    HB3  SER 664           1HB      SER 664  10.736  -0.497 -11.635
  167    HG   SER 664           HG       SER 664  12.586  -1.493 -11.310
  168    H    GLN 665           H        GLN 665  10.165  -4.033 -10.320
  169    HA   GLN 665           HA       GLN 665   7.327  -4.490 -10.524
  170    HB2  GLN 665           2HB      GLN 665   9.625  -6.459 -10.559
  171    HB3  GLN 665           1HB      GLN 665   7.956  -6.826 -10.974
  172    HG2  GLN 665           2HG      GLN 665   8.767  -6.517 -13.058
  173    HG3  GLN 665           1HG      GLN 665   8.351  -4.842 -12.691
  174   HE21  GLN 665          1HE2      GLN 665   9.865  -3.916 -14.000
  175   HE22  GLN 665          2HE2      GLN 665  11.565  -4.022 -13.701
  176    H    TYR 666           H        TYR 666   9.530  -4.365  -8.002
  177    HA   TYR 666           HA       TYR 666   8.382  -6.396  -6.332
  178    HB2  TYR 666           2HB      TYR 666  10.255  -4.099  -5.753
  179    HB3  TYR 666           1HB      TYR 666   9.676  -5.207  -4.507
  180    HD1  TYR 666           2HD      TYR 666  11.454  -5.164  -7.782
  181    HD2  TYR 666           1HD      TYR 666  10.826  -7.179  -4.094
  182    HE1  TYR 666           2HE      TYR 666  13.256  -6.735  -8.341
  183    HE2  TYR 666           1HE      TYR 666  12.630  -8.757  -4.642
  184    HH   TYR 666           HH       TYR 666  14.637  -8.314  -7.514
  185    H    LYS 667           H        LYS 667   7.982  -2.948  -6.806
  186    HA   LYS 667           HA       LYS 667   6.246  -2.574  -4.593
  187    HB2  LYS 667           2HB      LYS 667   6.757  -0.480  -5.139
  188    HB3  LYS 667           1HB      LYS 667   7.330  -0.954  -6.730
  189    HG2  LYS 667           2HG      LYS 667   4.540  -1.044  -6.892
  190    HG3  LYS 667           1HG      LYS 667   4.913   0.416  -5.973
  191    HD2  LYS 667           2HD      LYS 667   5.821   1.450  -7.757
  192    HD3  LYS 667           1HD      LYS 667   6.608  -0.022  -8.333
  193    HE2  LYS 667           2HE      LYS 667   5.074  -0.029  -9.954
  194    HE3  LYS 667           1HE      LYS 667   3.937  -0.559  -8.715
  195    HZ1  LYS 667           3HZ      LYS 667   2.878   1.263  -9.604
  196    HZ2  LYS 667           1HZ      LYS 667   4.317   2.128  -9.861
  197    HZ3  LYS 667           2HZ      LYS 667   3.691   1.972  -8.293
  198    H    MET 668           H        MET 668   4.149  -2.867  -4.408
  199    HA   MET 668           HA       MET 668   2.729  -4.064  -6.663
  200    HB2  MET 668           2HB      MET 668   0.893  -4.105  -4.679
  201    HB3  MET 668           1HB      MET 668   2.067  -5.381  -4.944
  202    HG2  MET 668           2HG      MET 668   3.556  -4.259  -3.294
  203    HG3  MET 668           1HG      MET 668   2.239  -3.140  -2.953
  204    HE1  MET 668           3HE      MET 668   0.118  -3.628  -2.228
  205    HE2  MET 668           1HE      MET 668  -0.463  -5.064  -1.386
  206    HE3  MET 668           2HE      MET 668   0.610  -3.934  -0.561
  207    H    ASP 669           H        ASP 669   1.433  -2.919  -7.896
  208    HA   ASP 669           HA       ASP 669   1.096  -0.128  -7.388
  209    HB2  ASP 669           2HB      ASP 669   1.307  -1.428  -9.678
  210    HB3  ASP 669           1HB      ASP 669  -0.446  -1.525  -9.536
  211    H    VAL 670           H        VAL 670  -0.275   0.478  -5.854
  212    HA   VAL 670           HA       VAL 670  -2.651  -1.055  -5.293
  213    HB   VAL 670           HB       VAL 670  -1.819   1.586  -4.075
  214   HG11  VAL 670          1HG1      VAL 670  -3.560   1.399  -2.680
  215   HG12  VAL 670          2HG1      VAL 670  -4.206   0.265  -3.865
  216   HG13  VAL 670          3HG1      VAL 670  -3.318  -0.334  -2.462
  217   HG21  VAL 670          3HG2      VAL 670  -0.392  -0.762  -3.913
  218   HG22  VAL 670          1HG2      VAL 670  -0.331   0.566  -2.753
  219   HG23  VAL 670          2HG2      VAL 670  -1.401  -0.806  -2.465
  220    H    THR 671           H        THR 671  -4.268  -0.857  -6.642
  221    HA   THR 671           HA       THR 671  -4.869   1.699  -7.897
  222    HB   THR 671           HB       THR 671  -6.551  -0.750  -8.307
  223    HG1  THR 671           1HG      THR 671  -3.934  -0.831  -8.505
  224   HG21  THR 671          3HG2      THR 671  -5.483   1.234 -10.311
  225   HG22  THR 671          1HG2      THR 671  -6.975   1.504  -9.406
  226   HG23  THR 671          2HG2      THR 671  -6.839   0.123 -10.495
  227    H    VAL 672           H        VAL 672  -5.964   3.073  -6.655
  228    HA   VAL 672           HA       VAL 672  -7.806   2.107  -4.633
  229    HB   VAL 672           HB       VAL 672  -7.185   4.987  -5.285
  230   HG11  VAL 672          1HG1      VAL 672  -7.788   4.089  -2.539
  231   HG12  VAL 672          2HG1      VAL 672  -8.294   5.544  -3.396
  232   HG13  VAL 672          3HG1      VAL 672  -9.121   4.015  -3.690
  233   HG21  VAL 672          3HG2      VAL 672  -5.175   4.848  -4.328
  234   HG22  VAL 672          1HG2      VAL 672  -5.811   3.931  -2.964
  235   HG23  VAL 672          2HG2      VAL 672  -5.332   3.096  -4.442
  236    H    ILE 673           H        ILE 673  -9.833   1.720  -5.115
  237    HA   ILE 673           HA       ILE 673 -11.059   2.858  -7.482
  238    HB   ILE 673           HB       ILE 673 -11.853   0.756  -5.490
  239   HG12  ILE 673          2HG1      ILE 673 -12.375  -0.134  -8.048
  240   HG13  ILE 673          1HG1      ILE 673 -10.966   0.898  -8.275
  241   HG21  ILE 673          1HG2      ILE 673 -14.063   0.714  -6.067
  242   HG22  ILE 673          2HG2      ILE 673 -13.763   2.451  -6.160
  243   HG23  ILE 673          3HG2      ILE 673 -13.781   1.475  -7.634
  244   HD11  ILE 673          3HD1      ILE 673  -9.665  -0.403  -6.793
  245   HD12  ILE 673          1HD1      ILE 673 -11.081  -1.275  -6.206
  246   HD13  ILE 673          2HD1      ILE 673 -10.505  -1.536  -7.853
  247    H    ASP 674           H        ASP 674 -11.879   4.840  -7.357
  248    HA   ASP 674           HA       ASP 674 -12.935   5.842  -4.842
  249    HB2  ASP 674           2HB      ASP 674 -13.415   7.877  -6.503
  250    HB3  ASP 674           1HB      ASP 674 -11.830   7.609  -5.792
  251    H    THR 675           H        THR 675 -14.639   4.294  -4.781
  252    HA   THR 675           HA       THR 675 -16.670   3.358  -5.258
  253    HB   THR 675           HB       THR 675 -17.898   5.969  -5.862
  254    HG1  THR 675           1HG      THR 675 -16.360   6.860  -4.570
  255   HG21  THR 675          3HG2      THR 675 -18.410   3.554  -4.303
  256   HG22  THR 675          1HG2      THR 675 -19.547   4.697  -5.018
  257   HG23  THR 675          2HG2      THR 675 -18.831   5.033  -3.441
  258    H    LYS 676           H        LYS 676 -15.120   3.200  -7.517
  259    HA   LYS 676           HA       LYS 676 -16.785   4.130  -9.742
  260    HB2  LYS 676           2HB      LYS 676 -14.865   3.876 -11.147
  261    HB3  LYS 676           1HB      LYS 676 -14.346   4.712  -9.691
  262    HG2  LYS 676           2HG      LYS 676 -12.885   3.117  -9.176
  263    HG3  LYS 676           1HG      LYS 676 -14.066   1.835  -9.456
  264    HD2  LYS 676           2HD      LYS 676 -12.480   3.258 -11.597
  265    HD3  LYS 676           1HD      LYS 676 -12.118   1.656 -10.950
  266    HE2  LYS 676           2HE      LYS 676 -14.857   2.124 -11.990
  267    HE3  LYS 676           1HE      LYS 676 -13.551   2.029 -13.171
  268    HZ1  LYS 676           3HZ      LYS 676 -13.264  -0.076 -11.323
  269    HZ2  LYS 676           1HZ      LYS 676 -13.582  -0.162 -12.990
  270    HZ3  LYS 676           2HZ      LYS 676 -14.864  -0.071 -11.887
  271    H    ASP 677           H        ASP 677 -16.159   1.332  -7.963
  272    HA   ASP 677           HA       ASP 677 -16.284  -0.518 -10.155
  273    HB2  ASP 677           2HB      ASP 677 -15.395  -0.695  -7.550
  274    HB3  ASP 677           1HB      ASP 677 -16.873  -1.657  -7.538
  275    H    GLY 678           H        GLY 678 -18.178   0.151 -11.141
  276    HA2  GLY 678           1HA      GLY 678 -20.436  -1.332 -10.822
  277    HA3  GLY 678           2HA      GLY 678 -20.711   0.068  -9.790
  278    H    SER 679           H        SER 679 -19.087   1.791 -11.553
  279    HA   SER 679           HA       SER 679 -21.166   2.397 -13.489
  280    HB2  SER 679           2HB      SER 679 -19.128   4.282 -13.759
  281    HB3  SER 679           1HB      SER 679 -20.601   4.464 -12.805
  282    HG   SER 679           HG       SER 679 -18.129   4.436 -11.920
  283    H    GLN 680           H        GLN 680 -18.591   0.423 -13.497
  284    HA   GLN 680           HA       GLN 680 -17.115   1.205 -15.769
  285    HB2  GLN 680           2HB      GLN 680 -16.348  -1.228 -15.746
  286    HB3  GLN 680           1HB      GLN 680 -15.999  -0.262 -14.321
  287    HG2  GLN 680           2HG      GLN 680 -18.515  -1.501 -13.919
  288    HG3  GLN 680           1HG      GLN 680 -17.394  -2.729 -14.511
  289   HE21  GLN 680          1HE2      GLN 680 -17.265  -3.789 -12.559
  290   HE22  GLN 680          2HE2      GLN 680 -16.460  -3.122 -11.172
  291    H    SER 681           H        SER 681 -17.941   1.411 -17.696
  292    HA   SER 681           HA       SER 681 -19.924  -0.489 -18.688
  293    HB2  SER 681           2HB      SER 681 -18.932   1.582 -20.526
  294    HB3  SER 681           1HB      SER 681 -20.588   1.169 -20.073
  295    HG   SER 681           HG       SER 681 -19.836   2.208 -17.938
  296    H    LYS 682           H        LYS 682 -16.655  -0.209 -18.463
  297    HA   LYS 682           HA       LYS 682 -15.948  -1.467 -20.970
  298    HB2  LYS 682           2HB      LYS 682 -14.425  -0.728 -18.481
  299    HB3  LYS 682           1HB      LYS 682 -13.694  -1.701 -19.749
  300    HG2  LYS 682           2HG      LYS 682 -14.735   0.414 -21.143
  301    HG3  LYS 682           1HG      LYS 682 -14.186   1.163 -19.640
  302    HD2  LYS 682           2HD      LYS 682 -11.972   0.352 -19.955
  303    HD3  LYS 682           1HD      LYS 682 -12.476  -0.687 -21.291
  304    HE2  LYS 682           2HE      LYS 682 -12.747   2.304 -21.369
  305    HE3  LYS 682           1HE      LYS 682 -11.290   1.471 -21.906
  306    HZ1  LYS 682           3HZ      LYS 682 -13.833   1.742 -23.212
  307    HZ2  LYS 682           1HZ      LYS 682 -13.272   0.138 -23.187
  308    HZ3  LYS 682           2HZ      LYS 682 -12.315   1.364 -23.865
  309    H    LEU 683           H        LEU 683 -17.604  -2.562 -18.477
  310    HA   LEU 683           HA       LEU 683 -16.383  -5.238 -18.540
  311    HB2  LEU 683           2HB      LEU 683 -16.991  -3.564 -16.303
  312    HB3  LEU 683           1HB      LEU 683 -18.050  -4.961 -16.255
  313    HG   LEU 683           HG       LEU 683 -15.435  -5.915 -16.803
  314   HD11  LEU 683          1HD1      LEU 683 -15.319  -3.490 -15.373
  315   HD12  LEU 683          2HD1      LEU 683 -15.022  -4.785 -14.212
  316   HD13  LEU 683          3HD1      LEU 683 -14.022  -4.652 -15.658
  317   HD21  LEU 683          3HD2      LEU 683 -16.143  -7.447 -15.357
  318   HD22  LEU 683          1HD2      LEU 683 -16.301  -6.251 -14.070
  319   HD23  LEU 683          2HD2      LEU 683 -17.630  -6.513 -15.199
  320    H    GLY 684           H        GLY 684 -17.892  -7.013 -18.391
  321    HA2  GLY 684           1HA      GLY 684 -20.314  -6.475 -19.875
  322    HA3  GLY 684           2HA      GLY 684 -19.700  -8.052 -19.396
  323    H    GLY 685           H        GLY 685 -21.345  -5.169 -18.201
  324    HA2  GLY 685           1HA      GLY 685 -23.286  -6.671 -16.792
  325    HA3  GLY 685           2HA      GLY 685 -22.071  -6.070 -15.669
  326    H    GLY 901           H        GLY 901 -24.513  -5.178 -15.204
  327    HA2  GLY 901           1HA      GLY 901 -24.414  -2.515 -14.972
  328    HA3  GLY 901           2HA      GLY 901 -24.960  -2.689 -16.634
  329    H    GLY 902           H        GLY 902 -27.049  -2.173 -16.651
  330    HA2  GLY 902           1HA      GLY 902 -28.879  -3.736 -15.018
  331    HA3  GLY 902           2HA      GLY 902 -28.868  -2.009 -14.692
  332    H    SER 903           H        SER 903 -28.736  -3.966 -17.665
  333    HA   SER 903           HA       SER 903 -30.410  -2.230 -19.133
  334    HB2  SER 903           2HB      SER 903 -30.429  -4.972 -20.095
  335    HB3  SER 903           1HB      SER 903 -29.722  -3.534 -20.835
  336    HG   SER 903           HG       SER 903 -27.921  -4.558 -20.378
  337    H    GLY 904           H        GLY 904 -32.521  -1.931 -18.905
  338    HA2  GLY 904           1HA      GLY 904 -34.719  -3.058 -19.117
  339    HA3  GLY 904           2HA      GLY 904 -34.144  -4.186 -17.899
  340    H    GLY 905           H        GLY 905 -34.779  -3.813 -15.887
  341    HA2  GLY 905           1HA      GLY 905 -35.575  -1.052 -15.194
  342    HA3  GLY 905           2HA      GLY 905 -36.351  -2.489 -14.537
  343    H    HIS 906           H        HIS 906 -33.505  -0.462 -14.471
  344    HA   HIS 906           HA       HIS 906 -32.266  -2.064 -12.383
  345    HB2  HIS 906           2HB      HIS 906 -31.021  -0.909 -14.307
  346    HB3  HIS 906           1HB      HIS 906 -31.276   0.585 -13.413
  347    HD1  HIS 906           1HD      HIS 906 -29.966  -2.883 -12.419
  348    HD2  HIS 906           2HD      HIS 906 -29.081   1.165 -12.026
  349    HE1  HIS 906           1HE      HIS 906 -27.848  -2.742 -11.036
  350    H    MET 907           H        MET 907 -32.285  -1.603 -10.272
  351    HA   MET 907           HA       MET 907 -33.847   0.721  -9.405
  352    HB2  MET 907           2HB      MET 907 -34.206  -1.803  -8.695
  353    HB3  MET 907           1HB      MET 907 -32.944  -1.419  -7.533
  354    HG2  MET 907           2HG      MET 907 -34.271   0.358  -6.604
  355    HG3  MET 907           1HG      MET 907 -35.507   0.120  -7.837
  356    HE1  MET 907           3HE      MET 907 -37.229  -1.477  -7.890
  357    HE2  MET 907           1HE      MET 907 -37.815  -2.351  -6.475
  358    HE3  MET 907           2HE      MET 907 -37.729  -0.591  -6.450
  359    H    GLY 908           H        GLY 908 -30.668  -0.548  -9.493
  360    HA2  GLY 908           1HA      GLY 908 -28.745   0.780  -9.048
  361    HA3  GLY 908           2HA      GLY 908 -29.704   1.735  -7.921
  362    H    SER 909           H        SER 909 -30.605   0.399  -6.047
  363    HA   SER 909           HA       SER 909 -28.423  -0.943  -4.745
  364    HB2  SER 909           2HB      SER 909 -30.892  -1.218  -3.315
  365    HB3  SER 909           1HB      SER 909 -29.508  -0.194  -2.928
  366    HG   SER 909           HG       SER 909 -31.704   0.805  -3.374
  367    H    GLY 910           H        GLY 910 -28.462  -2.568  -6.598
  368    HA2  GLY 910           1HA      GLY 910 -30.450  -4.696  -6.096
  369    HA3  GLY 910           2HA      GLY 910 -29.628  -4.437  -7.627
  370    H    GLY 911           H        GLY 911 -29.595  -6.064  -4.660
  371    HA2  GLY 911           1HA      GLY 911 -28.206  -8.112  -4.670
  372    HA3  GLY 911           2HA      GLY 911 -26.889  -7.099  -5.250
  373    H    LEU  18           H        LEU  18 -27.087  -8.783  -2.834
  374    HA   LEU  18           HA       LEU  18 -26.649  -6.668  -0.823
  375    HB2  LEU  18           2HB      LEU  18 -28.172  -9.192  -0.697
  376    HB3  LEU  18           1HB      LEU  18 -27.162  -8.854   0.694
  377    HG   LEU  18           HG       LEU  18 -29.194  -7.950   1.333
  378   HD11  LEU  18          1HD1      LEU  18 -27.373  -5.899   0.221
  379   HD12  LEU  18          2HD1      LEU  18 -28.986  -5.373   0.705
  380   HD13  LEU  18          3HD1      LEU  18 -27.924  -6.156   1.875
  381   HD21  LEU  18          3HD2      LEU  18 -29.520  -7.129  -1.535
  382   HD22  LEU  18          1HD2      LEU  18 -30.512  -8.234  -0.585
  383   HD23  LEU  18          2HD2      LEU  18 -30.556  -6.503  -0.252
  384    H    SER  19           H        SER  19 -25.090  -8.793  -2.713
  385    HA   SER  19           HA       SER  19 -23.199  -9.714  -0.703
  386    HB2  SER  19           2HB      SER  19 -22.401 -10.409  -3.365
  387    HB3  SER  19           1HB      SER  19 -22.964 -11.472  -2.075
  388    HG   SER  19           HG       SER  19 -24.541 -11.771  -3.461
  389    H    TRP  20           H        TRP  20 -23.432  -7.508  -3.397
  390    HA   TRP  20           HA       TRP  20 -22.069  -5.914  -4.248
  391    HB2  TRP  20           2HB      TRP  20 -20.587  -5.849  -1.635
  392    HB3  TRP  20           1HB      TRP  20 -20.927  -4.521  -2.737
  393    HD1  TRP  20           HD       TRP  20 -23.979  -4.527  -3.007
  394    HE1  TRP  20           1HE      TRP  20 -25.529  -4.119  -0.991
  395    HE3  TRP  20           3HE      TRP  20 -20.743  -5.758   0.750
  396    HZ2  TRP  20           2HZ      TRP  20 -25.383  -4.283   1.825
  397    HZ3  TRP  20           3HZ      TRP  20 -21.527  -5.601   3.077
  398    HH2  TRP  20           HH       TRP  20 -23.797  -4.882   3.602
  399    H    LYS  21           H        LYS  21 -19.381  -6.519  -2.266
  400    HA   LYS  21           HA       LYS  21 -18.112  -8.192  -4.314
  401    HB2  LYS  21           2HB      LYS  21 -17.568  -5.533  -4.147
  402    HB3  LYS  21           1HB      LYS  21 -16.366  -6.179  -3.041
  403    HG2  LYS  21           2HG      LYS  21 -15.270  -6.105  -5.087
  404    HG3  LYS  21           1HG      LYS  21 -15.767  -7.792  -4.934
  405    HD2  LYS  21           2HD      LYS  21 -16.986  -7.664  -6.790
  406    HD3  LYS  21           1HD      LYS  21 -17.834  -6.235  -6.197
  407    HE2  LYS  21           2HE      LYS  21 -15.692  -4.966  -6.865
  408    HE3  LYS  21           1HE      LYS  21 -15.316  -6.406  -7.811
  409    HZ1  LYS  21           3HZ      LYS  21 -17.873  -4.923  -8.072
  410    HZ2  LYS  21           1HZ      LYS  21 -17.258  -6.122  -9.103
  411    HZ3  LYS  21           2HZ      LYS  21 -16.513  -4.595  -9.030
  412    H    ARG  22           H        ARG  22 -16.629  -9.657  -3.537
  413    HA   ARG  22           HA       ARG  22 -16.744 -10.082  -0.652
  414    HB2  ARG  22           2HB      ARG  22 -17.225 -11.867  -2.519
  415    HB3  ARG  22           1HB      ARG  22 -15.474 -12.013  -2.562
  416    HG2  ARG  22           2HG      ARG  22 -15.836 -13.585  -1.002
  417    HG3  ARG  22           1HG      ARG  22 -15.896 -12.196   0.085
  418    HD2  ARG  22           2HD      ARG  22 -18.454 -12.271  -0.795
  419    HD3  ARG  22           1HD      ARG  22 -18.042 -13.985  -0.826
  420    HE   ARG  22           HE       ARG  22 -17.175 -13.092   1.622
  421   HH11  ARG  22          2HH1      ARG  22 -20.236 -13.146  -0.074
  422   HH12  ARG  22          1HH1      ARG  22 -21.192 -13.289   1.369
  423   HH21  ARG  22          2HH2      ARG  22 -18.425 -13.258   3.536
  424   HH22  ARG  22          1HH2      ARG  22 -20.164 -13.322   3.424
  425    H    CYS  23           H        CYS  23 -15.005  -9.980   0.655
  426    HA   CYS  23           HA       CYS  23 -12.664  -8.672  -0.398
  427    HB2  CYS  23           2HB      CYS  23 -13.690  -7.957   1.726
  428    HB3  CYS  23           1HB      CYS  23 -13.328  -9.530   2.426
  429    H    ALA  24           H        ALA  24 -10.543  -9.353  -0.122
  430    HA   ALA  24           HA       ALA  24 -10.191 -12.264   0.033
  431    HB1  ALA  24           1HB      ALA  24  -7.859 -10.688  -0.732
  432    HB2  ALA  24           2HB      ALA  24  -8.603 -12.075  -1.529
  433    HB3  ALA  24           3HB      ALA  24  -9.243 -10.455  -1.803
  434    H    GLY  25           H        GLY  25 -10.062  -9.597   1.946
  435    HA2  GLY  25           1HA      GLY  25  -7.680 -10.422   3.449
  436    HA3  GLY  25           2HA      GLY  25  -8.578  -8.928   3.662
  437    H    CYS  26           H        CYS  26 -11.105  -9.653   4.138
  438    HA   CYS  26           HA       CYS  26 -10.796 -11.160   6.631
  439    HB2  CYS  26           2HB      CYS  26 -13.021 -10.076   7.253
  440    HB3  CYS  26           1HB      CYS  26 -11.621  -9.018   7.173
  441    H    GLY  27           H        GLY  27 -12.490 -11.053   3.619
  442    HA2  GLY  27           1HA      GLY  27 -13.207 -13.084   2.593
  443    HA3  GLY  27           2HA      GLY  27 -13.494 -13.750   4.193
  444    H    GLY  28           H        GLY  28 -14.719 -10.888   4.656
  445    HA2  GLY  28           1HA      GLY  28 -17.424 -11.801   4.166
  446    HA3  GLY  28           2HA      GLY  28 -16.947 -10.336   5.017
  447    H    LYS  29           H        LYS  29 -18.619  -9.262   3.824
  448    HA   LYS  29           HA       LYS  29 -17.980  -8.792   1.003
  449    HB2  LYS  29           2HB      LYS  29 -20.259  -7.311   1.632
  450    HB3  LYS  29           1HB      LYS  29 -20.206  -8.845   0.776
  451    HG2  LYS  29           2HG      LYS  29 -20.289  -9.935   3.085
  452    HG3  LYS  29           1HG      LYS  29 -20.760  -8.341   3.677
  453    HD2  LYS  29           2HD      LYS  29 -22.354  -8.820   1.425
  454    HD3  LYS  29           1HD      LYS  29 -22.343 -10.332   2.332
  455    HE2  LYS  29           2HE      LYS  29 -22.892  -8.969   4.382
  456    HE3  LYS  29           1HE      LYS  29 -23.163  -7.602   3.301
  457    HZ1  LYS  29           3HZ      LYS  29 -25.157  -8.371   2.771
  458    HZ2  LYS  29           1HZ      LYS  29 -24.994  -9.514   4.013
  459    HZ3  LYS  29           2HZ      LYS  29 -24.564  -9.923   2.424
  460    H    ILE  30           H        ILE  30 -17.260  -6.841   0.296
  461    HA   ILE  30           HA       ILE  30 -16.167  -5.051   2.236
  462    HB   ILE  30           HB       ILE  30 -16.384  -4.802  -0.770
  463   HG12  ILE  30          2HG1      ILE  30 -13.752  -5.077   0.503
  464   HG13  ILE  30          1HG1      ILE  30 -14.804  -6.469   0.747
  465   HG21  ILE  30          1HG2      ILE  30 -14.351  -3.147  -0.067
  466   HG22  ILE  30          2HG2      ILE  30 -16.002  -2.616  -0.380
  467   HG23  ILE  30          3HG2      ILE  30 -15.468  -2.899   1.275
  468   HD11  ILE  30          3HD1      ILE  30 -13.251  -6.495  -1.261
  469   HD12  ILE  30          1HD1      ILE  30 -14.943  -6.897  -1.544
  470   HD13  ILE  30          2HD1      ILE  30 -14.333  -5.297  -1.968
  471    H    ALA  31           H        ALA  31 -17.422  -3.786   3.385
  472    HA   ALA  31           HA       ALA  31 -19.585  -2.326   2.019
  473    HB1  ALA  31           1HB      ALA  31 -19.923  -4.161   4.027
  474    HB2  ALA  31           2HB      ALA  31 -19.901  -2.632   4.903
  475    HB3  ALA  31           3HB      ALA  31 -21.066  -2.887   3.605
  476    H    ASP  32           H        ASP  32 -16.649  -1.850   2.849
  477    HA   ASP  32           HA       ASP  32 -16.677   0.281   4.725
  478    HB2  ASP  32           2HB      ASP  32 -14.731  -0.851   2.793
  479    HB3  ASP  32           1HB      ASP  32 -14.480   0.832   3.239
  480    H    ARG  33           H        ARG  33 -15.391   0.981   1.575
  481    HA   ARG  33           HA       ARG  33 -17.543   2.381   0.457
  482    HB2  ARG  33           2HB      ARG  33 -16.767   3.853   2.519
  483    HB3  ARG  33           1HB      ARG  33 -15.516   4.368   1.397
  484    HG2  ARG  33           2HG      ARG  33 -17.028   5.385  -0.025
  485    HG3  ARG  33           1HG      ARG  33 -18.388   4.434   0.577
  486    HD2  ARG  33           2HD      ARG  33 -18.452   5.660   2.612
  487    HD3  ARG  33           1HD      ARG  33 -16.913   6.444   2.256
  488    HE   ARG  33           HE       ARG  33 -19.083   6.948   0.380
  489   HH11  ARG  33          2HH1      ARG  33 -17.294   8.035   3.199
  490   HH12  ARG  33          1HH1      ARG  33 -17.753   9.701   3.004
  491   HH21  ARG  33          2HH2      ARG  33 -19.675   9.148   0.112
  492   HH22  ARG  33          1HH2      ARG  33 -19.097  10.333   1.246
  493    H    PHE  34           H        PHE  34 -14.036   2.690   0.883
  494    HA   PHE  34           HA       PHE  34 -13.768   2.888  -2.023
  495    HB2  PHE  34           2HB      PHE  34 -12.196   3.841   0.291
  496    HB3  PHE  34           1HB      PHE  34 -11.251   3.277  -1.084
  497    HD1  PHE  34           2HD      PHE  34 -14.471   5.147  -0.826
  498    HD2  PHE  34           1HD      PHE  34 -10.462   5.077  -2.257
  499    HE1  PHE  34           2HE      PHE  34 -14.852   7.281  -1.979
  500    HE2  PHE  34           1HE      PHE  34 -10.840   7.215  -3.418
  501    HZ   PHE  34           HZ       PHE  34 -13.040   8.311  -3.285
  502    H    LEU  35           H        LEU  35 -12.920   1.325  -3.210
  503    HA   LEU  35           HA       LEU  35 -12.073  -1.128  -1.877
  504    HB2  LEU  35           2HB      LEU  35 -13.222  -0.431  -4.507
  505    HB3  LEU  35           1HB      LEU  35 -12.028  -1.714  -4.526
  506    HG   LEU  35           HG       LEU  35 -13.959  -2.141  -2.414
  507   HD11  LEU  35          1HD1      LEU  35 -15.660  -2.808  -4.390
  508   HD12  LEU  35          2HD1      LEU  35 -15.758  -1.301  -3.479
  509   HD13  LEU  35          3HD1      LEU  35 -14.974  -1.327  -5.057
  510   HD21  LEU  35          3HD2      LEU  35 -14.239  -4.271  -3.835
  511   HD22  LEU  35          1HD2      LEU  35 -12.900  -3.629  -4.787
  512   HD23  LEU  35          2HD2      LEU  35 -12.681  -3.966  -3.069
  513    H    LEU  36           H        LEU  36 -10.067  -2.041  -2.195
  514    HA   LEU  36           HA       LEU  36  -8.106  -0.298  -3.524
  515    HB2  LEU  36           2HB      LEU  36  -7.636  -1.881  -1.000
  516    HB3  LEU  36           1HB      LEU  36  -6.513  -0.781  -1.778
  517    HG   LEU  36           HG       LEU  36  -9.164   0.099  -0.637
  518   HD11  LEU  36          1HD1      LEU  36  -7.067  -0.837   0.853
  519   HD12  LEU  36          2HD1      LEU  36  -6.753   0.896   0.792
  520   HD13  LEU  36          3HD1      LEU  36  -8.294   0.301   1.409
  521   HD21  LEU  36          3HD2      LEU  36  -6.996   2.026  -0.815
  522   HD22  LEU  36          1HD2      LEU  36  -7.451   1.369  -2.387
  523   HD23  LEU  36          2HD2      LEU  36  -8.665   2.144  -1.371
  524    H    TYR  37           H        TYR  37  -6.307  -1.294  -4.456
  525    HA   TYR  37           HA       TYR  37  -6.631  -4.177  -4.982
  526    HB2  TYR  37           2HB      TYR  37  -6.386  -1.908  -6.767
  527    HB3  TYR  37           1HB      TYR  37  -5.089  -3.062  -7.042
  528    HD1  TYR  37           1HD      TYR  37  -5.855  -5.564  -7.305
  529    HD2  TYR  37           2HD      TYR  37  -8.402  -2.198  -7.825
  530    HE1  TYR  37           1HE      TYR  37  -7.375  -6.931  -8.670
  531    HE2  TYR  37           2HE      TYR  37  -9.929  -3.553  -9.187
  532    HH   TYR  37           HH       TYR  37  -9.096  -6.807 -10.198
  533    H    ALA  38           H        ALA  38  -5.122  -5.123  -3.687
  534    HA   ALA  38           HA       ALA  38  -2.543  -3.933  -3.224
  535    HB1  ALA  38           1HB      ALA  38  -2.976  -6.805  -2.649
  536    HB2  ALA  38           2HB      ALA  38  -2.223  -5.550  -1.663
  537    HB3  ALA  38           3HB      ALA  38  -3.981  -5.644  -1.781
  538    H    MET  39           H        MET  39  -3.788  -6.633  -5.133
  539    HA   MET  39           HA       MET  39  -1.433  -6.521  -6.825
  540    HB2  MET  39           2HB      MET  39  -1.819  -8.571  -4.816
  541    HB3  MET  39           1HB      MET  39  -1.788  -9.274  -6.424
  542    HG2  MET  39           2HG      MET  39   0.377  -8.470  -6.856
  543    HG3  MET  39           1HG      MET  39   0.323  -7.364  -5.485
  544    HE1  MET  39           3HE      MET  39   0.750  -8.599  -2.643
  545    HE2  MET  39           1HE      MET  39   2.398  -8.967  -3.151
  546    HE3  MET  39           2HE      MET  39   1.562  -7.565  -3.819
  547    H    ASP  40           H        ASP  40  -4.128  -8.791  -6.232
  548    HA   ASP  40           HA       ASP  40  -5.314  -7.980  -8.772
  549    HB2  ASP  40           2HB      ASP  40  -3.754  -9.966  -9.133
  550    HB3  ASP  40           1HB      ASP  40  -4.889 -10.908  -8.175
  551    H    SER  41           H        SER  41  -5.640  -8.844  -5.547
  552    HA   SER  41           HA       SER  41  -8.362  -9.831  -5.817
  553    HB2  SER  41           2HB      SER  41  -7.601  -9.446  -3.101
  554    HB3  SER  41           1HB      SER  41  -7.789 -10.967  -3.979
  555    HG   SER  41           HG       SER  41  -5.689 -10.924  -3.311
  556    H    TYR  42           H        TYR  42  -9.970  -8.903  -4.199
  557    HA   TYR  42           HA       TYR  42  -9.923  -5.978  -4.423
  558    HB2  TYR  42           2HB      TYR  42 -12.177  -7.908  -3.838
  559    HB3  TYR  42           1HB      TYR  42 -12.357  -6.157  -3.873
  560    HD1  TYR  42           1HD      TYR  42 -11.876  -4.949  -6.057
  561    HD2  TYR  42           2HD      TYR  42 -12.316  -9.172  -5.807
  562    HE1  TYR  42           1HE      TYR  42 -12.292  -5.043  -8.478
  563    HE2  TYR  42           2HE      TYR  42 -12.730  -9.280  -8.227
  564    HH   TYR  42           HH       TYR  42 -12.102  -6.681 -10.312
  565    H    TRP  43           H        TRP  43  -9.810  -4.683  -2.675
  566    HA   TRP  43           HA       TRP  43 -10.137  -5.876  -0.014
  567    HB2  TRP  43           2HB      TRP  43  -7.888  -3.943  -0.531
  568    HB3  TRP  43           1HB      TRP  43  -8.100  -5.053   0.817
  569    HD1  TRP  43           HD       TRP  43  -7.233  -5.148  -2.950
  570    HE1  TRP  43           1HE      TRP  43  -5.752  -7.203  -3.376
  571    HE3  TRP  43           3HE      TRP  43  -7.272  -7.179   1.746
  572    HZ2  TRP  43           2HZ      TRP  43  -4.714  -9.373  -1.932
  573    HZ3  TRP  43           3HZ      TRP  43  -5.994  -9.252   2.132
  574    HH2  TRP  43           HH       TRP  43  -4.745 -10.321   0.319
  575    H    HIS  44           H        HIS  44  -9.944  -4.030   1.666
  576    HA   HIS  44           HA       HIS  44 -10.992  -1.481   0.702
  577    HB2  HIS  44           2HB      HIS  44 -12.607  -1.456   2.696
  578    HB3  HIS  44           1HB      HIS  44 -13.058  -2.487   1.345
  579    HD1  HIS  44           1HD      HIS  44 -13.548  -2.707   4.732
  580    HD2  HIS  44           2HD      HIS  44 -11.471  -5.142   2.089
  581    HE1  HIS  44           1HE      HIS  44 -13.280  -4.975   5.875
  582    H    SER  45           H        SER  45 -11.203  -0.084   2.948
  583    HA   SER  45           HA       SER  45  -8.587   0.669   3.366
  584    HB2  SER  45           2HB      SER  45 -10.184   1.490   5.597
  585    HB3  SER  45           1HB      SER  45  -9.668   2.435   4.199
  586    HG   SER  45           HG       SER  45 -12.033   0.896   4.528
  587    H    ARG  46           H        ARG  46 -10.537  -1.507   5.382
  588    HA   ARG  46           HA       ARG  46  -8.568  -1.354   7.513
  589    HB2  ARG  46           2HB      ARG  46 -10.140  -2.251   8.920
  590    HB3  ARG  46           1HB      ARG  46 -11.159  -1.431   7.748
  591    HG2  ARG  46           2HG      ARG  46 -12.126  -3.333   7.108
  592    HG3  ARG  46           1HG      ARG  46 -10.582  -4.185   7.011
  593    HD2  ARG  46           2HD      ARG  46 -11.033  -5.237   8.910
  594    HD3  ARG  46           1HD      ARG  46 -11.153  -3.690   9.747
  595    HE   ARG  46           HE       ARG  46 -13.563  -4.063   8.420
  596   HH11  ARG  46          2HH1      ARG  46 -11.709  -5.649  10.940
  597   HH12  ARG  46          1HH1      ARG  46 -13.110  -6.282  11.753
  598   HH21  ARG  46          2HH2      ARG  46 -15.414  -4.907   9.486
  599   HH22  ARG  46          1HH2      ARG  46 -15.214  -5.857  10.933
  600    H    CYS  47           H        CYS  47  -9.015  -3.399   4.814
  601    HA   CYS  47           HA       CYS  47  -7.577  -5.557   6.190
  602    HB2  CYS  47           2HB      CYS  47  -9.317  -5.474   3.788
  603    HB3  CYS  47           1HB      CYS  47  -8.008  -6.651   3.801
  604    H    LEU  48           H        LEU  48  -7.291  -3.288   3.523
  605    HA   LEU  48           HA       LEU  48  -4.813  -4.386   2.602
  606    HB2  LEU  48           2HB      LEU  48  -6.736  -2.652   1.591
  607    HB3  LEU  48           1HB      LEU  48  -5.319  -1.647   1.811
  608    HG   LEU  48           HG       LEU  48  -5.898  -3.331  -0.353
  609   HD11  LEU  48          1HD1      LEU  48  -3.149  -2.535  -0.265
  610   HD12  LEU  48          2HD1      LEU  48  -4.471  -1.911  -1.253
  611   HD13  LEU  48          3HD1      LEU  48  -4.186  -1.248   0.356
  612   HD21  LEU  48          3HD2      LEU  48  -3.795  -4.477   1.447
  613   HD22  LEU  48          1HD2      LEU  48  -5.085  -5.301   0.571
  614   HD23  LEU  48          2HD2      LEU  48  -3.697  -4.663  -0.304
  615    H    LYS  49           H        LYS  49  -3.823  -4.370   4.722
  616    HA   LYS  49           HA       LYS  49  -2.486  -1.815   5.289
  617    HB2  LYS  49           2HB      LYS  49  -3.189  -3.711   7.510
  618    HB3  LYS  49           1HB      LYS  49  -2.831  -1.994   7.598
  619    HG2  LYS  49           2HG      LYS  49  -5.105  -2.047   6.070
  620    HG3  LYS  49           1HG      LYS  49  -5.370  -3.361   7.217
  621    HD2  LYS  49           2HD      LYS  49  -4.273  -1.043   8.539
  622    HD3  LYS  49           1HD      LYS  49  -5.747  -0.629   7.659
  623    HE2  LYS  49           2HE      LYS  49  -7.009  -2.259   8.828
  624    HE3  LYS  49           1HE      LYS  49  -5.557  -2.993   9.504
  625    HZ1  LYS  49           3HZ      LYS  49  -5.489  -0.370  10.329
  626    HZ2  LYS  49           1HZ      LYS  49  -5.887  -1.726  11.268
  627    HZ3  LYS  49           2HZ      LYS  49  -7.111  -0.831  10.504
  628    H    CYS  50           H        CYS  50  -0.413  -2.140   6.515
  629    HA   CYS  50           HA       CYS  50   1.217  -4.167   5.471
  630    HB2  CYS  50           2HB      CYS  50   2.131  -2.090   6.486
  631    HB3  CYS  50           1HB      CYS  50   1.598  -2.640   8.069
  632    H    SER  51           H        SER  51   1.686  -6.225   6.144
  633    HA   SER  51           HA       SER  51  -0.124  -7.416   8.040
  634    HB2  SER  51           2HB      SER  51   2.281  -8.705   6.728
  635    HB3  SER  51           1HB      SER  51   0.867  -9.513   7.409
  636    HG   SER  51           HG       SER  51   0.246  -7.648   5.495
  637    H    SER  52           H        SER  52   2.540  -5.600   8.445
  638    HA   SER  52           HA       SER  52   3.320  -7.000  10.911
  639    HB2  SER  52           2HB      SER  52   5.194  -4.979   9.983
  640    HB3  SER  52           1HB      SER  52   5.480  -6.674  10.384
  641    HG   SER  52           HG       SER  52   4.518  -5.618   7.921
  642    H    CYS  53           H        CYS  53   2.550  -3.879   9.426
  643    HA   CYS  53           HA       CYS  53   2.667  -2.546  12.031
  644    HB2  CYS  53           2HB      CYS  53   2.218  -1.496   9.231
  645    HB3  CYS  53           1HB      CYS  53   2.215  -0.487  10.672
  646    H    GLN  54           H        GLN  54   0.399  -3.711   9.690
  647    HA   GLN  54           HA       GLN  54  -1.841  -3.667   9.464
  648    HB2  GLN  54           2HB      GLN  54  -1.529  -3.370  12.414
  649    HB3  GLN  54           1HB      GLN  54  -3.115  -3.055  11.719
  650    HG2  GLN  54           2HG      GLN  54  -1.812  -5.517  10.795
  651    HG3  GLN  54           1HG      GLN  54  -2.237  -5.482  12.507
  652   HE21  GLN  54          1HE2      GLN  54  -3.720  -4.519   9.396
  653   HE22  GLN  54          2HE2      GLN  54  -5.266  -5.202   9.747
  654    H    ALA  55           H        ALA  55  -0.119  -1.250   9.240
  655    HA   ALA  55           HA       ALA  55  -1.990   0.936   9.597
  656    HB1  ALA  55           1HB      ALA  55   0.719   0.859   9.544
  657    HB2  ALA  55           2HB      ALA  55   0.375   1.329   7.879
  658    HB3  ALA  55           3HB      ALA  55  -0.231   2.307   9.213
  659    H    GLN  56           H        GLN  56  -3.261   1.795   8.006
  660    HA   GLN  56           HA       GLN  56  -3.980   0.100   5.857
  661    HB2  GLN  56           2HB      GLN  56  -4.819   2.929   5.697
  662    HB3  GLN  56           1HB      GLN  56  -5.777   1.461   5.596
  663    HG2  GLN  56           2HG      GLN  56  -5.136   1.370   8.187
  664    HG3  GLN  56           1HG      GLN  56  -5.074   3.115   7.937
  665   HE21  GLN  56          1HE2      GLN  56  -7.059   3.515   6.135
  666   HE22  GLN  56          2HE2      GLN  56  -8.585   3.110   6.834
  667    H    LEU  57           H        LEU  57  -2.295  -0.238   4.469
  668    HA   LEU  57           HA       LEU  57  -0.661   1.821   3.396
  669    HB2  LEU  57           2HB      LEU  57  -1.160  -1.043   2.624
  670    HB3  LEU  57           1HB      LEU  57  -0.107  -0.008   1.679
  671    HG   LEU  57           HG       LEU  57   0.301  -0.610   4.608
  672   HD11  LEU  57          1HD1      LEU  57   1.521  -2.423   4.097
  673   HD12  LEU  57          2HD1      LEU  57   0.574  -2.420   2.607
  674   HD13  LEU  57          3HD1      LEU  57   2.179  -1.691   2.633
  675   HD21  LEU  57          3HD2      LEU  57   2.349   0.494   4.432
  676   HD22  LEU  57          1HD2      LEU  57   2.327   0.453   2.670
  677   HD23  LEU  57          2HD2      LEU  57   1.239   1.535   3.538
  678    H    GLY  58           H        GLY  58  -3.779   0.612   2.608
  679    HA2  GLY  58           1HA      GLY  58  -3.738   1.650  -0.102
  680    HA3  GLY  58           2HA      GLY  58  -5.093   0.871   0.702
  681    H    ASP  59           H        ASP  59  -4.097   3.029   2.897
  682    HA   ASP  59           HA       ASP  59  -5.965   5.070   1.931
  683    HB2  ASP  59           2HB      ASP  59  -5.891   3.849   4.349
  684    HB3  ASP  59           1HB      ASP  59  -4.892   5.258   4.682
  685    H    ILE  60           H        ILE  60  -2.914   4.431   1.722
  686    HA   ILE  60           HA       ILE  60  -2.103   7.245   1.664
  687    HB   ILE  60           HB       ILE  60  -0.155   5.068   2.393
  688   HG12  ILE  60          2HG1      ILE  60  -1.428   6.805   4.493
  689   HG13  ILE  60          1HG1      ILE  60  -2.162   5.269   4.038
  690   HG21  ILE  60          1HG2      ILE  60   0.713   7.218   1.614
  691   HG22  ILE  60          2HG2      ILE  60  -0.153   8.035   2.912
  692   HG23  ILE  60          3HG2      ILE  60   1.149   6.907   3.293
  693   HD11  ILE  60          3HD1      ILE  60   0.360   4.463   4.466
  694   HD12  ILE  60          1HD1      ILE  60   0.279   5.824   5.583
  695   HD13  ILE  60          2HD1      ILE  60  -0.880   4.503   5.719
  696    H    GLY  61           H        GLY  61  -0.840   7.761  -0.113
  697    HA2  GLY  61           1HA      GLY  61  -0.781   5.949  -2.327
  698    HA3  GLY  61           2HA      GLY  61  -0.018   7.534  -2.256
  699    H    THR  62           H        THR  62   0.345   4.394  -0.648
  700    HA   THR  62           HA       THR  62   3.238   4.798  -0.562
  701    HB   THR  62           HB       THR  62   2.523   2.407   0.771
  702    HG1  THR  62           1HG      THR  62   0.384   3.070   0.919
  703   HG21  THR  62          3HG2      THR  62   4.076   3.347   2.062
  704   HG22  THR  62          1HG2      THR  62   2.841   4.454   2.666
  705   HG23  THR  62          2HG2      THR  62   3.835   4.913   1.284
  706    H    SER  63           H        SER  63   4.340   3.979  -2.199
  707    HA   SER  63           HA       SER  63   3.500   1.691  -3.698
  708    HB2  SER  63           2HB      SER  63   6.277   2.888  -3.611
  709    HB3  SER  63           1HB      SER  63   5.540   1.966  -4.921
  710    HG   SER  63           HG       SER  63   4.898   4.590  -4.044
  711    H    SER  64           H        SER  64   3.166   0.187  -1.981
  712    HA   SER  64           HA       SER  64   5.252  -0.584  -0.218
  713    HB2  SER  64           2HB      SER  64   3.273  -1.202   0.736
  714    HB3  SER  64           1HB      SER  64   2.485  -1.451  -0.820
  715    HG   SER  64           HG       SER  64   3.971  -3.227   0.745
  716    H    TYR  65           H        TYR  65   6.564  -2.411  -0.280
  717    HA   TYR  65           HA       TYR  65   6.891  -3.567  -2.963
  718    HB2  TYR  65           2HB      TYR  65   9.066  -3.369  -0.883
  719    HB3  TYR  65           1HB      TYR  65   9.233  -3.688  -2.606
  720    HD1  TYR  65           2HD      TYR  65   8.833  -1.841  -4.242
  721    HD2  TYR  65           1HD      TYR  65   9.000  -1.146  -0.050
  722    HE1  TYR  65           2HE      TYR  65   9.182   0.553  -4.663
  723    HE2  TYR  65           1HE      TYR  65   9.346   1.250  -0.454
  724    HH   TYR  65           HH       TYR  65   9.042   2.646  -3.627
  725    H    THR  66           H        THR  66   7.309  -5.775  -3.152
  726    HA   THR  66           HA       THR  66   7.013  -7.344  -0.690
  727    HB   THR  66           HB       THR  66   4.808  -7.105  -1.910
  728    HG1  THR  66           1HG      THR  66   4.806  -8.795  -0.572
  729   HG21  THR  66          3HG2      THR  66   4.764  -8.978  -3.809
  730   HG22  THR  66          1HG2      THR  66   6.427  -8.432  -4.015
  731   HG23  THR  66          2HG2      THR  66   5.097  -7.284  -4.169
  732    H    LYS  67           H        LYS  67   7.488  -9.688  -1.114
  733    HA   LYS  67           HA       LYS  67   9.471 -10.091  -3.220
  734    HB2  LYS  67           2HB      LYS  67  10.192  -9.479  -0.595
  735    HB3  LYS  67           1HB      LYS  67  10.358 -11.226  -0.693
  736    HG2  LYS  67           2HG      LYS  67  11.671 -10.704  -2.880
  737    HG3  LYS  67           1HG      LYS  67  11.838  -9.098  -2.167
  738    HD2  LYS  67           2HD      LYS  67  12.665 -10.273  -0.075
  739    HD3  LYS  67           1HD      LYS  67  12.772 -11.734  -1.059
  740    HE2  LYS  67           2HE      LYS  67  14.038  -9.297  -2.153
  741    HE3  LYS  67           1HE      LYS  67  14.802 -10.015  -0.734
  742    HZ1  LYS  67           3HZ      LYS  67  15.736 -11.492  -2.071
  743    HZ2  LYS  67           1HZ      LYS  67  14.919 -10.864  -3.416
  744    HZ3  LYS  67           2HZ      LYS  67  14.208 -12.094  -2.487
  745    H    SER  68           H        SER  68   8.264 -11.723  -0.303
  746    HA   SER  68           HA       SER  68   7.903 -14.149  -1.899
  747    HB2  SER  68           2HB      SER  68   7.687 -14.245   1.057
  748    HB3  SER  68           1HB      SER  68   8.516 -15.341  -0.054
  749    HG   SER  68           HG       SER  68  10.268 -14.068  -0.044
  750    H    GLY  69           H        GLY  69   5.951 -12.174  -2.213
  751    HA2  GLY  69           1HA      GLY  69   3.661 -12.036  -2.344
  752    HA3  GLY  69           2HA      GLY  69   3.605 -13.685  -1.742
  753    H    MET  70           H        MET  70   5.120 -11.103   0.034
  754    HA   MET  70           HA       MET  70   2.996 -11.340   2.061
  755    HB2  MET  70           2HB      MET  70   5.886 -11.508   2.227
  756    HB3  MET  70           1HB      MET  70   5.267 -10.246   3.282
  757    HG2  MET  70           2HG      MET  70   3.552 -12.206   3.892
  758    HG3  MET  70           1HG      MET  70   4.953 -13.172   3.436
  759    HE1  MET  70           3HE      MET  70   7.639 -12.355   5.931
  760    HE2  MET  70           1HE      MET  70   6.774 -13.814   5.452
  761    HE3  MET  70           2HE      MET  70   7.292 -12.655   4.228
  762    H    ILE  71           H        ILE  71   1.966  -9.512   2.695
  763    HA   ILE  71           HA       ILE  71   2.617  -7.094   1.226
  764    HB   ILE  71           HB       ILE  71   0.381  -7.466   3.221
  765   HG12  ILE  71          2HG1      ILE  71  -0.254  -7.571   0.346
  766   HG13  ILE  71          1HG1      ILE  71   0.663  -8.951   0.942
  767   HG21  ILE  71          1HG2      ILE  71  -0.664  -5.636   1.897
  768   HG22  ILE  71          2HG2      ILE  71   0.819  -5.155   2.723
  769   HG23  ILE  71          3HG2      ILE  71   0.845  -5.487   0.991
  770   HD11  ILE  71          3HD1      ILE  71  -1.032  -9.640   2.340
  771   HD12  ILE  71          1HD1      ILE  71  -1.773  -8.040   2.405
  772   HD13  ILE  71          2HD1      ILE  71  -1.923  -9.023   0.948
  773    H    LEU  72           H        LEU  72   4.202  -5.898   2.024
  774    HA   LEU  72           HA       LEU  72   4.124  -5.200   4.877
  775    HB2  LEU  72           2HB      LEU  72   6.714  -5.399   3.375
  776    HB3  LEU  72           1HB      LEU  72   6.448  -5.384   5.109
  777    HG   LEU  72           HG       LEU  72   5.372  -7.684   3.553
  778   HD11  LEU  72          1HD1      LEU  72   7.338  -8.325   2.763
  779   HD12  LEU  72          2HD1      LEU  72   8.117  -6.907   3.467
  780   HD13  LEU  72          3HD1      LEU  72   7.957  -8.385   4.414
  781   HD21  LEU  72          3HD2      LEU  72   6.390  -7.150   6.314
  782   HD22  LEU  72          1HD2      LEU  72   4.850  -7.840   5.802
  783   HD23  LEU  72          2HD2      LEU  72   6.327  -8.797   5.689
  784    H    CYS  73           H        CYS  73   5.030  -3.108   5.354
  785    HA   CYS  73           HA       CYS  73   4.386  -1.168   3.370
  786    HB2  CYS  73           2HB      CYS  73   5.060   0.468   5.085
  787    HB3  CYS  73           1HB      CYS  73   3.956  -0.739   5.733
  788    H    ARG  74           H        ARG  74   6.075   0.754   3.221
  789    HA   ARG  74           HA       ARG  74   8.141  -0.139   1.550
  790    HB2  ARG  74           2HB      ARG  74   7.437   2.039   1.129
  791    HB3  ARG  74           1HB      ARG  74   7.454   2.486   2.826
  792    HG2  ARG  74           2HG      ARG  74   9.893   2.534   2.804
  793    HG3  ARG  74           1HG      ARG  74   9.894   2.040   1.111
  794    HD2  ARG  74           2HD      ARG  74  10.194   4.526   1.611
  795    HD3  ARG  74           1HD      ARG  74   8.992   4.082   0.400
  796    HE   ARG  74           HE       ARG  74   7.693   4.240   2.868
  797   HH11  ARG  74          2HH1      ARG  74   9.408   6.381   0.681
  798   HH12  ARG  74          1HH1      ARG  74   8.455   7.775   1.103
  799   HH21  ARG  74          2HH2      ARG  74   6.434   6.061   3.408
  800   HH22  ARG  74          1HH2      ARG  74   6.757   7.595   2.650
  801    H    ASN  75           H        ASN  75   8.138   0.873   4.930
  802    HA   ASN  75           HA       ASN  75  10.984   0.662   5.203
  803    HB2  ASN  75           2HB      ASN  75  10.423   2.066   6.857
  804    HB3  ASN  75           1HB      ASN  75   8.737   1.572   6.800
  805   HD21  ASN  75          1HD2      ASN  75   8.000  -0.004   8.211
  806   HD22  ASN  75          2HD2      ASN  75   8.929  -0.532   9.572
  807    H    ASP  76           H        ASP  76   8.227  -1.419   5.812
  808    HA   ASP  76           HA       ASP  76   9.624  -3.241   7.494
  809    HB2  ASP  76           2HB      ASP  76   6.952  -2.924   6.565
  810    HB3  ASP  76           1HB      ASP  76   7.457  -4.574   6.210
  811    H    TYR  77           H        TYR  77   9.003  -3.135   4.011
  812    HA   TYR  77           HA       TYR  77   9.821  -5.726   3.384
  813    HB2  TYR  77           2HB      TYR  77   8.846  -4.485   1.617
  814    HB3  TYR  77           1HB      TYR  77   9.995  -3.162   1.805
  815    HD1  TYR  77           2HD      TYR  77  10.103  -6.851   1.185
  816    HD2  TYR  77           1HD      TYR  77  11.620  -3.005   0.171
  817    HE1  TYR  77           2HE      TYR  77  11.570  -7.878  -0.499
  818    HE2  TYR  77           1HE      TYR  77  13.099  -4.025  -1.507
  819    HH   TYR  77           HH       TYR  77  14.181  -6.505  -1.725
  820    H    ILE  78           H        ILE  78  11.755  -2.774   3.727
  821    HA   ILE  78           HA       ILE  78  14.227  -3.972   3.009
  822    HB   ILE  78           HB       ILE  78  13.861  -1.547   4.774
  823   HG12  ILE  78          2HG1      ILE  78  14.246  -1.400   1.802
  824   HG13  ILE  78          1HG1      ILE  78  12.627  -1.614   2.463
  825   HG21  ILE  78          1HG2      ILE  78  16.067  -1.689   2.840
  826   HG22  ILE  78          2HG2      ILE  78  16.056  -1.135   4.513
  827   HG23  ILE  78          3HG2      ILE  78  16.149  -2.861   4.156
  828   HD11  ILE  78          3HD1      ILE  78  14.435   0.610   3.337
  829   HD12  ILE  78          1HD1      ILE  78  13.355   0.750   1.950
  830   HD13  ILE  78          2HD1      ILE  78  12.694   0.457   3.557
  831    H    ARG  79           H        ARG  79  12.592  -3.413   6.085
  832    HA   ARG  79           HA       ARG  79  14.730  -4.307   7.718
  833    HB2  ARG  79           2HB      ARG  79  13.428  -3.470   9.326
  834    HB3  ARG  79           1HB      ARG  79  12.229  -3.108   8.100
  835    HG2  ARG  79           2HG      ARG  79  10.983  -5.013   8.585
  836    HG3  ARG  79           1HG      ARG  79  12.323  -5.790   9.428
  837    HD2  ARG  79           2HD      ARG  79  11.503  -5.007  11.336
  838    HD3  ARG  79           1HD      ARG  79  11.860  -3.378  10.767
  839    HE   ARG  79           HE       ARG  79   9.358  -4.412   9.783
  840   HH11  ARG  79          2HH1      ARG  79  10.909  -2.793  12.484
  841   HH12  ARG  79          1HH1      ARG  79   9.456  -1.994  13.009
  842   HH21  ARG  79          2HH2      ARG  79   7.446  -3.384  10.478
  843   HH22  ARG  79          1HH2      ARG  79   7.476  -2.345  11.879
  844    H    LEU  80           H        LEU  80  12.063  -5.919   6.127
  845    HA   LEU  80           HA       LEU  80  12.485  -8.427   7.470
  846    HB2  LEU  80           2HB      LEU  80  10.726  -7.431   5.279
  847    HB3  LEU  80           1HB      LEU  80  11.005  -9.156   5.391
  848    HG   LEU  80           HG       LEU  80   9.179  -7.523   6.879
  849   HD11  LEU  80          1HD1      LEU  80   8.237  -9.651   7.471
  850   HD12  LEU  80          2HD1      LEU  80   8.737  -9.687   5.779
  851   HD13  LEU  80          3HD1      LEU  80   9.721 -10.480   7.007
  852   HD21  LEU  80          3HD2      LEU  80   9.599  -8.211   9.121
  853   HD22  LEU  80          1HD2      LEU  80  10.976  -9.196   8.624
  854   HD23  LEU  80          2HD2      LEU  80  11.066  -7.437   8.521
  855    H    PHE  81           H        PHE  81  12.805  -7.433   4.061
  856    HA   PHE  81           HA       PHE  81  14.805  -9.569   3.739
  857    HB2  PHE  81           2HB      PHE  81  13.154  -8.362   1.522
  858    HB3  PHE  81           1HB      PHE  81  14.135  -9.821   1.464
  859    HD1  PHE  81           1HD      PHE  81  13.386 -11.838   2.773
  860    HD2  PHE  81           2HD      PHE  81  10.904  -8.434   2.169
  861    HE1  PHE  81           1HE      PHE  81  11.399 -13.189   3.326
  862    HE2  PHE  81           2HE      PHE  81   8.919  -9.780   2.721
  863    HZ   PHE  81           HZ       PHE  81   9.166 -12.157   3.303
  864    H    GLY  82           H        GLY  82  14.004  -6.864   1.602
  865    HA2  GLY  82           1HA      GLY  82  15.336  -4.950   1.187
  866    HA3  GLY  82           2HA      GLY  82  16.655  -5.709   2.075
  Start of MODEL    7
    1    H    SER 641           1H       SER 641  20.197 -17.084 -29.737
    2    HA   SER 641           HA       SER 641  18.913 -16.799 -27.902
    3    HB2  SER 641           2HB      SER 641  18.549 -19.723 -27.790
    4    HB3  SER 641           1HB      SER 641  17.390 -18.456 -28.191
    5    HG   SER 641           HG       SER 641  17.876 -19.820 -29.988
    6    H    LEU 642           H        LEU 642  18.176 -17.835 -25.726
    7    HA   LEU 642           HA       LEU 642  20.294 -17.771 -23.899
    8    HB2  LEU 642           2HB      LEU 642  17.420 -18.321 -23.836
    9    HB3  LEU 642           1HB      LEU 642  18.320 -19.163 -22.591
   10    HG   LEU 642           HG       LEU 642  19.149 -16.409 -22.700
   11   HD11  LEU 642          1HD1      LEU 642  17.269 -15.225 -22.746
   12   HD12  LEU 642          2HD1      LEU 642  16.517 -16.656 -23.453
   13   HD13  LEU 642          3HD1      LEU 642  16.420 -16.375 -21.714
   14   HD21  LEU 642          3HD2      LEU 642  17.968 -18.291 -20.699
   15   HD22  LEU 642          1HD2      LEU 642  19.573 -17.562 -20.737
   16   HD23  LEU 642          2HD2      LEU 642  18.169 -16.582 -20.314
   17    H    GLN 643           H        GLN 643  21.912 -19.199 -23.895
   18    HA   GLN 643           HA       GLN 643  21.513 -21.978 -24.536
   19    HB2  GLN 643           2HB      GLN 643  23.883 -20.363 -23.616
   20    HB3  GLN 643           1HB      GLN 643  23.952 -22.119 -23.709
   21    HG2  GLN 643           2HG      GLN 643  24.656 -21.773 -25.795
   22    HG3  GLN 643           1HG      GLN 643  22.953 -21.498 -26.154
   23   HE21  GLN 643          1HE2      GLN 643  23.858 -20.237 -27.934
   24   HE22  GLN 643          2HE2      GLN 643  24.299 -18.590 -27.643
   25    H    ASN 644           H        ASN 644  21.952 -20.016 -21.651
   26    HA   ASN 644           HA       ASN 644  21.866 -22.243 -19.843
   27    HB2  ASN 644           2HB      ASN 644  22.809 -19.895 -19.364
   28    HB3  ASN 644           1HB      ASN 644  21.132 -19.395 -19.154
   29   HD21  ASN 644          1HD2      ASN 644  20.591 -19.298 -17.106
   30   HD22  ASN 644          2HD2      ASN 644  21.119 -20.375 -15.859
   31    H    ASN 645           H        ASN 645  20.050 -22.862 -18.524
   32    HA   ASN 645           HA       ASN 645  17.611 -22.636 -20.082
   33    HB2  ASN 645           2HB      ASN 645  18.533 -24.833 -19.155
   34    HB3  ASN 645           1HB      ASN 645  17.936 -24.287 -17.586
   35   HD21  ASN 645          1HD2      ASN 645  16.681 -24.143 -20.901
   36   HD22  ASN 645          2HD2      ASN 645  15.142 -24.850 -20.534
   37    H    GLN 646           H        GLN 646  16.149 -21.204 -19.705
   38    HA   GLN 646           HA       GLN 646  14.553 -19.971 -18.674
   39    HB2  GLN 646           2HB      GLN 646  15.453 -21.682 -16.422
   40    HB3  GLN 646           1HB      GLN 646  14.558 -20.227 -16.009
   41    HG2  GLN 646           2HG      GLN 646  13.143 -21.443 -18.097
   42    HG3  GLN 646           1HG      GLN 646  13.600 -22.738 -16.988
   43   HE21  GLN 646          1HE2      GLN 646  11.408 -20.302 -17.625
   44   HE22  GLN 646          2HE2      GLN 646  10.613 -20.255 -16.080
   45    H    ASP 647           H        ASP 647  17.123 -19.971 -16.216
   46    HA   ASP 647           HA       ASP 647  16.879 -17.121 -15.919
   47    HB2  ASP 647           2HB      ASP 647  17.567 -19.044 -14.178
   48    HB3  ASP 647           1HB      ASP 647  19.178 -18.574 -14.711
   49    H    VAL 648           H        VAL 648  18.762 -15.690 -16.029
   50    HA   VAL 648           HA       VAL 648  20.030 -15.915 -18.592
   51    HB   VAL 648           HB       VAL 648  21.160 -13.882 -16.818
   52   HG11  VAL 648          1HG1      VAL 648  20.028 -14.096 -19.551
   53   HG12  VAL 648          2HG1      VAL 648  20.051 -12.502 -18.796
   54   HG13  VAL 648          3HG1      VAL 648  21.555 -13.401 -19.007
   55   HG21  VAL 648          3HG2      VAL 648  19.090 -12.492 -16.781
   56   HG22  VAL 648          1HG2      VAL 648  18.179 -13.918 -17.270
   57   HG23  VAL 648          2HG2      VAL 648  19.028 -13.904 -15.725
   58    H    SER 649           H        SER 649  22.504 -15.243 -18.610
   59    HA   SER 649           HA       SER 649  23.909 -17.443 -17.469
   60    HB2  SER 649           2HB      SER 649  25.587 -15.319 -18.544
   61    HB3  SER 649           1HB      SER 649  25.379 -16.980 -19.108
   62    HG   SER 649           HG       SER 649  24.524 -15.832 -20.735
   63    H    PHE 650           H        PHE 650  23.266 -16.793 -15.215
   64    HA   PHE 650           HA       PHE 650  24.726 -14.592 -14.038
   65    HB2  PHE 650           2HB      PHE 650  23.608 -15.181 -11.970
   66    HB3  PHE 650           1HB      PHE 650  22.432 -15.191 -13.279
   67    HD1  PHE 650           2HD      PHE 650  21.789 -17.439 -14.284
   68    HD2  PHE 650           1HD      PHE 650  23.904 -17.055 -10.612
   69    HE1  PHE 650           2HE      PHE 650  21.118 -19.723 -13.665
   70    HE2  PHE 650           1HE      PHE 650  23.236 -19.339  -9.986
   71    HZ   PHE 650           HZ       PHE 650  21.840 -20.674 -11.513
   72    H    GLU 651           H        GLU 651  25.487 -17.697 -14.908
   73    HA   GLU 651           HA       GLU 651  27.252 -18.253 -12.667
   74    HB2  GLU 651           2HB      GLU 651  27.826 -20.087 -14.689
   75    HB3  GLU 651           1HB      GLU 651  26.787 -20.356 -13.298
   76    HG2  GLU 651           2HG      GLU 651  25.449 -20.990 -15.061
   77    HG3  GLU 651           1HG      GLU 651  24.937 -19.326 -14.779
   78    H    ASN 652           H        ASN 652  27.373 -17.280 -16.023
   79    HA   ASN 652           HA       ASN 652  30.178 -17.364 -16.363
   80    HB2  ASN 652           2HB      ASN 652  27.872 -16.170 -17.816
   81    HB3  ASN 652           1HB      ASN 652  29.468 -15.522 -18.178
   82   HD21  ASN 652          1HD2      ASN 652  27.527 -18.448 -18.107
   83   HD22  ASN 652          2HD2      ASN 652  28.459 -19.309 -19.291
   84    H    ILE 653           H        ILE 653  27.994 -14.894 -15.147
   85    HA   ILE 653           HA       ILE 653  30.356 -13.288 -14.442
   86    HB   ILE 653           HB       ILE 653  28.436 -11.375 -14.537
   87   HG12  ILE 653          2HG1      ILE 653  27.948 -12.773 -17.129
   88   HG13  ILE 653          1HG1      ILE 653  27.048 -13.318 -15.718
   89   HG21  ILE 653          1HG2      ILE 653  29.875 -11.929 -17.074
   90   HG22  ILE 653          2HG2      ILE 653  29.737 -10.431 -16.153
   91   HG23  ILE 653          3HG2      ILE 653  30.830 -11.703 -15.609
   92   HD11  ILE 653          3HD1      ILE 653  25.645 -11.618 -15.894
   93   HD12  ILE 653          1HD1      ILE 653  26.973 -10.454 -15.905
   94   HD13  ILE 653          2HD1      ILE 653  26.434 -11.195 -17.411
   95    H    GLN 654           H        GLN 654  30.530 -13.821 -12.346
   96    HA   GLN 654           HA       GLN 654  28.222 -13.863 -10.601
   97    HB2  GLN 654           2HB      GLN 654  30.888 -13.752  -9.366
   98    HB3  GLN 654           1HB      GLN 654  29.568 -14.868  -9.072
   99    HG2  GLN 654           2HG      GLN 654  30.345 -16.362 -10.570
  100    HG3  GLN 654           1HG      GLN 654  31.016 -15.120 -11.621
  101   HE21  GLN 654          1HE2      GLN 654  31.611 -17.281  -9.031
  102   HE22  GLN 654          2HE2      GLN 654  33.294 -16.921  -8.825
  103    H    TRP 655           H        TRP 655  27.655 -11.622 -11.247
  104    HA   TRP 655           HA       TRP 655  29.382  -9.511 -10.318
  105    HB2  TRP 655           2HB      TRP 655  27.000  -9.727 -12.004
  106    HB3  TRP 655           1HB      TRP 655  26.987  -8.311 -10.956
  107    HD1  TRP 655           HD       TRP 655  27.802  -8.976 -14.311
  108    HE1  TRP 655           1HE      TRP 655  29.713  -7.504 -15.218
  109    HE3  TRP 655           3HE      TRP 655  29.742  -7.339  -9.867
  110    HZ2  TRP 655           2HZ      TRP 655  31.763  -5.874 -14.180
  111    HZ3  TRP 655           3HZ      TRP 655  31.679  -5.825  -9.917
  112    HH2  TRP 655           HH       TRP 655  32.667  -5.109 -12.032
  113    H    SER 656           H        SER 656  29.531  -9.374  -8.184
  114    HA   SER 656           HA       SER 656  27.296  -9.703  -6.423
  115    HB2  SER 656           2HB      SER 656  29.519  -8.410  -5.166
  116    HB3  SER 656           1HB      SER 656  28.956 -10.068  -4.970
  117    HG   SER 656           HG       SER 656  31.206  -9.577  -5.867
  118    H    ILE 657           H        ILE 657  26.300  -7.913  -7.970
  119    HA   ILE 657           HA       ILE 657  26.847  -5.237  -6.889
  120    HB   ILE 657           HB       ILE 657  25.324  -4.519  -8.829
  121   HG12  ILE 657          2HG1      ILE 657  26.112  -6.928 -10.325
  122   HG13  ILE 657          1HG1      ILE 657  24.892  -7.216  -9.088
  123   HG21  ILE 657          1HG2      ILE 657  27.158  -4.208 -10.184
  124   HG22  ILE 657          2HG2      ILE 657  27.923  -4.528  -8.626
  125   HG23  ILE 657          3HG2      ILE 657  27.820  -5.806  -9.838
  126   HD11  ILE 657          3HD1      ILE 657  24.052  -6.694 -11.406
  127   HD12  ILE 657          1HD1      ILE 657  23.381  -5.719 -10.100
  128   HD13  ILE 657          2HD1      ILE 657  24.629  -5.048 -11.148
  129    H    ASP 658           H        ASP 658  24.474  -3.968  -7.366
  130    HA   ASP 658           HA       ASP 658  22.831  -4.785  -5.202
  131    HB2  ASP 658           2HB      ASP 658  22.795  -2.648  -7.237
  132    HB3  ASP 658           1HB      ASP 658  21.205  -3.140  -6.664
  133    HA   PRO 659           HA       PRO 659  20.819  -7.915  -7.693
  134    HB2  PRO 659           2HB      PRO 659  19.771  -9.104  -5.330
  135    HB3  PRO 659           1HB      PRO 659  21.200  -9.596  -6.239
  136    HG2  PRO 659           2HG      PRO 659  21.208  -8.539  -3.668
  137    HG3  PRO 659           1HG      PRO 659  22.605  -8.618  -4.752
  138    HD2  PRO 659           2HD      PRO 659  20.800  -6.318  -4.148
  139    HD3  PRO 659           1HD      PRO 659  22.550  -6.334  -4.467
  140    H    GLY 660           H        GLY 660  19.436  -5.600  -7.816
  141    HA2  GLY 660           1HA      GLY 660  17.240  -5.041  -8.362
  142    HA3  GLY 660           2HA      GLY 660  16.700  -6.540  -7.619
  143    H    ALA 661           H        ALA 661  18.791  -4.346  -5.937
  144    HA   ALA 661           HA       ALA 661  17.041  -4.187  -3.704
  145    HB1  ALA 661           1HB      ALA 661  19.516  -2.571  -4.298
  146    HB2  ALA 661           2HB      ALA 661  18.728  -2.735  -2.729
  147    HB3  ALA 661           3HB      ALA 661  19.483  -4.137  -3.490
  148    H    ASP 662           H        ASP 662  17.149  -2.492  -6.612
  149    HA   ASP 662           HA       ASP 662  16.214   0.051  -5.829
  150    HB2  ASP 662           2HB      ASP 662  17.027  -0.751  -8.145
  151    HB3  ASP 662           1HB      ASP 662  15.375  -1.316  -8.375
  152    H    LEU 663           H        LEU 663  14.679  -3.038  -6.118
  153    HA   LEU 663           HA       LEU 663  12.685  -3.826  -5.386
  154    HB2  LEU 663           2HB      LEU 663  13.030  -1.318  -3.901
  155    HB3  LEU 663           1HB      LEU 663  11.369  -1.858  -4.028
  156    HG   LEU 663           HG       LEU 663  11.705  -3.689  -2.690
  157   HD11  LEU 663          1HD1      LEU 663  13.707  -4.384  -4.235
  158   HD12  LEU 663          2HD1      LEU 663  14.677  -3.729  -2.918
  159   HD13  LEU 663          3HD1      LEU 663  13.549  -5.050  -2.611
  160   HD21  LEU 663          3HD2      LEU 663  13.677  -2.910  -1.031
  161   HD22  LEU 663          1HD2      LEU 663  13.374  -1.399  -1.890
  162   HD23  LEU 663          2HD2      LEU 663  12.060  -2.205  -1.036
  163    H    SER 664           H        SER 664  12.948  -1.994  -7.856
  164    HA   SER 664           HA       SER 664  10.504  -0.644  -8.208
  165    HB2  SER 664           2HB      SER 664  11.498  -1.419 -10.735
  166    HB3  SER 664           1HB      SER 664  11.733   0.125  -9.911
  167    HG   SER 664           HG       SER 664  13.720  -0.415  -9.484
  168    H    GLN 665           H        GLN 665  11.514  -3.935  -8.863
  169    HA   GLN 665           HA       GLN 665   9.192  -4.594 -10.421
  170    HB2  GLN 665           2HB      GLN 665  11.711  -5.725  -9.991
  171    HB3  GLN 665           1HB      GLN 665  10.580  -6.878  -9.294
  172    HG2  GLN 665           2HG      GLN 665  10.920  -7.529 -11.533
  173    HG3  GLN 665           1HG      GLN 665   9.320  -6.795 -11.462
  174   HE21  GLN 665          1HE2      GLN 665  12.535  -6.555 -12.691
  175   HE22  GLN 665          2HE2      GLN 665  12.257  -5.200 -13.745
  176    H    TYR 666           H        TYR 666   9.753  -4.210  -7.133
  177    HA   TYR 666           HA       TYR 666   7.716  -6.177  -6.366
  178    HB2  TYR 666           2HB      TYR 666   9.808  -4.676  -4.803
  179    HB3  TYR 666           1HB      TYR 666   8.467  -5.489  -4.004
  180    HD1  TYR 666           1HD      TYR 666   8.298  -7.901  -5.832
  181    HD2  TYR 666           2HD      TYR 666  11.615  -5.963  -4.003
  182    HE1  TYR 666           1HE      TYR 666   9.552 -10.013  -5.886
  183    HE2  TYR 666           2HE      TYR 666  12.881  -8.072  -4.054
  184    HH   TYR 666           HH       TYR 666  12.864 -10.199  -5.386
  185    H    LYS 667           H        LYS 667   7.715  -3.147  -7.436
  186    HA   LYS 667           HA       LYS 667   6.250  -1.782  -5.388
  187    HB2  LYS 667           2HB      LYS 667   6.872  -1.126  -8.265
  188    HB3  LYS 667           1HB      LYS 667   5.934  -0.067  -7.224
  189    HG2  LYS 667           2HG      LYS 667   8.037  -0.340  -5.645
  190    HG3  LYS 667           1HG      LYS 667   8.831  -0.687  -7.184
  191    HD2  LYS 667           2HD      LYS 667   8.945   1.500  -7.586
  192    HD3  LYS 667           1HD      LYS 667   7.180   1.565  -7.602
  193    HE2  LYS 667           2HE      LYS 667   8.021   1.441  -4.899
  194    HE3  LYS 667           1HE      LYS 667   8.988   2.676  -5.706
  195    HZ1  LYS 667           3HZ      LYS 667   6.926   3.699  -6.494
  196    HZ2  LYS 667           1HZ      LYS 667   6.971   3.620  -4.800
  197    HZ3  LYS 667           2HZ      LYS 667   6.020   2.523  -5.672
  198    H    MET 668           H        MET 668   4.145  -1.745  -5.066
  199    HA   MET 668           HA       MET 668   2.404  -3.052  -7.033
  200    HB2  MET 668           2HB      MET 668   0.741  -3.011  -5.088
  201    HB3  MET 668           1HB      MET 668   2.114  -4.101  -4.953
  202    HG2  MET 668           2HG      MET 668   2.357  -3.221  -2.925
  203    HG3  MET 668           1HG      MET 668   3.085  -1.857  -3.769
  204    HE1  MET 668           3HE      MET 668  -0.929  -1.995  -1.607
  205    HE2  MET 668           1HE      MET 668  -0.468  -3.281  -2.721
  206    HE3  MET 668           2HE      MET 668   0.513  -2.962  -1.290
  207    H    ASP 669           H        ASP 669   0.632  -2.035  -7.889
  208    HA   ASP 669           HA       ASP 669   0.578   0.882  -7.570
  209    HB2  ASP 669           2HB      ASP 669   0.855   0.106  -9.863
  210    HB3  ASP 669           1HB      ASP 669  -0.588  -0.893  -9.728
  211    H    VAL 670           H        VAL 670  -0.879   1.667  -6.217
  212    HA   VAL 670           HA       VAL 670  -3.113   0.034  -5.373
  213    HB   VAL 670           HB       VAL 670  -2.762   2.850  -4.431
  214   HG11  VAL 670          1HG1      VAL 670  -3.690   0.260  -3.224
  215   HG12  VAL 670          2HG1      VAL 670  -3.375   1.702  -2.258
  216   HG13  VAL 670          3HG1      VAL 670  -4.616   1.735  -3.512
  217   HG21  VAL 670          3HG2      VAL 670  -0.686   2.542  -3.714
  218   HG22  VAL 670          1HG2      VAL 670  -1.268   1.227  -2.689
  219   HG23  VAL 670          2HG2      VAL 670  -0.682   0.884  -4.317
  220    H    THR 671           H        THR 671  -4.566  -0.027  -7.026
  221    HA   THR 671           HA       THR 671  -5.582   2.478  -8.137
  222    HB   THR 671           HB       THR 671  -6.813  -0.144  -8.848
  223    HG1  THR 671           1HG      THR 671  -4.130   0.347  -8.970
  224   HG21  THR 671          3HG2      THR 671  -6.292   2.492 -10.094
  225   HG22  THR 671          1HG2      THR 671  -7.696   1.435 -10.231
  226   HG23  THR 671          2HG2      THR 671  -6.239   1.092 -11.164
  227    H    VAL 672           H        VAL 672  -7.441   3.399  -7.567
  228    HA   VAL 672           HA       VAL 672  -9.006   2.014  -5.484
  229    HB   VAL 672           HB       VAL 672  -9.443   4.859  -5.526
  230   HG11  VAL 672          1HG1      VAL 672  -8.057   3.714  -3.228
  231   HG12  VAL 672          2HG1      VAL 672  -9.622   4.523  -3.320
  232   HG13  VAL 672          3HG1      VAL 672  -9.490   2.808  -3.713
  233   HG21  VAL 672          3HG2      VAL 672  -6.891   4.358  -6.290
  234   HG22  VAL 672          1HG2      VAL 672  -7.412   5.796  -5.410
  235   HG23  VAL 672          2HG2      VAL 672  -6.723   4.428  -4.535
  236    H    ILE 673           H        ILE 673 -11.014   1.496  -5.999
  237    HA   ILE 673           HA       ILE 673 -12.305   2.946  -8.221
  238    HB   ILE 673           HB       ILE 673 -12.985   0.127  -7.402
  239   HG12  ILE 673          2HG1      ILE 673 -11.675  -0.170  -9.765
  240   HG13  ILE 673          1HG1      ILE 673 -10.735   1.130  -9.034
  241   HG21  ILE 673          1HG2      ILE 673 -13.376   0.948 -10.168
  242   HG22  ILE 673          2HG2      ILE 673 -14.496   0.176  -9.044
  243   HG23  ILE 673          3HG2      ILE 673 -14.286   1.928  -9.016
  244   HD11  ILE 673          3HD1      ILE 673 -11.261  -1.593  -7.875
  245   HD12  ILE 673          1HD1      ILE 673  -9.730  -0.971  -8.493
  246   HD13  ILE 673          2HD1      ILE 673 -10.437  -0.282  -7.032
  247    H    ASP 674           H        ASP 674 -14.352   3.689  -7.954
  248    HA   ASP 674           HA       ASP 674 -15.412   3.895  -5.291
  249    HB2  ASP 674           2HB      ASP 674 -15.648   5.769  -6.790
  250    HB3  ASP 674           1HB      ASP 674 -16.469   4.775  -7.985
  251    H    THR 675           H        THR 675 -17.574   3.210  -4.657
  252    HA   THR 675           HA       THR 675 -18.022   0.471  -5.320
  253    HB   THR 675           HB       THR 675 -20.272   1.528  -3.943
  254    HG1  THR 675           1HG      THR 675 -17.813   2.352  -2.757
  255   HG21  THR 675          3HG2      THR 675 -18.569  -0.616  -3.753
  256   HG22  THR 675          1HG2      THR 675 -19.841  -0.218  -2.598
  257   HG23  THR 675          2HG2      THR 675 -18.186   0.307  -2.301
  258    H    LYS 676           H        LYS 676 -19.192  -0.296  -6.961
  259    HA   LYS 676           HA       LYS 676 -20.780   1.313  -8.650
  260    HB2  LYS 676           2HB      LYS 676 -19.704  -1.103  -8.968
  261    HB3  LYS 676           1HB      LYS 676 -21.308  -1.617  -8.464
  262    HG2  LYS 676           2HG      LYS 676 -21.368   0.453 -10.511
  263    HG3  LYS 676           1HG      LYS 676 -20.536  -1.014 -11.026
  264    HD2  LYS 676           2HD      LYS 676 -22.584  -1.783 -11.511
  265    HD3  LYS 676           1HD      LYS 676 -22.750  -2.018  -9.770
  266    HE2  LYS 676           2HE      LYS 676 -23.674   0.302  -9.630
  267    HE3  LYS 676           1HE      LYS 676 -23.662   0.353 -11.392
  268    HZ1  LYS 676           3HZ      LYS 676 -25.472  -1.019  -9.594
  269    HZ2  LYS 676           1HZ      LYS 676 -24.970  -1.938 -10.930
  270    HZ3  LYS 676           2HZ      LYS 676 -25.731  -0.444 -11.169
  271    H    ASP 677           H        ASP 677 -21.703  -1.151  -6.240
  272    HA   ASP 677           HA       ASP 677 -24.419  -0.115  -6.223
  273    HB2  ASP 677           2HB      ASP 677 -23.482  -2.633  -5.864
  274    HB3  ASP 677           1HB      ASP 677 -23.631  -2.110  -4.188
  275    H    GLY 678           H        GLY 678 -24.574   1.776  -5.256
  276    HA2  GLY 678           1HA      GLY 678 -24.709   2.370  -2.680
  277    HA3  GLY 678           2HA      GLY 678 -22.962   2.385  -2.901
  278    H    SER 679           H        SER 679 -22.178   3.760  -4.750
  279    HA   SER 679           HA       SER 679 -23.334   6.380  -4.489
  280    HB2  SER 679           2HB      SER 679 -21.272   6.121  -6.535
  281    HB3  SER 679           1HB      SER 679 -21.262   7.073  -5.050
  282    HG   SER 679           HG       SER 679 -19.695   5.215  -5.328
  283    H    GLN 680           H        GLN 680 -23.239   3.849  -6.907
  284    HA   GLN 680           HA       GLN 680 -24.573   5.537  -8.870
  285    HB2  GLN 680           2HB      GLN 680 -22.801   3.411  -9.088
  286    HB3  GLN 680           1HB      GLN 680 -24.348   2.713  -9.546
  287    HG2  GLN 680           2HG      GLN 680 -23.556   5.312 -10.745
  288    HG3  GLN 680           1HG      GLN 680 -22.772   3.839 -11.316
  289   HE21  GLN 680          1HE2      GLN 680 -23.772   2.672 -12.806
  290   HE22  GLN 680          2HE2      GLN 680 -25.421   2.881 -13.298
  291    H    SER 681           H        SER 681 -26.171   5.439  -6.785
  292    HA   SER 681           HA       SER 681 -28.012   3.243  -6.828
  293    HB2  SER 681           2HB      SER 681 -29.185   5.537  -5.614
  294    HB3  SER 681           1HB      SER 681 -28.481   4.126  -4.815
  295    HG   SER 681           HG       SER 681 -26.668   5.199  -4.462
  296    H    LYS 682           H        LYS 682 -27.499   5.869  -8.819
  297    HA   LYS 682           HA       LYS 682 -30.094   6.709  -9.477
  298    HB2  LYS 682           2HB      LYS 682 -28.021   7.929 -10.075
  299    HB3  LYS 682           1HB      LYS 682 -27.641   6.670 -11.240
  300    HG2  LYS 682           2HG      LYS 682 -28.686   7.941 -12.729
  301    HG3  LYS 682           1HG      LYS 682 -30.185   7.420 -11.958
  302    HD2  LYS 682           2HD      LYS 682 -28.770   9.691 -10.696
  303    HD3  LYS 682           1HD      LYS 682 -29.509  10.000 -12.270
  304    HE2  LYS 682           2HE      LYS 682 -31.272   8.504 -10.526
  305    HE3  LYS 682           1HE      LYS 682 -30.770  10.029  -9.793
  306    HZ1  LYS 682           3HZ      LYS 682 -32.826   9.861 -11.413
  307    HZ2  LYS 682           1HZ      LYS 682 -31.624  10.095 -12.588
  308    HZ3  LYS 682           2HZ      LYS 682 -31.841  11.244 -11.360
  309    H    LEU 683           H        LEU 683 -27.965   4.355 -11.078
  310    HA   LEU 683           HA       LEU 683 -30.262   3.409 -12.638
  311    HB2  LEU 683           2HB      LEU 683 -27.362   3.489 -13.031
  312    HB3  LEU 683           1HB      LEU 683 -28.087   1.959 -13.486
  313    HG   LEU 683           HG       LEU 683 -29.759   3.852 -14.643
  314   HD11  LEU 683          1HD1      LEU 683 -27.539   4.858 -15.966
  315   HD12  LEU 683          2HD1      LEU 683 -28.604   5.735 -14.865
  316   HD13  LEU 683          3HD1      LEU 683 -27.128   4.985 -14.254
  317   HD21  LEU 683          3HD2      LEU 683 -27.486   2.223 -15.759
  318   HD22  LEU 683          1HD2      LEU 683 -29.192   1.782 -15.680
  319   HD23  LEU 683          2HD2      LEU 683 -28.665   3.079 -16.751
  320    H    GLY 684           H        GLY 684 -28.871   2.744  -9.758
  321    HA2  GLY 684           1HA      GLY 684 -29.756  -0.057  -9.885
  322    HA3  GLY 684           2HA      GLY 684 -28.188   0.333  -9.192
  323    H    GLY 685           H        GLY 685 -31.645   1.088  -8.879
  324    HA2  GLY 685           1HA      GLY 685 -32.291   0.372  -6.455
  325    HA3  GLY 685           2HA      GLY 685 -31.211   1.696  -6.043
  326    H    GLY 901           H        GLY 901 -31.777   3.629  -7.786
  327    HA2  GLY 901           1HA      GLY 901 -33.525   4.964  -8.679
  328    HA3  GLY 901           2HA      GLY 901 -34.685   4.015  -7.760
  329    H    GLY 902           H        GLY 902 -34.271   4.154  -5.293
  330    HA2  GLY 902           1HA      GLY 902 -33.043   6.396  -4.153
  331    HA3  GLY 902           2HA      GLY 902 -34.712   6.821  -4.509
  332    H    SER 903           H        SER 903 -35.554   6.923  -2.500
  333    HA   SER 903           HA       SER 903 -35.185   4.614  -0.731
  334    HB2  SER 903           2HB      SER 903 -36.368   7.322  -0.089
  335    HB3  SER 903           1HB      SER 903 -35.927   6.062   1.061
  336    HG   SER 903           HG       SER 903 -34.321   7.694   0.904
  337    H    GLY 904           H        GLY 904 -37.262   4.371   0.749
  338    HA2  GLY 904           1HA      GLY 904 -39.797   4.708   0.384
  339    HA3  GLY 904           2HA      GLY 904 -39.474   3.876  -1.130
  340    H    GLY 905           H        GLY 905 -37.553   2.889   1.503
  341    HA2  GLY 905           1HA      GLY 905 -38.680   1.186   3.104
  342    HA3  GLY 905           2HA      GLY 905 -39.029   0.356   1.591
  343    H    HIS 906           H        HIS 906 -37.425  -0.624   3.779
  344    HA   HIS 906           HA       HIS 906 -34.678  -0.476   2.871
  345    HB2  HIS 906           2HB      HIS 906 -36.050  -1.946   5.121
  346    HB3  HIS 906           1HB      HIS 906 -34.361  -2.237   4.718
  347    HD1  HIS 906           1HD      HIS 906 -32.741  -0.794   5.973
  348    HD2  HIS 906           2HD      HIS 906 -36.514   0.938   5.670
  349    HE1  HIS 906           1HE      HIS 906 -32.644   1.374   7.279
  350    H    MET 907           H        MET 907 -35.101  -1.281   0.732
  351    HA   MET 907           HA       MET 907 -35.888  -4.074   0.494
  352    HB2  MET 907           2HB      MET 907 -36.136  -3.698  -1.805
  353    HB3  MET 907           1HB      MET 907 -36.649  -2.186  -1.072
  354    HG2  MET 907           2HG      MET 907 -34.149  -1.512  -1.461
  355    HG3  MET 907           1HG      MET 907 -34.216  -2.791  -2.671
  356    HE1  MET 907           3HE      MET 907 -34.252  -0.069  -5.026
  357    HE2  MET 907           1HE      MET 907 -33.581  -1.562  -4.369
  358    HE3  MET 907           2HE      MET 907 -34.968  -1.622  -5.455
  359    H    GLY 908           H        GLY 908 -33.046  -2.298   0.859
  360    HA2  GLY 908           1HA      GLY 908 -30.899  -3.169   1.107
  361    HA3  GLY 908           2HA      GLY 908 -31.448  -4.667   0.368
  362    H    SER 909           H        SER 909 -29.057  -3.793  -0.394
  363    HA   SER 909           HA       SER 909 -29.160  -2.124  -2.720
  364    HB2  SER 909           2HB      SER 909 -26.846  -3.906  -2.467
  365    HB3  SER 909           1HB      SER 909 -26.912  -2.143  -2.517
  366    HG   SER 909           HG       SER 909 -26.861  -2.075  -0.415
  367    H    GLY 910           H        GLY 910 -27.943  -3.168  -4.761
  368    HA2  GLY 910           1HA      GLY 910 -29.735  -5.198  -5.754
  369    HA3  GLY 910           2HA      GLY 910 -28.404  -4.453  -6.634
  370    H    GLY 911           H        GLY 911 -26.328  -4.968  -4.896
  371    HA2  GLY 911           1HA      GLY 911 -26.269  -7.924  -4.726
  372    HA3  GLY 911           2HA      GLY 911 -24.889  -6.980  -5.279
  373    H    LEU  18           H        LEU  18 -26.770  -7.973  -2.527
  374    HA   LEU  18           HA       LEU  18 -25.603  -6.139  -0.675
  375    HB2  LEU  18           2HB      LEU  18 -27.684  -8.093  -0.665
  376    HB3  LEU  18           1HB      LEU  18 -26.632  -8.387   0.706
  377    HG   LEU  18           HG       LEU  18 -27.440  -5.576   0.309
  378   HD11  LEU  18          1HD1      LEU  18 -29.655  -5.765   0.862
  379   HD12  LEU  18          2HD1      LEU  18 -29.455  -7.175  -0.176
  380   HD13  LEU  18          3HD1      LEU  18 -29.454  -7.364   1.576
  381   HD21  LEU  18          3HD2      LEU  18 -27.381  -5.520   2.646
  382   HD22  LEU  18          1HD2      LEU  18 -27.606  -7.263   2.783
  383   HD23  LEU  18          2HD2      LEU  18 -26.070  -6.614   2.207
  384    H    SER  19           H        SER  19 -24.221  -8.717  -2.187
  385    HA   SER  19           HA       SER  19 -22.583  -9.512   0.086
  386    HB2  SER  19           2HB      SER  19 -22.358 -10.342  -2.815
  387    HB3  SER  19           1HB      SER  19 -21.535 -11.087  -1.443
  388    HG   SER  19           HG       SER  19 -24.328 -10.894  -1.372
  389    H    TRP  20           H        TRP  20 -22.636  -7.188  -2.369
  390    HA   TRP  20           HA       TRP  20 -21.148  -5.738  -3.279
  391    HB2  TRP  20           2HB      TRP  20 -19.594  -5.893  -0.708
  392    HB3  TRP  20           1HB      TRP  20 -19.894  -4.491  -1.732
  393    HD1  TRP  20           HD       TRP  20 -22.839  -4.071  -1.861
  394    HE1  TRP  20           1HE      TRP  20 -24.339  -3.774   0.206
  395    HE3  TRP  20           3HE      TRP  20 -19.815  -6.225   1.662
  396    HZ2  TRP  20           2HZ      TRP  20 -24.254  -4.364   2.964
  397    HZ3  TRP  20           3HZ      TRP  20 -20.601  -6.313   3.992
  398    HH2  TRP  20           HH       TRP  20 -22.773  -5.401   4.627
  399    H    LYS  21           H        LYS  21 -18.404  -6.432  -1.488
  400    HA   LYS  21           HA       LYS  21 -17.418  -8.420  -3.399
  401    HB2  LYS  21           2HB      LYS  21 -16.346  -5.711  -2.867
  402    HB3  LYS  21           1HB      LYS  21 -15.155  -7.004  -2.942
  403    HG2  LYS  21           2HG      LYS  21 -16.938  -5.936  -5.081
  404    HG3  LYS  21           1HG      LYS  21 -15.206  -6.259  -5.120
  405    HD2  LYS  21           2HD      LYS  21 -15.491  -8.457  -5.645
  406    HD3  LYS  21           1HD      LYS  21 -16.990  -8.593  -4.722
  407    HE2  LYS  21           2HE      LYS  21 -17.984  -7.071  -6.556
  408    HE3  LYS  21           1HE      LYS  21 -16.565  -7.532  -7.494
  409    HZ1  LYS  21           3HZ      LYS  21 -17.448  -9.912  -6.629
  410    HZ2  LYS  21           1HZ      LYS  21 -17.859  -9.228  -8.126
  411    HZ3  LYS  21           2HZ      LYS  21 -18.912  -9.074  -6.808
  412    H    ARG  22           H        ARG  22 -15.681  -9.724  -2.532
  413    HA   ARG  22           HA       ARG  22 -15.962  -9.933   0.367
  414    HB2  ARG  22           2HB      ARG  22 -15.949 -12.157   0.142
  415    HB3  ARG  22           1HB      ARG  22 -16.251 -11.837  -1.559
  416    HG2  ARG  22           2HG      ARG  22 -14.389 -12.868  -2.080
  417    HG3  ARG  22           1HG      ARG  22 -13.459 -11.706  -1.139
  418    HD2  ARG  22           2HD      ARG  22 -14.208 -13.145   0.888
  419    HD3  ARG  22           1HD      ARG  22 -14.511 -14.385  -0.331
  420    HE   ARG  22           HE       ARG  22 -11.884 -13.084   0.012
  421   HH11  ARG  22          2HH1      ARG  22 -13.873 -15.935  -0.420
  422   HH12  ARG  22          1HH1      ARG  22 -12.516 -17.007  -0.616
  423   HH21  ARG  22          2HH2      ARG  22 -10.101 -14.486  -0.223
  424   HH22  ARG  22          1HH2      ARG  22 -10.372 -16.183  -0.470
  425    H    CYS  23           H        CYS  23 -14.222 -10.123   1.725
  426    HA   CYS  23           HA       CYS  23 -12.100  -8.399   1.225
  427    HB2  CYS  23           2HB      CYS  23 -12.627 -10.456   3.326
  428    HB3  CYS  23           1HB      CYS  23 -11.102  -9.593   3.279
  429    H    ALA  24           H        ALA  24  -9.876  -8.734   1.087
  430    HA   ALA  24           HA       ALA  24  -9.035 -11.387   0.112
  431    HB1  ALA  24           1HB      ALA  24  -7.388  -9.040  -0.604
  432    HB2  ALA  24           2HB      ALA  24  -7.804 -10.470  -1.549
  433    HB3  ALA  24           3HB      ALA  24  -8.967  -9.155  -1.383
  434    H    GLY  25           H        GLY  25  -8.673  -8.919   2.421
  435    HA2  GLY  25           1HA      GLY  25  -6.154 -10.105   3.405
  436    HA3  GLY  25           2HA      GLY  25  -6.662  -8.451   3.705
  437    H    CYS  26           H        CYS  26  -9.018  -8.435   4.787
  438    HA   CYS  26           HA       CYS  26  -8.707  -9.530   7.353
  439    HB2  CYS  26           2HB      CYS  26 -11.471  -8.920   6.417
  440    HB3  CYS  26           1HB      CYS  26 -10.678  -8.496   7.928
  441    H    GLY  27           H        GLY  27 -11.280 -10.364   5.042
  442    HA2  GLY  27           1HA      GLY  27 -11.344 -12.769   4.361
  443    HA3  GLY  27           2HA      GLY  27 -11.138 -13.130   6.069
  444    H    GLY  28           H        GLY  28 -13.192 -10.570   4.794
  445    HA2  GLY  28           1HA      GLY  28 -15.567 -12.208   5.355
  446    HA3  GLY  28           2HA      GLY  28 -15.386 -10.658   6.167
  447    H    LYS  29           H        LYS  29 -16.841  -9.344   5.278
  448    HA   LYS  29           HA       LYS  29 -16.943  -9.197   2.334
  449    HB2  LYS  29           2HB      LYS  29 -19.034  -8.430   4.383
  450    HB3  LYS  29           1HB      LYS  29 -19.178  -8.138   2.655
  451    HG2  LYS  29           2HG      LYS  29 -18.593 -10.851   2.876
  452    HG3  LYS  29           1HG      LYS  29 -19.748 -10.522   4.167
  453    HD2  LYS  29           2HD      LYS  29 -20.161  -9.658   1.311
  454    HD3  LYS  29           1HD      LYS  29 -20.748 -11.193   1.954
  455    HE2  LYS  29           2HE      LYS  29 -21.519  -8.420   2.851
  456    HE3  LYS  29           1HE      LYS  29 -22.537  -9.595   2.024
  457    HZ1  LYS  29           3HZ      LYS  29 -21.861 -11.014   4.154
  458    HZ2  LYS  29           1HZ      LYS  29 -23.212  -9.988   4.128
  459    HZ3  LYS  29           2HZ      LYS  29 -21.761  -9.463   4.831
  460    H    ILE  30           H        ILE  30 -16.467  -7.314   1.356
  461    HA   ILE  30           HA       ILE  30 -15.184  -5.281   2.907
  462    HB   ILE  30           HB       ILE  30 -15.775  -5.568  -0.035
  463   HG12  ILE  30          2HG1      ILE  30 -13.089  -5.355   1.292
  464   HG13  ILE  30          1HG1      ILE  30 -13.954  -6.889   1.268
  465   HG21  ILE  30          1HG2      ILE  30 -14.315  -3.296   1.310
  466   HG22  ILE  30          2HG2      ILE  30 -14.430  -3.564  -0.429
  467   HG23  ILE  30          3HG2      ILE  30 -15.879  -3.188   0.502
  468   HD11  ILE  30          3HD1      ILE  30 -14.087  -6.478  -1.283
  469   HD12  ILE  30          1HD1      ILE  30 -12.765  -5.347  -0.990
  470   HD13  ILE  30          2HD1      ILE  30 -12.579  -7.050  -0.565
  471    H    ALA  31           H        ALA  31 -16.335  -3.905   4.058
  472    HA   ALA  31           HA       ALA  31 -18.888  -2.927   2.984
  473    HB1  ALA  31           1HB      ALA  31 -19.748  -3.036   5.045
  474    HB2  ALA  31           2HB      ALA  31 -18.345  -4.028   5.439
  475    HB3  ALA  31           3HB      ALA  31 -18.324  -2.298   5.778
  476    H    ASP  32           H        ASP  32 -16.066  -1.985   2.463
  477    HA   ASP  32           HA       ASP  32 -16.048   0.699   3.568
  478    HB2  ASP  32           2HB      ASP  32 -14.207  -0.872   1.786
  479    HB3  ASP  32           1HB      ASP  32 -14.052   0.878   1.882
  480    H    ARG  33           H        ARG  33 -15.412   2.412   1.689
  481    HA   ARG  33           HA       ARG  33 -17.654   2.281  -0.190
  482    HB2  ARG  33           2HB      ARG  33 -16.885   4.333   1.362
  483    HB3  ARG  33           1HB      ARG  33 -15.936   4.693  -0.073
  484    HG2  ARG  33           2HG      ARG  33 -18.255   4.279  -1.272
  485    HG3  ARG  33           1HG      ARG  33 -18.873   4.734   0.316
  486    HD2  ARG  33           2HD      ARG  33 -18.587   6.862  -0.241
  487    HD3  ARG  33           1HD      ARG  33 -16.849   6.573  -0.271
  488    HE   ARG  33           HE       ARG  33 -18.007   5.773  -2.722
  489   HH11  ARG  33          2HH1      ARG  33 -17.084   8.618  -0.906
  490   HH12  ARG  33          1HH1      ARG  33 -16.915   9.621  -2.317
  491   HH21  ARG  33          2HH2      ARG  33 -17.739   7.050  -4.576
  492   HH22  ARG  33          1HH2      ARG  33 -17.264   8.720  -4.411
  493    H    PHE  34           H        PHE  34 -14.139   2.798  -0.155
  494    HA   PHE  34           HA       PHE  34 -14.189   2.526  -3.066
  495    HB2  PHE  34           2HB      PHE  34 -12.477   4.014  -1.204
  496    HB3  PHE  34           1HB      PHE  34 -11.614   3.208  -2.515
  497    HD1  PHE  34           1HD      PHE  34 -14.798   5.110  -2.114
  498    HD2  PHE  34           2HD      PHE  34 -11.238   4.514  -4.367
  499    HE1  PHE  34           1HE      PHE  34 -15.495   6.876  -3.668
  500    HE2  PHE  34           2HE      PHE  34 -11.925   6.288  -5.926
  501    HZ   PHE  34           HZ       PHE  34 -14.057   7.469  -5.582
  502    H    LEU  35           H        LEU  35 -13.262   0.942  -4.118
  503    HA   LEU  35           HA       LEU  35 -12.191  -1.294  -2.576
  504    HB2  LEU  35           2HB      LEU  35 -13.477  -0.945  -5.217
  505    HB3  LEU  35           1HB      LEU  35 -12.214  -2.158  -5.144
  506    HG   LEU  35           HG       LEU  35 -13.798  -2.678  -2.913
  507   HD11  LEU  35          1HD1      LEU  35 -16.034  -3.019  -4.115
  508   HD12  LEU  35          2HD1      LEU  35 -15.639  -1.390  -3.564
  509   HD13  LEU  35          3HD1      LEU  35 -15.448  -1.815  -5.265
  510   HD21  LEU  35          3HD2      LEU  35 -13.279  -4.644  -3.807
  511   HD22  LEU  35          1HD2      LEU  35 -14.619  -4.404  -4.930
  512   HD23  LEU  35          2HD2      LEU  35 -12.985  -3.916  -5.386
  513    H    LEU  36           H        LEU  36 -10.146  -2.108  -2.895
  514    HA   LEU  36           HA       LEU  36  -8.341  -0.236  -4.272
  515    HB2  LEU  36           2HB      LEU  36  -8.180  -1.613  -1.637
  516    HB3  LEU  36           1HB      LEU  36  -6.688  -1.318  -2.509
  517    HG   LEU  36           HG       LEU  36  -7.529   1.138  -2.641
  518   HD11  LEU  36          1HD1      LEU  36  -9.040   0.228  -0.201
  519   HD12  LEU  36          2HD1      LEU  36  -8.984   1.850  -0.893
  520   HD13  LEU  36          3HD1      LEU  36  -9.799   0.548  -1.761
  521   HD21  LEU  36          3HD2      LEU  36  -6.634   1.479  -0.264
  522   HD22  LEU  36          1HD2      LEU  36  -6.421  -0.272  -0.246
  523   HD23  LEU  36          2HD2      LEU  36  -5.580   0.707  -1.447
  524    H    TYR  37           H        TYR  37  -7.003  -0.995  -5.745
  525    HA   TYR  37           HA       TYR  37  -6.683  -3.894  -6.099
  526    HB2  TYR  37           2HB      TYR  37  -6.485  -1.507  -7.840
  527    HB3  TYR  37           1HB      TYR  37  -5.282  -2.756  -8.134
  528    HD1  TYR  37           2HD      TYR  37  -6.705  -5.243  -7.791
  529    HD2  TYR  37           1HD      TYR  37  -8.054  -1.590  -9.498
  530    HE1  TYR  37           2HE      TYR  37  -8.326  -6.488  -9.161
  531    HE2  TYR  37           1HE      TYR  37  -9.678  -2.814 -10.867
  532    HH   TYR  37           HH       TYR  37 -10.320  -4.837 -11.595
  533    H    ALA  38           H        ALA  38  -4.971  -4.754  -5.086
  534    HA   ALA  38           HA       ALA  38  -2.625  -3.057  -4.592
  535    HB1  ALA  38           1HB      ALA  38  -2.004  -4.567  -2.864
  536    HB2  ALA  38           2HB      ALA  38  -3.727  -4.237  -2.678
  537    HB3  ALA  38           3HB      ALA  38  -3.195  -5.756  -3.394
  538    H    MET  39           H        MET  39  -3.674  -5.925  -6.257
  539    HA   MET  39           HA       MET  39  -1.230  -6.148  -7.691
  540    HB2  MET  39           2HB      MET  39  -0.464  -8.289  -6.854
  541    HB3  MET  39           1HB      MET  39  -0.548  -7.135  -5.533
  542    HG2  MET  39           2HG      MET  39  -2.589  -8.123  -4.734
  543    HG3  MET  39           1HG      MET  39  -2.625  -9.230  -6.107
  544    HE1  MET  39           3HE      MET  39  -0.362  -8.001  -3.154
  545    HE2  MET  39           1HE      MET  39  -1.722  -8.885  -2.462
  546    HE3  MET  39           2HE      MET  39  -0.089  -9.531  -2.323
  547    H    ASP  40           H        ASP  40  -4.323  -7.515  -6.778
  548    HA   ASP  40           HA       ASP  40  -5.165  -8.042  -9.379
  549    HB2  ASP  40           2HB      ASP  40  -4.501 -10.132  -9.894
  550    HB3  ASP  40           1HB      ASP  40  -3.309  -9.941  -8.617
  551    H    SER  41           H        SER  41  -5.366  -8.651  -5.963
  552    HA   SER  41           HA       SER  41  -8.034  -9.749  -6.125
  553    HB2  SER  41           2HB      SER  41  -7.232  -9.098  -3.456
  554    HB3  SER  41           1HB      SER  41  -7.378 -10.694  -4.200
  555    HG   SER  41           HG       SER  41  -5.271 -10.647  -4.772
  556    H    TYR  42           H        TYR  42  -9.757  -8.817  -4.728
  557    HA   TYR  42           HA       TYR  42  -9.829  -5.907  -4.974
  558    HB2  TYR  42           2HB      TYR  42 -12.058  -7.759  -4.112
  559    HB3  TYR  42           1HB      TYR  42 -12.207  -6.079  -4.606
  560    HD1  TYR  42           1HD      TYR  42 -10.709  -5.924  -7.078
  561    HD2  TYR  42           2HD      TYR  42 -13.191  -9.059  -5.629
  562    HE1  TYR  42           1HE      TYR  42 -11.133  -6.649  -9.388
  563    HE2  TYR  42           2HE      TYR  42 -13.620  -9.793  -7.934
  564    HH   TYR  42           HH       TYR  42 -11.873  -8.465 -10.646
  565    H    TRP  43           H        TRP  43  -9.223  -4.728  -3.277
  566    HA   TRP  43           HA       TRP  43  -9.694  -5.831  -0.581
  567    HB2  TRP  43           2HB      TRP  43  -7.564  -3.779  -1.089
  568    HB3  TRP  43           1HB      TRP  43  -7.682  -4.944   0.217
  569    HD1  TRP  43           HD       TRP  43  -7.052  -5.049  -3.615
  570    HE1  TRP  43           1HE      TRP  43  -5.261  -6.830  -4.063
  571    HE3  TRP  43           3HE      TRP  43  -6.347  -6.739   1.160
  572    HZ2  TRP  43           2HZ      TRP  43  -3.732  -8.688  -2.615
  573    HZ3  TRP  43           3HZ      TRP  43  -4.694  -8.522   1.539
  574    HH2  TRP  43           HH       TRP  43  -3.417  -9.476  -0.314
  575    H    HIS  44           H        HIS  44  -9.686  -4.023   1.086
  576    HA   HIS  44           HA       HIS  44 -10.533  -1.419   0.011
  577    HB2  HIS  44           2HB      HIS  44 -12.040  -1.169   2.056
  578    HB3  HIS  44           1HB      HIS  44 -12.614  -2.271   0.814
  579    HD1  HIS  44           1HD      HIS  44 -13.380  -2.363   4.006
  580    HD2  HIS  44           2HD      HIS  44 -10.740  -4.801   1.910
  581    HE1  HIS  44           1HE      HIS  44 -13.204  -4.585   5.289
  582    H    SER  45           H        SER  45 -10.533   0.076   2.319
  583    HA   SER  45           HA       SER  45  -7.773   0.370   2.790
  584    HB2  SER  45           2HB      SER  45  -9.912   1.435   4.619
  585    HB3  SER  45           1HB      SER  45  -8.347   2.147   4.226
  586    HG   SER  45           HG       SER  45  -9.235   3.100   2.596
  587    H    ARG  46           H        ARG  46 -10.207  -1.498   4.395
  588    HA   ARG  46           HA       ARG  46  -8.615  -1.967   6.754
  589    HB2  ARG  46           2HB      ARG  46 -11.323  -2.290   6.031
  590    HB3  ARG  46           1HB      ARG  46 -10.718  -3.897   6.407
  591    HG2  ARG  46           2HG      ARG  46 -10.386  -1.528   8.229
  592    HG3  ARG  46           1HG      ARG  46 -11.730  -2.670   8.326
  593    HD2  ARG  46           2HD      ARG  46 -10.218  -4.489   8.757
  594    HD3  ARG  46           1HD      ARG  46  -8.822  -3.445   8.490
  595    HE   ARG  46           HE       ARG  46  -9.302  -2.338  10.539
  596   HH11  ARG  46          2HH1      ARG  46 -11.314  -5.142   9.931
  597   HH12  ARG  46          1HH1      ARG  46 -11.772  -5.332  11.599
  598   HH21  ARG  46          2HH2      ARG  46  -9.897  -2.587  12.738
  599   HH22  ARG  46          1HH2      ARG  46 -10.923  -3.918  13.200
  600    H    CYS  47           H        CYS  47  -9.181  -3.542   3.678
  601    HA   CYS  47           HA       CYS  47  -7.961  -6.042   4.456
  602    HB2  CYS  47           2HB      CYS  47  -9.293  -4.970   2.082
  603    HB3  CYS  47           1HB      CYS  47  -7.882  -5.941   1.688
  604    H    LEU  48           H        LEU  48  -7.108  -3.348   2.328
  605    HA   LEU  48           HA       LEU  48  -4.499  -4.379   1.814
  606    HB2  LEU  48           2HB      LEU  48  -6.226  -2.517   0.643
  607    HB3  LEU  48           1HB      LEU  48  -4.841  -1.582   1.174
  608    HG   LEU  48           HG       LEU  48  -5.115  -3.275  -1.124
  609   HD11  LEU  48          1HD1      LEU  48  -3.828  -1.661  -1.906
  610   HD12  LEU  48          2HD1      LEU  48  -3.780  -0.970  -0.283
  611   HD13  LEU  48          3HD1      LEU  48  -2.527  -2.100  -0.800
  612   HD21  LEU  48          3HD2      LEU  48  -4.082  -4.948   0.489
  613   HD22  LEU  48          1HD2      LEU  48  -3.205  -4.653  -1.011
  614   HD23  LEU  48          2HD2      LEU  48  -2.657  -3.908   0.492
  615    H    LYS  49           H        LYS  49  -3.626  -4.564   3.870
  616    HA   LYS  49           HA       LYS  49  -2.484  -2.050   4.820
  617    HB2  LYS  49           2HB      LYS  49  -2.686  -3.349   7.179
  618    HB3  LYS  49           1HB      LYS  49  -3.876  -2.186   6.622
  619    HG2  LYS  49           2HG      LYS  49  -5.258  -3.877   7.209
  620    HG3  LYS  49           1HG      LYS  49  -4.940  -4.346   5.538
  621    HD2  LYS  49           2HD      LYS  49  -3.480  -6.043   6.162
  622    HD3  LYS  49           1HD      LYS  49  -3.190  -5.340   7.754
  623    HE2  LYS  49           2HE      LYS  49  -4.619  -7.411   7.733
  624    HE3  LYS  49           1HE      LYS  49  -5.322  -6.010   8.539
  625    HZ1  LYS  49           3HZ      LYS  49  -5.960  -6.969   5.802
  626    HZ2  LYS  49           1HZ      LYS  49  -6.587  -5.559   6.503
  627    HZ3  LYS  49           2HZ      LYS  49  -6.960  -7.069   7.168
  628    H    CYS  50           H        CYS  50  -0.608  -2.455   6.216
  629    HA   CYS  50           HA       CYS  50   1.187  -4.272   5.007
  630    HB2  CYS  50           2HB      CYS  50   1.839  -2.118   6.001
  631    HB3  CYS  50           1HB      CYS  50   1.386  -2.717   7.589
  632    H    SER  51           H        SER  51   1.797  -6.275   5.604
  633    HA   SER  51           HA       SER  51   0.161  -7.669   7.514
  634    HB2  SER  51           2HB      SER  51   2.604  -8.876   6.245
  635    HB3  SER  51           1HB      SER  51   1.065  -9.640   6.647
  636    HG   SER  51           HG       SER  51   0.909  -7.580   4.810
  637    H    SER  52           H        SER  52   2.896  -5.786   7.785
  638    HA   SER  52           HA       SER  52   4.039  -7.392   9.948
  639    HB2  SER  52           2HB      SER  52   5.545  -5.009   9.378
  640    HB3  SER  52           1HB      SER  52   6.016  -6.700   9.183
  641    HG   SER  52           HG       SER  52   4.632  -5.059   7.317
  642    H    CYS  53           H        CYS  53   3.064  -3.975   9.345
  643    HA   CYS  53           HA       CYS  53   3.030  -3.660  12.265
  644    HB2  CYS  53           2HB      CYS  53   3.197  -1.248  11.920
  645    HB3  CYS  53           1HB      CYS  53   4.524  -2.094  11.142
  646    H    GLN  54           H        GLN  54   1.008  -4.048   9.652
  647    HA   GLN  54           HA       GLN  54  -1.227  -4.084   9.406
  648    HB2  GLN  54           2HB      GLN  54  -0.756  -4.620  12.141
  649    HB3  GLN  54           1HB      GLN  54  -2.155  -3.557  12.055
  650    HG2  GLN  54           2HG      GLN  54  -2.194  -5.729  10.105
  651    HG3  GLN  54           1HG      GLN  54  -2.199  -6.267  11.781
  652   HE21  GLN  54          1HE2      GLN  54  -3.738  -3.720   9.831
  653   HE22  GLN  54          2HE2      GLN  54  -5.330  -3.958  10.468
  654    H    ALA  55           H        ALA  55   0.249  -1.493   9.414
  655    HA   ALA  55           HA       ALA  55  -1.686   0.468  10.233
  656    HB1  ALA  55           1HB      ALA  55   0.683   1.049  10.057
  657    HB2  ALA  55           2HB      ALA  55   0.653   0.699   8.331
  658    HB3  ALA  55           3HB      ALA  55  -0.284   2.047   8.974
  659    H    GLN  56           H        GLN  56  -2.938   1.791   8.751
  660    HA   GLN  56           HA       GLN  56  -4.167   0.230   6.682
  661    HB2  GLN  56           2HB      GLN  56  -4.626   2.884   7.924
  662    HB3  GLN  56           1HB      GLN  56  -5.198   2.690   6.271
  663    HG2  GLN  56           2HG      GLN  56  -6.384   0.614   7.044
  664    HG3  GLN  56           1HG      GLN  56  -5.980   1.091   8.690
  665   HE21  GLN  56          1HE2      GLN  56  -6.576   3.635   6.476
  666   HE22  GLN  56          2HE2      GLN  56  -8.163   4.036   7.025
  667    H    LEU  57           H        LEU  57  -2.112  -0.100   5.618
  668    HA   LEU  57           HA       LEU  57  -0.571   1.976   4.514
  669    HB2  LEU  57           2HB      LEU  57   0.589   0.035   4.923
  670    HB3  LEU  57           1HB      LEU  57  -0.709  -0.991   4.352
  671    HG   LEU  57           HG       LEU  57  -0.086  -0.092   2.010
  672   HD11  LEU  57          1HD1      LEU  57   2.618   0.243   3.226
  673   HD12  LEU  57          2HD1      LEU  57   1.985   0.869   1.701
  674   HD13  LEU  57          3HD1      LEU  57   1.488   1.598   3.229
  675   HD21  LEU  57          3HD2      LEU  57   2.108  -1.736   2.407
  676   HD22  LEU  57          1HD2      LEU  57   0.969  -2.222   3.664
  677   HD23  LEU  57          2HD2      LEU  57   0.477  -2.245   1.969
  678    H    GLY  58           H        GLY  58  -3.386   0.320   3.352
  679    HA2  GLY  58           1HA      GLY  58  -2.934   0.913   0.579
  680    HA3  GLY  58           2HA      GLY  58  -4.420   0.298   1.289
  681    H    ASP  59           H        ASP  59  -4.224   2.658   3.244
  682    HA   ASP  59           HA       ASP  59  -5.739   4.449   1.508
  683    HB2  ASP  59           2HB      ASP  59  -6.327   3.525   3.997
  684    HB3  ASP  59           1HB      ASP  59  -5.576   5.067   4.396
  685    H    ILE  60           H        ILE  60  -2.706   4.155   1.951
  686    HA   ILE  60           HA       ILE  60  -2.211   7.051   1.982
  687    HB   ILE  60           HB       ILE  60  -0.042   5.246   2.943
  688   HG12  ILE  60          2HG1      ILE  60  -1.966   6.344   4.960
  689   HG13  ILE  60          1HG1      ILE  60  -2.303   4.791   4.200
  690   HG21  ILE  60          1HG2      ILE  60   0.409   7.272   4.368
  691   HG22  ILE  60          2HG2      ILE  60   0.542   7.517   2.625
  692   HG23  ILE  60          3HG2      ILE  60  -0.890   8.079   3.488
  693   HD11  ILE  60          3HD1      ILE  60  -0.825   5.156   6.457
  694   HD12  ILE  60          1HD1      ILE  60  -0.755   3.739   5.407
  695   HD13  ILE  60          2HD1      ILE  60   0.420   5.040   5.215
  696    H    GLY  61           H        GLY  61  -0.834   7.778   0.409
  697    HA2  GLY  61           1HA      GLY  61  -0.222   5.995  -1.765
  698    HA3  GLY  61           2HA      GLY  61   0.201   7.699  -1.664
  699    H    THR  62           H        THR  62   1.045   4.621  -0.119
  700    HA   THR  62           HA       THR  62   3.781   5.566   0.291
  701    HB   THR  62           HB       THR  62   2.802   2.895   1.237
  702    HG1  THR  62           1HG      THR  62   1.260   3.843   2.331
  703   HG21  THR  62          3HG2      THR  62   5.173   3.871   1.541
  704   HG22  THR  62          1HG2      THR  62   4.378   3.157   2.944
  705   HG23  THR  62          2HG2      THR  62   4.429   4.910   2.756
  706    H    SER  63           H        SER  63   5.603   4.322  -0.392
  707    HA   SER  63           HA       SER  63   5.185   2.795  -2.814
  708    HB2  SER  63           2HB      SER  63   7.560   3.838  -1.318
  709    HB3  SER  63           1HB      SER  63   7.794   2.528  -2.473
  710    HG   SER  63           HG       SER  63   7.187   5.197  -2.903
  711    H    SER  64           H        SER  64   3.845   1.273  -1.433
  712    HA   SER  64           HA       SER  64   5.145  -0.534   0.329
  713    HB2  SER  64           2HB      SER  64   2.807  -1.722  -0.779
  714    HB3  SER  64           1HB      SER  64   2.996  -0.957   0.804
  715    HG   SER  64           HG       SER  64   1.689  -0.058  -1.389
  716    H    TYR  65           H        TYR  65   5.608  -2.733  -0.019
  717    HA   TYR  65           HA       TYR  65   6.065  -3.443  -2.840
  718    HB2  TYR  65           2HB      TYR  65   7.870  -4.175  -0.526
  719    HB3  TYR  65           1HB      TYR  65   8.149  -4.513  -2.231
  720    HD1  TYR  65           1HD      TYR  65   8.350  -2.439  -3.791
  721    HD2  TYR  65           2HD      TYR  65   8.769  -2.269   0.433
  722    HE1  TYR  65           1HE      TYR  65   9.588  -0.326  -4.007
  723    HE2  TYR  65           2HE      TYR  65  10.013  -0.159   0.233
  724    HH   TYR  65           HH       TYR  65  11.001   1.108  -2.888
  725    H    THR  66           H        THR  66   5.857  -5.619  -3.372
  726    HA   THR  66           HA       THR  66   4.523  -7.240  -1.319
  727    HB   THR  66           HB       THR  66   3.513  -6.394  -3.821
  728    HG1  THR  66           1HG      THR  66   2.715  -7.822  -1.604
  729   HG21  THR  66          3HG2      THR  66   4.389  -8.094  -5.123
  730   HG22  THR  66          1HG2      THR  66   2.839  -8.774  -4.629
  731   HG23  THR  66          2HG2      THR  66   4.321  -9.276  -3.815
  732    H    LYS  67           H        LYS  67   5.192  -9.297  -1.024
  733    HA   LYS  67           HA       LYS  67   6.924 -10.626  -2.910
  734    HB2  LYS  67           2HB      LYS  67   8.231  -9.020  -1.169
  735    HB3  LYS  67           1HB      LYS  67   8.125 -10.483  -0.201
  736    HG2  LYS  67           2HG      LYS  67   8.970 -11.308  -2.742
  737    HG3  LYS  67           1HG      LYS  67   9.895  -9.854  -2.362
  738    HD2  LYS  67           2HD      LYS  67  10.349 -10.921  -0.101
  739    HD3  LYS  67           1HD      LYS  67   9.720 -12.415  -0.798
  740    HE2  LYS  67           2HE      LYS  67  11.801 -10.954  -2.327
  741    HE3  LYS  67           1HE      LYS  67  12.308 -11.785  -0.857
  742    HZ1  LYS  67           3HZ      LYS  67  12.561 -13.275  -2.674
  743    HZ2  LYS  67           1HZ      LYS  67  10.985 -12.980  -3.232
  744    HZ3  LYS  67           2HZ      LYS  67  11.224 -13.813  -1.772
  745    H    SER  68           H        SER  68   6.638 -12.766  -2.786
  746    HA   SER  68           HA       SER  68   5.779 -14.772  -2.179
  747    HB2  SER  68           2HB      SER  68   6.209 -13.915   0.688
  748    HB3  SER  68           1HB      SER  68   6.278 -15.547   0.017
  749    HG   SER  68           HG       SER  68   8.022 -14.096  -1.335
  750    H    GLY  69           H        GLY  69   3.939 -12.680  -2.625
  751    HA2  GLY  69           1HA      GLY  69   1.659 -12.412  -2.540
  752    HA3  GLY  69           2HA      GLY  69   1.583 -13.889  -1.593
  753    H    MET  70           H        MET  70   3.611 -11.411  -0.358
  754    HA   MET  70           HA       MET  70   1.544 -10.766   1.642
  755    HB2  MET  70           2HB      MET  70   4.414 -11.365   1.844
  756    HB3  MET  70           1HB      MET  70   3.917  -9.949   2.760
  757    HG2  MET  70           2HG      MET  70   2.056 -11.461   3.687
  758    HG3  MET  70           1HG      MET  70   3.031 -12.790   3.066
  759    HE1  MET  70           3HE      MET  70   6.412 -12.220   4.917
  760    HE2  MET  70           1HE      MET  70   5.443 -13.606   4.412
  761    HE3  MET  70           2HE      MET  70   5.735 -12.276   3.291
  762    H    ILE  71           H        ILE  71   1.369  -8.615   2.379
  763    HA   ILE  71           HA       ILE  71   2.465  -6.613   0.513
  764    HB   ILE  71           HB       ILE  71   0.189  -5.571   1.900
  765   HG12  ILE  71          2HG1      ILE  71  -1.350  -7.246   0.411
  766   HG13  ILE  71          1HG1      ILE  71  -0.093  -8.359   0.946
  767   HG21  ILE  71          1HG2      ILE  71   0.263  -6.293  -1.004
  768   HG22  ILE  71          2HG2      ILE  71  -0.467  -4.889  -0.223
  769   HG23  ILE  71          3HG2      ILE  71   1.287  -5.011  -0.359
  770   HD11  ILE  71          3HD1      ILE  71  -0.637  -7.217   3.284
  771   HD12  ILE  71          1HD1      ILE  71  -2.199  -6.986   2.495
  772   HD13  ILE  71          2HD1      ILE  71  -1.529  -8.609   2.667
  773    H    LEU  72           H        LEU  72   3.960  -5.418   1.446
  774    HA   LEU  72           HA       LEU  72   3.758  -4.889   4.342
  775    HB2  LEU  72           2HB      LEU  72   5.946  -6.007   2.698
  776    HB3  LEU  72           1HB      LEU  72   6.427  -4.789   3.862
  777    HG   LEU  72           HG       LEU  72   5.369  -6.154   5.655
  778   HD11  LEU  72          1HD1      LEU  72   3.953  -7.411   3.829
  779   HD12  LEU  72          2HD1      LEU  72   5.336  -8.509   3.853
  780   HD13  LEU  72          3HD1      LEU  72   4.432  -8.195   5.336
  781   HD21  LEU  72          3HD2      LEU  72   7.522  -6.677   5.859
  782   HD22  LEU  72          1HD2      LEU  72   7.125  -8.171   5.012
  783   HD23  LEU  72          2HD2      LEU  72   7.744  -6.785   4.113
  784    H    CYS  73           H        CYS  73   4.479  -2.823   5.037
  785    HA   CYS  73           HA       CYS  73   4.387  -0.787   3.046
  786    HB2  CYS  73           2HB      CYS  73   4.664   0.812   4.821
  787    HB3  CYS  73           1HB      CYS  73   3.551  -0.430   5.364
  788    H    ARG  74           H        ARG  74   6.152   0.955   3.067
  789    HA   ARG  74           HA       ARG  74   8.170  -0.065   1.512
  790    HB2  ARG  74           2HB      ARG  74   7.295   2.358   1.835
  791    HB3  ARG  74           1HB      ARG  74   8.560   2.479   3.050
  792    HG2  ARG  74           2HG      ARG  74   9.922   1.445   0.935
  793    HG3  ARG  74           1HG      ARG  74   8.738   2.479   0.134
  794    HD2  ARG  74           2HD      ARG  74   9.891   4.291   0.692
  795    HD3  ARG  74           1HD      ARG  74   9.814   3.850   2.398
  796    HE   ARG  74           HE       ARG  74  11.832   2.483   0.813
  797   HH11  ARG  74          2HH1      ARG  74  11.077   5.133   2.983
  798   HH12  ARG  74          1HH1      ARG  74  12.729   5.362   3.473
  799   HH21  ARG  74          2HH2      ARG  74  13.989   2.803   1.421
  800   HH22  ARG  74          1HH2      ARG  74  14.401   4.056   2.552
  801    H    ASN  75           H        ASN  75   8.488   1.065   4.875
  802    HA   ASN  75           HA       ASN  75  11.263   0.298   4.975
  803    HB2  ASN  75           2HB      ASN  75  10.378   2.259   6.201
  804    HB3  ASN  75           1HB      ASN  75   9.427   1.180   7.215
  805   HD21  ASN  75          1HD2      ASN  75  10.308   0.491   9.035
  806   HD22  ASN  75          2HD2      ASN  75  11.989   0.610   9.442
  807    H    ASP  76           H        ASP  76   8.252  -1.221   5.745
  808    HA   ASP  76           HA       ASP  76   9.350  -3.010   7.711
  809    HB2  ASP  76           2HB      ASP  76   6.715  -2.402   6.650
  810    HB3  ASP  76           1HB      ASP  76   6.962  -4.131   6.880
  811    H    TYR  77           H        TYR  77   8.861  -3.079   4.258
  812    HA   TYR  77           HA       TYR  77   9.096  -5.844   3.874
  813    HB2  TYR  77           2HB      TYR  77   8.534  -4.572   1.950
  814    HB3  TYR  77           1HB      TYR  77   9.943  -3.526   2.137
  815    HD1  TYR  77           2HD      TYR  77   9.421  -7.235   1.984
  816    HD2  TYR  77           1HD      TYR  77  11.498  -3.846   0.466
  817    HE1  TYR  77           2HE      TYR  77  10.732  -8.702   0.506
  818    HE2  TYR  77           1HE      TYR  77  12.820  -5.309  -1.002
  819    HH   TYR  77           HH       TYR  77  13.552  -7.724  -0.988
  820    H    ILE  78           H        ILE  78  11.580  -3.327   4.113
  821    HA   ILE  78           HA       ILE  78  13.797  -5.084   3.891
  822    HB   ILE  78           HB       ILE  78  14.017  -2.543   5.448
  823   HG12  ILE  78          2HG1      ILE  78  14.109  -2.333   2.484
  824   HG13  ILE  78          1HG1      ILE  78  12.514  -2.434   3.222
  825   HG21  ILE  78          1HG2      ILE  78  15.801  -3.290   3.208
  826   HG22  ILE  78          2HG2      ILE  78  16.182  -2.564   4.769
  827   HG23  ILE  78          3HG2      ILE  78  15.848  -4.291   4.659
  828   HD11  ILE  78          3HD1      ILE  78  12.690  -0.392   4.203
  829   HD12  ILE  78          1HD1      ILE  78  14.443  -0.493   4.358
  830   HD13  ILE  78          2HD1      ILE  78  13.717  -0.130   2.791
  831    H    ARG  79           H        ARG  79  11.745  -4.099   6.498
  832    HA   ARG  79           HA       ARG  79  13.326  -4.920   8.682
  833    HB2  ARG  79           2HB      ARG  79  10.645  -3.978   8.250
  834    HB3  ARG  79           1HB      ARG  79  10.598  -5.386   9.300
  835    HG2  ARG  79           2HG      ARG  79  10.740  -3.519  10.718
  836    HG3  ARG  79           1HG      ARG  79  12.347  -4.244  10.709
  837    HD2  ARG  79           2HD      ARG  79  11.992  -2.250   8.619
  838    HD3  ARG  79           1HD      ARG  79  11.756  -1.600  10.240
  839    HE   ARG  79           HE       ARG  79  13.992  -2.637  10.753
  840   HH11  ARG  79          2HH1      ARG  79  13.138  -1.510   7.541
  841   HH12  ARG  79          1HH1      ARG  79  14.793  -1.288   7.046
  842   HH21  ARG  79          2HH2      ARG  79  16.141  -2.368  10.111
  843   HH22  ARG  79          1HH2      ARG  79  16.511  -1.803   8.508
  844    H    LEU  80           H        LEU  80  10.923  -6.612   6.701
  845    HA   LEU  80           HA       LEU  80  11.275  -9.060   8.198
  846    HB2  LEU  80           2HB      LEU  80   9.455  -8.070   6.110
  847    HB3  LEU  80           1HB      LEU  80   9.853  -9.775   5.988
  848    HG   LEU  80           HG       LEU  80   9.203  -9.863   8.507
  849   HD11  LEU  80          1HD1      LEU  80   7.952  -8.194   9.412
  850   HD12  LEU  80          2HD1      LEU  80   8.998  -7.235   8.364
  851   HD13  LEU  80          3HD1      LEU  80   7.362  -7.635   7.847
  852   HD21  LEU  80          3HD2      LEU  80   7.772 -10.209   6.081
  853   HD22  LEU  80          1HD2      LEU  80   7.538 -11.029   7.625
  854   HD23  LEU  80          2HD2      LEU  80   6.669  -9.535   7.279
  855    H    PHE  81           H        PHE  81  11.769  -8.094   4.805
  856    HA   PHE  81           HA       PHE  81  13.528 -10.434   4.496
  857    HB2  PHE  81           2HB      PHE  81  12.014  -8.832   2.421
  858    HB3  PHE  81           1HB      PHE  81  13.118 -10.152   2.053
  859    HD1  PHE  81           2HD      PHE  81  12.537 -12.467   2.723
  860    HD2  PHE  81           1HD      PHE  81   9.798  -9.237   3.130
  861    HE1  PHE  81           2HE      PHE  81  10.680 -14.072   2.915
  862    HE2  PHE  81           1HE      PHE  81   7.937 -10.837   3.322
  863    HZ   PHE  81           HZ       PHE  81   8.378 -13.255   3.217
  864    H    GLY  82           H        GLY  82  13.492  -7.861   2.195
  865    HA2  GLY  82           1HA      GLY  82  15.101  -6.008   2.223
  866    HA3  GLY  82           2HA      GLY  82  16.223  -7.110   3.018
  Start of MODEL    8
    1    H    SER 641           1H       SER 641  47.892  28.445 -18.527
    2    HA   SER 641           HA       SER 641  48.373  26.716 -19.776
    3    HB2  SER 641           2HB      SER 641  49.855  25.039 -18.060
    4    HB3  SER 641           1HB      SER 641  50.480  26.314 -19.108
    5    HG   SER 641           HG       SER 641  50.238  26.253 -16.391
    6    H    LEU 642           H        LEU 642  45.882  26.312 -19.184
    7    HA   LEU 642           HA       LEU 642  45.720  23.426 -18.711
    8    HB2  LEU 642           2HB      LEU 642  44.906  25.229 -16.792
    9    HB3  LEU 642           1HB      LEU 642  43.417  24.892 -17.656
   10    HG   LEU 642           HG       LEU 642  44.936  22.480 -16.999
   11   HD11  LEU 642          1HD1      LEU 642  43.877  24.219 -14.780
   12   HD12  LEU 642          2HD1      LEU 642  44.347  22.527 -14.610
   13   HD13  LEU 642          3HD1      LEU 642  45.554  23.737 -15.037
   14   HD21  LEU 642          3HD2      LEU 642  42.737  22.242 -17.814
   15   HD22  LEU 642          1HD2      LEU 642  42.651  21.873 -16.091
   16   HD23  LEU 642          2HD2      LEU 642  42.106  23.441 -16.687
   17    H    GLN 643           H        GLN 643  44.551  22.435 -20.200
   18    HA   GLN 643           HA       GLN 643  42.429  23.806 -21.616
   19    HB2  GLN 643           2HB      GLN 643  44.839  24.133 -22.707
   20    HB3  GLN 643           1HB      GLN 643  44.491  22.538 -23.358
   21    HG2  GLN 643           2HG      GLN 643  42.393  24.606 -23.623
   22    HG3  GLN 643           1HG      GLN 643  43.839  24.775 -24.616
   23   HE21  GLN 643          1HE2      GLN 643  44.429  22.132 -25.128
   24   HE22  GLN 643          2HE2      GLN 643  43.167  21.455 -26.116
   25    H    ASN 644           H        ASN 644  40.965  22.406 -22.526
   26    HA   ASN 644           HA       ASN 644  39.824  20.492 -22.918
   27    HB2  ASN 644           2HB      ASN 644  42.489  19.992 -23.842
   28    HB3  ASN 644           1HB      ASN 644  41.851  18.511 -23.132
   29   HD21  ASN 644          1HD2      ASN 644  41.079  21.083 -25.421
   30   HD22  ASN 644          2HD2      ASN 644  40.142  20.095 -26.489
   31    H    ASN 645           H        ASN 645  39.607  21.015 -20.443
   32    HA   ASN 645           HA       ASN 645  40.608  19.007 -18.660
   33    HB2  ASN 645           2HB      ASN 645  39.828  21.396 -18.079
   34    HB3  ASN 645           1HB      ASN 645  38.196  20.740 -18.145
   35   HD21  ASN 645          1HD2      ASN 645  37.415  19.736 -16.399
   36   HD22  ASN 645          2HD2      ASN 645  38.341  19.318 -14.994
   37    H    GLN 646           H        GLN 646  40.025  17.052 -19.658
   38    HA   GLN 646           HA       GLN 646  37.219  16.447 -20.065
   39    HB2  GLN 646           2HB      GLN 646  39.225  15.616 -21.488
   40    HB3  GLN 646           1HB      GLN 646  39.449  14.435 -20.205
   41    HG2  GLN 646           2HG      GLN 646  36.696  14.559 -21.080
   42    HG3  GLN 646           1HG      GLN 646  37.793  14.207 -22.413
   43   HE21  GLN 646          1HE2      GLN 646  39.526  13.055 -20.043
   44   HE22  GLN 646          2HE2      GLN 646  38.922  11.441 -19.913
   45    H    ASP 647           H        ASP 647  35.972  15.839 -18.463
   46    HA   ASP 647           HA       ASP 647  37.132  14.698 -16.033
   47    HB2  ASP 647           2HB      ASP 647  35.278  16.592 -16.235
   48    HB3  ASP 647           1HB      ASP 647  34.205  15.202 -16.342
   49    H    VAL 648           H        VAL 648  36.059  12.808 -15.053
   50    HA   VAL 648           HA       VAL 648  35.195  10.940 -17.162
   51    HB   VAL 648           HB       VAL 648  37.299  10.176 -16.369
   52   HG11  VAL 648          1HG1      VAL 648  37.325  11.529 -14.289
   53   HG12  VAL 648          2HG1      VAL 648  36.283  10.319 -13.541
   54   HG13  VAL 648          3HG1      VAL 648  37.905   9.876 -14.074
   55   HG21  VAL 648          3HG2      VAL 648  36.090   8.258 -14.670
   56   HG22  VAL 648          1HG2      VAL 648  34.925   8.677 -15.926
   57   HG23  VAL 648          2HG2      VAL 648  36.530   8.095 -16.371
   58    H    SER 649           H        SER 649  33.200  10.239 -17.038
   59    HA   SER 649           HA       SER 649  31.534  10.848 -14.789
   60    HB2  SER 649           2HB      SER 649  30.426   8.998 -16.762
   61    HB3  SER 649           1HB      SER 649  29.864  10.604 -16.291
   62    HG   SER 649           HG       SER 649  31.310  11.523 -17.720
   63    H    PHE 650           H        PHE 650  32.353   9.677 -13.055
   64    HA   PHE 650           HA       PHE 650  33.011   6.927 -13.156
   65    HB2  PHE 650           2HB      PHE 650  33.338   8.977 -11.341
   66    HB3  PHE 650           1HB      PHE 650  32.190   7.914 -10.532
   67    HD1  PHE 650           1HD      PHE 650  35.553   8.092 -12.035
   68    HD2  PHE 650           2HD      PHE 650  32.862   5.830  -9.637
   69    HE1  PHE 650           1HE      PHE 650  37.399   6.607 -11.365
   70    HE2  PHE 650           2HE      PHE 650  34.702   4.343  -8.968
   71    HZ   PHE 650           HZ       PHE 650  36.973   4.732  -9.828
   72    H    GLU 651           H        GLU 651  30.021   8.585 -12.838
   73    HA   GLU 651           HA       GLU 651  28.587   6.457 -11.568
   74    HB2  GLU 651           2HB      GLU 651  27.658   8.909 -13.072
   75    HB3  GLU 651           1HB      GLU 651  26.568   7.778 -12.280
   76    HG2  GLU 651           2HG      GLU 651  26.869   9.614 -10.817
   77    HG3  GLU 651           1HG      GLU 651  27.762   8.256 -10.134
   78    H    ASN 652           H        ASN 652  29.679   7.037 -14.735
   79    HA   ASN 652           HA       ASN 652  27.646   5.699 -16.205
   80    HB2  ASN 652           2HB      ASN 652  29.868   7.170 -16.872
   81    HB3  ASN 652           1HB      ASN 652  30.359   5.541 -17.321
   82   HD21  ASN 652          1HD2      ASN 652  29.775   4.839 -19.245
   83   HD22  ASN 652          2HD2      ASN 652  28.530   5.522 -20.234
   84    H    ILE 653           H        ILE 653  30.422   4.648 -14.409
   85    HA   ILE 653           HA       ILE 653  29.962   1.881 -15.302
   86    HB   ILE 653           HB       ILE 653  32.204   1.440 -14.184
   87   HG12  ILE 653          2HG1      ILE 653  33.350   3.984 -14.536
   88   HG13  ILE 653          1HG1      ILE 653  31.884   4.258 -13.599
   89   HG21  ILE 653          1HG2      ILE 653  32.251   1.370 -16.486
   90   HG22  ILE 653          2HG2      ILE 653  31.767   3.057 -16.648
   91   HG23  ILE 653          3HG2      ILE 653  33.412   2.657 -16.152
   92   HD11  ILE 653          3HD1      ILE 653  32.798   3.414 -11.764
   93   HD12  ILE 653          1HD1      ILE 653  33.412   2.000 -12.618
   94   HD13  ILE 653          2HD1      ILE 653  34.339   3.500 -12.616
   95    H    GLN 654           H        GLN 654  28.626   3.648 -13.244
   96    HA   GLN 654           HA       GLN 654  28.801   1.762 -10.988
   97    HB2  GLN 654           2HB      GLN 654  29.115   4.646 -11.037
   98    HB3  GLN 654           1HB      GLN 654  27.832   4.152  -9.941
   99    HG2  GLN 654           2HG      GLN 654  29.386   2.682  -8.788
  100    HG3  GLN 654           1HG      GLN 654  30.657   3.145  -9.919
  101   HE21  GLN 654          1HE2      GLN 654  30.938   5.586 -10.083
  102   HE22  GLN 654          2HE2      GLN 654  30.992   6.450  -8.581
  103    H    TRP 655           H        TRP 655  27.077   1.664 -13.269
  104    HA   TRP 655           HA       TRP 655  24.488   2.597 -12.504
  105    HB2  TRP 655           2HB      TRP 655  23.726   1.082 -14.403
  106    HB3  TRP 655           1HB      TRP 655  24.817   2.388 -14.842
  107    HD1  TRP 655           HD       TRP 655  27.553   1.504 -14.984
  108    HE1  TRP 655           1HE      TRP 655  28.410  -0.639 -16.125
  109    HE3  TRP 655           3HE      TRP 655  23.196  -1.171 -15.060
  110    HZ2  TRP 655           2HZ      TRP 655  27.375  -3.123 -16.949
  111    HZ3  TRP 655           3HZ      TRP 655  23.219  -3.425 -16.047
  112    HH2  TRP 655           HH       TRP 655  25.264  -4.380 -16.972
  113    H    SER 656           H        SER 656  22.823   1.451 -11.604
  114    HA   SER 656           HA       SER 656  23.558  -0.567  -9.764
  115    HB2  SER 656           2HB      SER 656  20.708  -0.369 -10.183
  116    HB3  SER 656           1HB      SER 656  21.666   0.114  -8.782
  117    HG   SER 656           HG       SER 656  20.458   1.705 -10.464
  118    H    ILE 657           H        ILE 657  23.703  -2.687 -10.057
  119    HA   ILE 657           HA       ILE 657  22.145  -3.905 -12.246
  120    HB   ILE 657           HB       ILE 657  24.506  -5.431 -11.464
  121   HG12  ILE 657          2HG1      ILE 657  25.633  -3.538 -13.215
  122   HG13  ILE 657          1HG1      ILE 657  24.855  -2.601 -11.942
  123   HG21  ILE 657          1HG2      ILE 657  24.497  -6.061 -13.642
  124   HG22  ILE 657          2HG2      ILE 657  22.825  -5.519 -13.507
  125   HG23  ILE 657          3HG2      ILE 657  24.039  -4.461 -14.226
  126   HD11  ILE 657          3HD1      ILE 657  26.150  -4.515 -10.509
  127   HD12  ILE 657          1HD1      ILE 657  27.251  -4.263 -11.865
  128   HD13  ILE 657          2HD1      ILE 657  26.772  -2.901 -10.851
  129    H    ASP 658           H        ASP 658  22.513  -3.735  -8.986
  130    HA   ASP 658           HA       ASP 658  22.177  -6.531  -8.365
  131    HB2  ASP 658           2HB      ASP 658  23.351  -5.205  -6.745
  132    HB3  ASP 658           1HB      ASP 658  22.025  -4.053  -6.646
  133    HA   PRO 659           HA       PRO 659  17.763  -6.290  -9.028
  134    HB2  PRO 659           2HB      PRO 659  17.704  -9.131  -8.462
  135    HB3  PRO 659           1HB      PRO 659  17.463  -8.309 -10.005
  136    HG2  PRO 659           2HG      PRO 659  19.632  -9.872  -9.451
  137    HG3  PRO 659           1HG      PRO 659  19.657  -8.532 -10.610
  138    HD2  PRO 659           2HD      PRO 659  20.643  -8.611  -7.784
  139    HD3  PRO 659           1HD      PRO 659  21.370  -7.845  -9.213
  140    H    GLY 660           H        GLY 660  19.474  -7.002  -6.223
  141    HA2  GLY 660           1HA      GLY 660  17.258  -7.867  -4.599
  142    HA3  GLY 660           2HA      GLY 660  18.861  -7.426  -4.032
  143    H    ALA 661           H        ALA 661  19.170  -4.882  -4.831
  144    HA   ALA 661           HA       ALA 661  17.435  -3.457  -3.039
  145    HB1  ALA 661           1HB      ALA 661  19.536  -2.361  -4.908
  146    HB2  ALA 661           2HB      ALA 661  18.813  -1.532  -3.528
  147    HB3  ALA 661           3HB      ALA 661  19.839  -2.942  -3.271
  148    H    ASP 662           H        ASP 662  17.135  -4.359  -6.237
  149    HA   ASP 662           HA       ASP 662  15.588  -2.013  -7.012
  150    HB2  ASP 662           2HB      ASP 662  17.233  -3.304  -8.559
  151    HB3  ASP 662           1HB      ASP 662  15.915  -4.464  -8.715
  152    H    LEU 663           H        LEU 663  13.871  -2.264  -5.542
  153    HA   LEU 663           HA       LEU 663  12.162  -4.602  -5.966
  154    HB2  LEU 663           2HB      LEU 663  11.096  -2.806  -4.009
  155    HB3  LEU 663           1HB      LEU 663  11.633  -4.462  -3.813
  156    HG   LEU 663           HG       LEU 663  13.795  -2.465  -3.903
  157   HD11  LEU 663          1HD1      LEU 663  12.303  -1.115  -2.662
  158   HD12  LEU 663          2HD1      LEU 663  11.729  -2.492  -1.718
  159   HD13  LEU 663          3HD1      LEU 663  13.370  -1.885  -1.485
  160   HD21  LEU 663          3HD2      LEU 663  13.993  -3.987  -1.615
  161   HD22  LEU 663          1HD2      LEU 663  13.196  -5.071  -2.756
  162   HD23  LEU 663          2HD2      LEU 663  14.749  -4.345  -3.170
  163    H    SER 664           H        SER 664  12.496  -2.320  -7.837
  164    HA   SER 664           HA       SER 664  10.221  -0.661  -7.738
  165    HB2  SER 664           2HB      SER 664  11.407  -1.270 -10.386
  166    HB3  SER 664           1HB      SER 664  11.088   0.290  -9.619
  167    HG   SER 664           HG       SER 664  13.342  -1.353  -9.487
  168    H    GLN 665           H        GLN 665  10.791  -3.832  -9.125
  169    HA   GLN 665           HA       GLN 665   8.185  -3.902 -10.407
  170    HB2  GLN 665           2HB      GLN 665  10.098  -6.208 -10.015
  171    HB3  GLN 665           1HB      GLN 665   8.769  -6.110 -11.159
  172    HG2  GLN 665           2HG      GLN 665  10.603  -5.749 -12.495
  173    HG3  GLN 665           1HG      GLN 665  10.074  -4.105 -12.137
  174   HE21  GLN 665          1HE2      GLN 665  11.688  -2.811 -11.769
  175   HE22  GLN 665          2HE2      GLN 665  13.162  -3.203 -10.925
  176    H    TYR 666           H        TYR 666   9.393  -4.333  -7.335
  177    HA   TYR 666           HA       TYR 666   7.516  -6.419  -6.549
  178    HB2  TYR 666           2HB      TYR 666   9.737  -4.967  -5.123
  179    HB3  TYR 666           1HB      TYR 666   8.576  -5.956  -4.244
  180    HD1  TYR 666           2HD      TYR 666   8.216  -8.287  -5.935
  181    HD2  TYR 666           1HD      TYR 666  11.754  -6.074  -5.112
  182    HE1  TYR 666           2HE      TYR 666   9.571 -10.286  -6.402
  183    HE2  TYR 666           1HE      TYR 666  13.117  -8.062  -5.578
  184    HH   TYR 666           HH       TYR 666  13.065 -10.130  -6.606
  185    H    LYS 667           H        LYS 667   7.442  -3.147  -6.985
  186    HA   LYS 667           HA       LYS 667   5.877  -2.427  -4.688
  187    HB2  LYS 667           2HB      LYS 667   6.191  -0.293  -5.356
  188    HB3  LYS 667           1HB      LYS 667   7.406  -0.992  -6.411
  189    HG2  LYS 667           2HG      LYS 667   6.266  -0.472  -8.259
  190    HG3  LYS 667           1HG      LYS 667   4.720  -0.960  -7.564
  191    HD2  LYS 667           2HD      LYS 667   4.184   1.159  -7.130
  192    HD3  LYS 667           1HD      LYS 667   5.694   1.407  -6.252
  193    HE2  LYS 667           2HE      LYS 667   5.817   1.354  -9.215
  194    HE3  LYS 667           1HE      LYS 667   5.087   2.764  -8.453
  195    HZ1  LYS 667           3HZ      LYS 667   7.225   3.439  -8.444
  196    HZ2  LYS 667           1HZ      LYS 667   7.854   1.867  -8.431
  197    HZ3  LYS 667           2HZ      LYS 667   7.277   2.559  -6.992
  198    H    MET 668           H        MET 668   3.680  -1.922  -4.659
  199    HA   MET 668           HA       MET 668   2.142  -3.383  -6.681
  200    HB2  MET 668           2HB      MET 668   0.353  -3.492  -5.068
  201    HB3  MET 668           1HB      MET 668   1.843  -4.032  -4.306
  202    HG2  MET 668           2HG      MET 668   2.070  -1.939  -3.149
  203    HG3  MET 668           1HG      MET 668   0.697  -1.261  -4.022
  204    HE1  MET 668           3HE      MET 668   1.604  -4.523  -2.331
  205    HE2  MET 668           1HE      MET 668   1.643  -3.614  -0.821
  206    HE3  MET 668           2HE      MET 668   0.356  -4.787  -1.112
  207    H    ASP 669           H        ASP 669   0.323  -2.490  -7.657
  208    HA   ASP 669           HA       ASP 669   0.277   0.441  -7.719
  209    HB2  ASP 669           2HB      ASP 669   0.445  -0.402  -9.915
  210    HB3  ASP 669           1HB      ASP 669  -0.698  -1.700  -9.598
  211    H    VAL 670           H        VAL 670  -1.039   1.263  -6.241
  212    HA   VAL 670           HA       VAL 670  -3.366  -0.197  -5.330
  213    HB   VAL 670           HB       VAL 670  -2.565   2.589  -4.497
  214   HG11  VAL 670          1HG1      VAL 670  -4.056   0.430  -3.007
  215   HG12  VAL 670          2HG1      VAL 670  -3.770   2.085  -2.469
  216   HG13  VAL 670          3HG1      VAL 670  -4.817   1.777  -3.854
  217   HG21  VAL 670          3HG2      VAL 670  -1.764   0.359  -2.758
  218   HG22  VAL 670          1HG2      VAL 670  -0.869   0.475  -4.273
  219   HG23  VAL 670          2HG2      VAL 670  -0.909   1.846  -3.164
  220    H    THR 671           H        THR 671  -4.797  -0.204  -7.023
  221    HA   THR 671           HA       THR 671  -5.734   2.373  -8.046
  222    HB   THR 671           HB       THR 671  -6.842  -0.303  -8.869
  223    HG1  THR 671           1HG      THR 671  -4.290   0.574  -9.217
  224   HG21  THR 671          3HG2      THR 671  -7.955   1.814  -9.571
  225   HG22  THR 671          1HG2      THR 671  -7.366   0.849 -10.923
  226   HG23  THR 671          2HG2      THR 671  -6.469   2.275 -10.400
  227    H    VAL 672           H        VAL 672  -7.466   3.346  -7.188
  228    HA   VAL 672           HA       VAL 672  -9.162   1.838  -5.366
  229    HB   VAL 672           HB       VAL 672  -8.328   4.122  -4.765
  230   HG11  VAL 672          1HG1      VAL 672 -10.406   5.520  -6.252
  231   HG12  VAL 672          2HG1      VAL 672  -8.725   5.960  -5.958
  232   HG13  VAL 672          3HG1      VAL 672  -9.129   4.859  -7.275
  233   HG21  VAL 672          3HG2      VAL 672 -11.220   4.519  -4.710
  234   HG22  VAL 672          1HG2      VAL 672 -10.705   2.917  -4.182
  235   HG23  VAL 672          2HG2      VAL 672 -10.066   4.356  -3.388
  236    H    ILE 673           H        ILE 673 -11.170   1.165  -5.804
  237    HA   ILE 673           HA       ILE 673 -12.072   1.447  -8.564
  238    HB   ILE 673           HB       ILE 673 -12.801  -0.435  -6.332
  239   HG12  ILE 673          2HG1      ILE 673 -12.352  -1.945  -8.531
  240   HG13  ILE 673          1HG1      ILE 673 -11.343  -0.552  -8.907
  241   HG21  ILE 673          1HG2      ILE 673 -14.160  -0.808  -8.924
  242   HG22  ILE 673          2HG2      ILE 673 -14.731  -1.122  -7.284
  243   HG23  ILE 673          3HG2      ILE 673 -14.749   0.522  -7.925
  244   HD11  ILE 673          3HD1      ILE 673 -11.125  -1.833  -6.228
  245   HD12  ILE 673          1HD1      ILE 673 -10.360  -2.590  -7.625
  246   HD13  ILE 673          2HD1      ILE 673  -9.913  -0.950  -7.158
  247    H    ASP 674           H        ASP 674 -13.840   2.531  -9.185
  248    HA   ASP 674           HA       ASP 674 -15.121   4.211  -7.168
  249    HB2  ASP 674           2HB      ASP 674 -14.256   5.439  -9.022
  250    HB3  ASP 674           1HB      ASP 674 -14.990   4.337 -10.181
  251    H    THR 675           H        THR 675 -17.112   3.873  -6.478
  252    HA   THR 675           HA       THR 675 -18.959   2.394  -8.221
  253    HB   THR 675           HB       THR 675 -18.640   0.967  -6.340
  254    HG1  THR 675           1HG      THR 675 -20.865   1.921  -5.177
  255   HG21  THR 675          3HG2      THR 675 -18.862   3.474  -4.697
  256   HG22  THR 675          1HG2      THR 675 -17.565   2.280  -4.722
  257   HG23  THR 675          2HG2      THR 675 -19.118   1.878  -3.990
  258    H    LYS 676           H        LYS 676 -20.645   3.543  -8.892
  259    HA   LYS 676           HA       LYS 676 -21.216   6.083  -7.534
  260    HB2  LYS 676           2HB      LYS 676 -20.875   5.468 -10.231
  261    HB3  LYS 676           1HB      LYS 676 -22.614   5.691 -10.044
  262    HG2  LYS 676           2HG      LYS 676 -22.154   7.859 -10.315
  263    HG3  LYS 676           1HG      LYS 676 -21.648   7.781  -8.625
  264    HD2  LYS 676           2HD      LYS 676 -19.892   8.852  -9.837
  265    HD3  LYS 676           1HD      LYS 676 -19.339   7.224  -9.439
  266    HE2  LYS 676           2HE      LYS 676 -20.519   6.822 -11.859
  267    HE3  LYS 676           1HE      LYS 676 -19.878   8.454 -12.049
  268    HZ1  LYS 676           3HZ      LYS 676 -18.370   6.535 -12.688
  269    HZ2  LYS 676           1HZ      LYS 676 -18.203   6.234 -11.024
  270    HZ3  LYS 676           2HZ      LYS 676 -17.707   7.722 -11.670
  271    H    ASP 677           H        ASP 677 -22.122   3.156  -7.188
  272    HA   ASP 677           HA       ASP 677 -25.006   3.569  -7.144
  273    HB2  ASP 677           2HB      ASP 677 -24.879   1.515  -8.091
  274    HB3  ASP 677           1HB      ASP 677 -23.253   1.227  -7.489
  275    H    GLY 678           H        GLY 678 -26.029   3.828  -5.312
  276    HA2  GLY 678           1HA      GLY 678 -26.421   3.575  -2.982
  277    HA3  GLY 678           2HA      GLY 678 -24.722   3.172  -2.771
  278    H    SER 679           H        SER 679 -24.200   5.570  -4.641
  279    HA   SER 679           HA       SER 679 -24.030   7.519  -2.489
  280    HB2  SER 679           2HB      SER 679 -22.928   8.500  -4.931
  281    HB3  SER 679           1HB      SER 679 -22.073   7.979  -3.477
  282    HG   SER 679           HG       SER 679 -21.345   6.605  -4.988
  283    H    GLN 680           H        GLN 680 -26.084   6.811  -5.062
  284    HA   GLN 680           HA       GLN 680 -27.197   9.531  -5.025
  285    HB2  GLN 680           2HB      GLN 680 -25.909   8.270  -7.226
  286    HB3  GLN 680           1HB      GLN 680 -27.625   8.363  -7.598
  287    HG2  GLN 680           2HG      GLN 680 -27.128  10.403  -8.350
  288    HG3  GLN 680           1HG      GLN 680 -27.171  10.858  -6.649
  289   HE21  GLN 680          1HE2      GLN 680 -24.654   8.831  -7.899
  290   HE22  GLN 680          2HE2      GLN 680 -23.381   9.999  -7.802
  291    H    SER 681           H        SER 681 -27.977   7.036  -3.666
  292    HA   SER 681           HA       SER 681 -30.139   5.810  -5.025
  293    HB2  SER 681           2HB      SER 681 -30.242   5.731  -2.090
  294    HB3  SER 681           1HB      SER 681 -30.176   4.407  -3.254
  295    HG   SER 681           HG       SER 681 -28.222   4.232  -2.465
  296    H    LYS 682           H        LYS 682 -29.890   8.682  -3.073
  297    HA   LYS 682           HA       LYS 682 -32.741   8.840  -2.601
  298    HB2  LYS 682           2HB      LYS 682 -30.374  10.186  -1.630
  299    HB3  LYS 682           1HB      LYS 682 -31.603  11.352  -2.098
  300    HG2  LYS 682           2HG      LYS 682 -32.317  11.036   0.002
  301    HG3  LYS 682           1HG      LYS 682 -33.111   9.622  -0.698
  302    HD2  LYS 682           2HD      LYS 682 -31.409   8.169   0.054
  303    HD3  LYS 682           1HD      LYS 682 -30.324   9.510   0.431
  304    HE2  LYS 682           2HE      LYS 682 -31.203   9.773   2.463
  305    HE3  LYS 682           1HE      LYS 682 -32.849   9.700   1.840
  306    HZ1  LYS 682           3HZ      LYS 682 -32.990   7.467   2.191
  307    HZ2  LYS 682           1HZ      LYS 682 -31.923   7.870   3.448
  308    HZ3  LYS 682           2HZ      LYS 682 -31.323   7.204   2.009
  309    H    LEU 683           H        LEU 683 -30.550   9.719  -5.046
  310    HA   LEU 683           HA       LEU 683 -32.274  11.778  -6.165
  311    HB2  LEU 683           2HB      LEU 683 -29.547  10.738  -6.738
  312    HB3  LEU 683           1HB      LEU 683 -30.436  11.444  -8.074
  313    HG   LEU 683           HG       LEU 683 -30.771  13.367  -6.193
  314   HD11  LEU 683          1HD1      LEU 683 -28.235  13.579  -5.440
  315   HD12  LEU 683          2HD1      LEU 683 -29.442  12.743  -4.463
  316   HD13  LEU 683          3HD1      LEU 683 -28.345  11.819  -5.489
  317   HD21  LEU 683          3HD2      LEU 683 -29.974  13.547  -8.560
  318   HD22  LEU 683          1HD2      LEU 683 -29.179  14.639  -7.428
  319   HD23  LEU 683          2HD2      LEU 683 -28.350  13.182  -7.975
  320    H    GLY 684           H        GLY 684 -31.115   8.524  -6.966
  321    HA2  GLY 684           1HA      GLY 684 -32.756   6.935  -7.814
  322    HA3  GLY 684           2HA      GLY 684 -33.473   8.258  -8.723
  323    H    GLY 685           H        GLY 685 -31.729   5.550  -9.066
  324    HA2  GLY 685           1HA      GLY 685 -29.787   6.490 -11.010
  325    HA3  GLY 685           2HA      GLY 685 -30.094   4.818 -10.560
  326    H    GLY 901           H        GLY 901 -31.834   7.507 -12.101
  327    HA2  GLY 901           1HA      GLY 901 -33.116   5.553 -13.886
  328    HA3  GLY 901           2HA      GLY 901 -33.696   7.180 -13.564
  329    H    GLY 902           H        GLY 902 -32.787   5.507 -16.021
  330    HA2  GLY 902           1HA      GLY 902 -32.276   6.385 -18.136
  331    HA3  GLY 902           2HA      GLY 902 -31.569   7.795 -17.360
  332    H    SER 903           H        SER 903 -30.100   5.856 -15.538
  333    HA   SER 903           HA       SER 903 -27.707   5.756 -17.104
  334    HB2  SER 903           2HB      SER 903 -27.677   4.365 -14.523
  335    HB3  SER 903           1HB      SER 903 -26.679   5.704 -15.096
  336    HG   SER 903           HG       SER 903 -28.176   7.135 -14.414
  337    H    GLY 904           H        GLY 904 -28.633   4.263 -18.738
  338    HA2  GLY 904           1HA      GLY 904 -29.225   1.558 -18.061
  339    HA3  GLY 904           2HA      GLY 904 -28.916   2.177 -19.677
  340    H    GLY 905           H        GLY 905 -26.281   3.264 -18.764
  341    HA2  GLY 905           1HA      GLY 905 -24.813   0.763 -19.161
  342    HA3  GLY 905           2HA      GLY 905 -24.179   2.388 -19.382
  343    H    HIS 906           H        HIS 906 -25.976   1.865 -16.526
  344    HA   HIS 906           HA       HIS 906 -23.475   1.621 -14.997
  345    HB2  HIS 906           2HB      HIS 906 -25.435   3.697 -14.917
  346    HB3  HIS 906           1HB      HIS 906 -25.472   2.838 -13.380
  347    HD1  HIS 906           1HD      HIS 906 -23.131   4.844 -15.569
  348    HD2  HIS 906           2HD      HIS 906 -23.335   3.268 -11.728
  349    HE1  HIS 906           1HE      HIS 906 -21.182   5.825 -14.292
  350    H    MET 907           H        MET 907 -23.372   0.035 -13.561
  351    HA   MET 907           HA       MET 907 -25.777  -1.590 -13.128
  352    HB2  MET 907           2HB      MET 907 -22.874  -2.163 -13.255
  353    HB3  MET 907           1HB      MET 907 -23.783  -3.069 -12.053
  354    HG2  MET 907           2HG      MET 907 -24.554  -4.438 -13.601
  355    HG3  MET 907           1HG      MET 907 -25.215  -3.088 -14.520
  356    HE1  MET 907           3HE      MET 907 -24.733  -4.943 -16.581
  357    HE2  MET 907           1HE      MET 907 -23.101  -5.484 -16.980
  358    HE3  MET 907           2HE      MET 907 -23.860  -6.000 -15.473
  359    H    GLY 908           H        GLY 908 -26.378  -2.234 -11.034
  360    HA2  GLY 908           1HA      GLY 908 -25.392  -0.416  -8.941
  361    HA3  GLY 908           2HA      GLY 908 -26.954  -1.225  -8.934
  362    H    SER 909           H        SER 909 -26.246  -1.782  -6.714
  363    HA   SER 909           HA       SER 909 -24.160  -3.687  -6.340
  364    HB2  SER 909           2HB      SER 909 -26.102  -3.891  -4.258
  365    HB3  SER 909           1HB      SER 909 -24.535  -3.081  -4.207
  366    HG   SER 909           HG       SER 909 -25.532  -1.198  -5.000
  367    H    GLY 910           H        GLY 910 -24.410  -5.446  -7.670
  368    HA2  GLY 910           1HA      GLY 910 -26.943  -6.770  -7.993
  369    HA3  GLY 910           2HA      GLY 910 -25.395  -7.301  -8.636
  370    H    GLY 911           H        GLY 911 -27.185  -7.047  -5.577
  371    HA2  GLY 911           1HA      GLY 911 -27.642  -9.237  -4.494
  372    HA3  GLY 911           2HA      GLY 911 -25.949  -9.611  -4.784
  373    H    LEU  18           H        LEU  18 -26.115 -10.020  -2.399
  374    HA   LEU  18           HA       LEU  18 -25.785  -7.507  -0.891
  375    HB2  LEU  18           2HB      LEU  18 -27.197  -9.978  -0.323
  376    HB3  LEU  18           1HB      LEU  18 -26.032  -9.611   0.934
  377    HG   LEU  18           HG       LEU  18 -28.193  -8.715   1.542
  378   HD11  LEU  18          1HD1      LEU  18 -27.590  -6.289   1.736
  379   HD12  LEU  18          2HD1      LEU  18 -26.372  -7.420   2.327
  380   HD13  LEU  18          3HD1      LEU  18 -26.162  -6.641   0.760
  381   HD21  LEU  18          3HD2      LEU  18 -28.091  -6.971  -0.906
  382   HD22  LEU  18          1HD2      LEU  18 -28.970  -8.500  -0.853
  383   HD23  LEU  18          2HD2      LEU  18 -29.421  -7.186   0.233
  384    H    SER  19           H        SER  19 -23.989  -9.711  -2.403
  385    HA   SER  19           HA       SER  19 -22.054 -10.175  -0.281
  386    HB2  SER  19           2HB      SER  19 -21.081 -11.096  -2.791
  387    HB3  SER  19           1HB      SER  19 -21.678 -12.060  -1.441
  388    HG   SER  19           HG       SER  19 -23.813 -11.758  -2.305
  389    H    TRP  20           H        TRP  20 -22.466  -8.354  -3.232
  390    HA   TRP  20           HA       TRP  20 -21.297  -6.686  -4.222
  391    HB2  TRP  20           2HB      TRP  20 -19.852  -6.218  -1.627
  392    HB3  TRP  20           1HB      TRP  20 -20.287  -5.044  -2.865
  393    HD1  TRP  20           HD       TRP  20 -23.364  -5.513  -3.129
  394    HE1  TRP  20           1HE      TRP  20 -24.947  -4.958  -1.179
  395    HE3  TRP  20           3HE      TRP  20 -20.003  -5.653   0.719
  396    HZ2  TRP  20           2HZ      TRP  20 -24.797  -4.623   1.615
  397    HZ3  TRP  20           3HZ      TRP  20 -20.805  -5.201   3.000
  398    HH2  TRP  20           HH       TRP  20 -23.155  -4.698   3.437
  399    H    LYS  21           H        LYS  21 -18.566  -6.812  -2.202
  400    HA   LYS  21           HA       LYS  21 -17.178  -8.644  -3.997
  401    HB2  LYS  21           2HB      LYS  21 -16.854  -5.904  -4.139
  402    HB3  LYS  21           1HB      LYS  21 -15.517  -6.406  -3.112
  403    HG2  LYS  21           2HG      LYS  21 -15.062  -6.286  -5.595
  404    HG3  LYS  21           1HG      LYS  21 -14.614  -7.781  -4.772
  405    HD2  LYS  21           2HD      LYS  21 -16.295  -8.994  -5.760
  406    HD3  LYS  21           1HD      LYS  21 -17.318  -7.577  -6.000
  407    HE2  LYS  21           2HE      LYS  21 -14.811  -7.445  -7.476
  408    HE3  LYS  21           1HE      LYS  21 -15.798  -8.834  -7.923
  409    HZ1  LYS  21           3HZ      LYS  21 -17.664  -6.993  -7.964
  410    HZ2  LYS  21           1HZ      LYS  21 -16.663  -7.279  -9.304
  411    HZ3  LYS  21           2HZ      LYS  21 -16.335  -5.979  -8.267
  412    H    ARG  22           H        ARG  22 -15.897 -10.047  -2.963
  413    HA   ARG  22           HA       ARG  22 -15.661  -9.764  -0.059
  414    HB2  ARG  22           2HB      ARG  22 -15.415 -12.088  -1.949
  415    HB3  ARG  22           1HB      ARG  22 -14.790 -12.186  -0.308
  416    HG2  ARG  22           2HG      ARG  22 -17.260 -11.278   0.215
  417    HG3  ARG  22           1HG      ARG  22 -17.573 -12.164  -1.278
  418    HD2  ARG  22           2HD      ARG  22 -16.188 -13.293   1.150
  419    HD3  ARG  22           1HD      ARG  22 -17.884 -13.548   0.740
  420    HE   ARG  22           HE       ARG  22 -15.566 -14.761  -0.518
  421   HH11  ARG  22          2HH1      ARG  22 -19.028 -14.175  -0.647
  422   HH12  ARG  22          1HH1      ARG  22 -19.320 -15.431  -1.822
  423   HH21  ARG  22          2HH2      ARG  22 -15.956 -16.418  -2.042
  424   HH22  ARG  22          1HH2      ARG  22 -17.575 -16.710  -2.603
  425    H    CYS  23           H        CYS  23 -13.773  -9.372   0.931
  426    HA   CYS  23           HA       CYS  23 -11.526  -8.695  -0.743
  427    HB2  CYS  23           2HB      CYS  23 -10.551  -7.914   1.440
  428    HB3  CYS  23           1HB      CYS  23 -12.040  -7.124   0.938
  429    H    ALA  24           H        ALA  24  -9.359  -9.354  -0.281
  430    HA   ALA  24           HA       ALA  24  -9.183 -12.200   0.104
  431    HB1  ALA  24           1HB      ALA  24  -7.605 -10.175  -1.144
  432    HB2  ALA  24           2HB      ALA  24  -6.596 -11.115  -0.043
  433    HB3  ALA  24           3HB      ALA  24  -7.507 -11.929  -1.315
  434    H    GLY  25           H        GLY  25  -9.007  -9.532   2.180
  435    HA2  GLY  25           1HA      GLY  25  -7.148 -10.774   4.045
  436    HA3  GLY  25           2HA      GLY  25  -7.954  -9.225   4.246
  437    H    CYS  26           H        CYS  26  -9.963  -9.127   5.237
  438    HA   CYS  26           HA       CYS  26 -10.704 -10.908   7.173
  439    HB2  CYS  26           2HB      CYS  26 -12.945  -9.554   5.740
  440    HB3  CYS  26           1HB      CYS  26 -12.634  -9.684   7.463
  441    H    GLY  27           H        GLY  27 -11.865 -10.820   3.824
  442    HA2  GLY  27           1HA      GLY  27 -12.543 -12.670   2.544
  443    HA3  GLY  27           2HA      GLY  27 -12.587 -13.644   4.011
  444    H    GLY  28           H        GLY  28 -14.030 -10.570   4.180
  445    HA2  GLY  28           1HA      GLY  28 -16.687 -11.840   4.167
  446    HA3  GLY  28           2HA      GLY  28 -16.257 -10.417   5.108
  447    H    LYS  29           H        LYS  29 -18.058  -9.336   4.190
  448    HA   LYS  29           HA       LYS  29 -17.921  -8.738   1.334
  449    HB2  LYS  29           2HB      LYS  29 -19.929  -8.034   3.484
  450    HB3  LYS  29           1HB      LYS  29 -20.036  -7.443   1.834
  451    HG2  LYS  29           2HG      LYS  29 -20.985  -9.318   1.141
  452    HG3  LYS  29           1HG      LYS  29 -19.732 -10.309   1.888
  453    HD2  LYS  29           2HD      LYS  29 -21.925 -10.849   2.801
  454    HD3  LYS  29           1HD      LYS  29 -20.891 -10.141   4.042
  455    HE2  LYS  29           2HE      LYS  29 -21.990  -7.929   3.525
  456    HE3  LYS  29           1HE      LYS  29 -23.141  -8.820   2.529
  457    HZ1  LYS  29           3HZ      LYS  29 -24.077  -9.826   4.355
  458    HZ2  LYS  29           1HZ      LYS  29 -23.691  -8.304   4.994
  459    HZ3  LYS  29           2HZ      LYS  29 -22.700  -9.638   5.322
  460    H    ILE  30           H        ILE  30 -16.871  -6.975   0.616
  461    HA   ILE  30           HA       ILE  30 -15.722  -5.096   2.417
  462    HB   ILE  30           HB       ILE  30 -16.033  -5.019  -0.589
  463   HG12  ILE  30          2HG1      ILE  30 -13.481  -5.328   0.974
  464   HG13  ILE  30          1HG1      ILE  30 -14.500  -6.721   0.619
  465   HG21  ILE  30          1HG2      ILE  30 -14.113  -3.249   0.843
  466   HG22  ILE  30          2HG2      ILE  30 -14.884  -3.040  -0.729
  467   HG23  ILE  30          3HG2      ILE  30 -15.807  -2.762   0.749
  468   HD11  ILE  30          3HD1      ILE  30 -14.326  -6.076  -1.808
  469   HD12  ILE  30          1HD1      ILE  30 -13.081  -4.925  -1.321
  470   HD13  ILE  30          2HD1      ILE  30 -12.840  -6.652  -1.051
  471    H    ALA  31           H        ALA  31 -16.961  -3.793   3.555
  472    HA   ALA  31           HA       ALA  31 -19.198  -2.448   2.200
  473    HB1  ALA  31           1HB      ALA  31 -20.385  -3.371   3.865
  474    HB2  ALA  31           2HB      ALA  31 -18.952  -3.683   4.844
  475    HB3  ALA  31           3HB      ALA  31 -19.697  -2.085   4.856
  476    H    ASP  32           H        ASP  32 -16.252  -1.806   2.482
  477    HA   ASP  32           HA       ASP  32 -16.289   0.679   3.973
  478    HB2  ASP  32           2HB      ASP  32 -14.261  -1.006   2.676
  479    HB3  ASP  32           1HB      ASP  32 -13.970   0.723   2.528
  480    H    ARG  33           H        ARG  33 -17.706  -0.118   1.275
  481    HA   ARG  33           HA       ARG  33 -18.661   1.031  -0.419
  482    HB2  ARG  33           2HB      ARG  33 -18.210   3.020   1.357
  483    HB3  ARG  33           1HB      ARG  33 -17.218   3.575   0.013
  484    HG2  ARG  33           2HG      ARG  33 -19.419   3.005  -1.349
  485    HG3  ARG  33           1HG      ARG  33 -20.160   3.303   0.226
  486    HD2  ARG  33           2HD      ARG  33 -18.347   5.379  -0.075
  487    HD3  ARG  33           1HD      ARG  33 -19.036   5.172  -1.686
  488    HE   ARG  33           HE       ARG  33 -21.071   5.170   0.299
  489   HH11  ARG  33          2HH1      ARG  33 -18.884   7.333  -1.392
  490   HH12  ARG  33          1HH1      ARG  33 -19.976   8.691  -1.327
  491   HH21  ARG  33          2HH2      ARG  33 -22.471   6.950   0.436
  492   HH22  ARG  33          1HH2      ARG  33 -22.010   8.477  -0.254
  493    H    PHE  34           H        PHE  34 -15.389   2.435  -0.132
  494    HA   PHE  34           HA       PHE  34 -15.026   1.859  -2.983
  495    HB2  PHE  34           2HB      PHE  34 -14.029   3.946  -1.152
  496    HB3  PHE  34           1HB      PHE  34 -12.847   3.339  -2.308
  497    HD1  PHE  34           2HD      PHE  34 -16.509   3.953  -2.593
  498    HD2  PHE  34           1HD      PHE  34 -12.600   4.906  -3.974
  499    HE1  PHE  34           2HE      PHE  34 -17.480   5.388  -4.337
  500    HE2  PHE  34           1HE      PHE  34 -13.563   6.343  -5.722
  501    HZ   PHE  34           HZ       PHE  34 -16.008   6.581  -5.908
  502    H    LEU  35           H        LEU  35 -13.778   0.245  -3.601
  503    HA   LEU  35           HA       LEU  35 -12.101  -1.052  -1.584
  504    HB2  LEU  35           2HB      LEU  35 -12.031  -2.849  -3.523
  505    HB3  LEU  35           1HB      LEU  35 -13.360  -2.767  -2.385
  506    HG   LEU  35           HG       LEU  35 -13.707  -1.173  -4.848
  507   HD11  LEU  35          1HD1      LEU  35 -12.957  -3.974  -4.944
  508   HD12  LEU  35          2HD1      LEU  35 -14.550  -3.682  -5.643
  509   HD13  LEU  35          3HD1      LEU  35 -13.146  -2.807  -6.254
  510   HD21  LEU  35          3HD2      LEU  35 -15.529  -3.194  -3.559
  511   HD22  LEU  35          1HD2      LEU  35 -15.392  -1.530  -2.989
  512   HD23  LEU  35          2HD2      LEU  35 -15.962  -1.856  -4.627
  513    H    LEU  36           H        LEU  36  -9.987  -1.794  -2.164
  514    HA   LEU  36           HA       LEU  36  -8.722  -0.043  -4.170
  515    HB2  LEU  36           2HB      LEU  36  -7.531  -1.020  -1.570
  516    HB3  LEU  36           1HB      LEU  36  -6.741   0.021  -2.738
  517    HG   LEU  36           HG       LEU  36  -9.283   1.115  -1.824
  518   HD11  LEU  36          1HD1      LEU  36  -7.995  -0.235   0.157
  519   HD12  LEU  36          2HD1      LEU  36  -7.291   1.376   0.301
  520   HD13  LEU  36          3HD1      LEU  36  -9.039   1.167   0.396
  521   HD21  LEU  36          3HD2      LEU  36  -8.151   2.859  -2.615
  522   HD22  LEU  36          1HD2      LEU  36  -7.178   2.798  -1.145
  523   HD23  LEU  36          2HD2      LEU  36  -6.632   1.963  -2.600
  524    H    TYR  37           H        TYR  37  -6.619  -0.851  -4.938
  525    HA   TYR  37           HA       TYR  37  -6.646  -3.772  -5.278
  526    HB2  TYR  37           2HB      TYR  37  -6.525  -1.610  -7.167
  527    HB3  TYR  37           1HB      TYR  37  -5.048  -2.559  -7.275
  528    HD1  TYR  37           1HD      TYR  37  -6.018  -5.271  -6.720
  529    HD2  TYR  37           2HD      TYR  37  -7.760  -2.166  -9.038
  530    HE1  TYR  37           1HE      TYR  37  -7.196  -6.951  -8.069
  531    HE2  TYR  37           2HE      TYR  37  -8.942  -3.832 -10.398
  532    HH   TYR  37           HH       TYR  37  -8.188  -6.753 -10.770
  533    H    ALA  38           H        ALA  38  -4.667  -4.867  -5.222
  534    HA   ALA  38           HA       ALA  38  -2.283  -3.339  -4.512
  535    HB1  ALA  38           1HB      ALA  38  -3.760  -4.783  -2.605
  536    HB2  ALA  38           2HB      ALA  38  -2.312  -5.732  -2.938
  537    HB3  ALA  38           3HB      ALA  38  -2.165  -4.054  -2.414
  538    H    MET  39           H        MET  39  -2.683  -6.804  -4.207
  539    HA   MET  39           HA       MET  39  -0.658  -7.245  -6.217
  540    HB2  MET  39           2HB      MET  39  -1.883  -8.761  -4.045
  541    HB3  MET  39           1HB      MET  39  -1.660  -9.728  -5.495
  542    HG2  MET  39           2HG      MET  39   0.307 -10.080  -4.365
  543    HG3  MET  39           1HG      MET  39   0.743  -8.768  -5.460
  544    HE1  MET  39           3HE      MET  39   0.936  -5.729  -3.725
  545    HE2  MET  39           1HE      MET  39   2.458  -6.616  -3.799
  546    HE3  MET  39           2HE      MET  39   1.286  -6.766  -5.108
  547    H    ASP  40           H        ASP  40  -3.643  -9.077  -5.770
  548    HA   ASP  40           HA       ASP  40  -4.543  -8.442  -8.465
  549    HB2  ASP  40           2HB      ASP  40  -4.570 -10.681  -9.250
  550    HB3  ASP  40           1HB      ASP  40  -2.968 -10.450  -8.559
  551    H    SER  41           H        SER  41  -5.267  -8.505  -5.400
  552    HA   SER  41           HA       SER  41  -7.945  -9.667  -5.740
  553    HB2  SER  41           2HB      SER  41  -7.193  -9.240  -2.979
  554    HB3  SER  41           1HB      SER  41  -7.676 -10.735  -3.782
  555    HG   SER  41           HG       SER  41  -5.612 -11.210  -4.215
  556    H    TYR  42           H        TYR  42  -9.580  -8.599  -4.198
  557    HA   TYR  42           HA       TYR  42  -9.294  -5.698  -4.459
  558    HB2  TYR  42           2HB      TYR  42 -11.745  -7.356  -3.823
  559    HB3  TYR  42           1HB      TYR  42 -11.720  -5.616  -4.094
  560    HD1  TYR  42           2HD      TYR  42 -10.673  -4.887  -6.419
  561    HD2  TYR  42           1HD      TYR  42 -12.301  -8.734  -5.603
  562    HE1  TYR  42           2HE      TYR  42 -11.029  -5.241  -8.822
  563    HE2  TYR  42           1HE      TYR  42 -12.656  -9.096  -8.010
  564    HH   TYR  42           HH       TYR  42 -11.252  -7.711 -10.309
  565    H    TRP  43           H        TRP  43  -9.271  -4.354  -2.725
  566    HA   TRP  43           HA       TRP  43  -9.435  -5.583  -0.052
  567    HB2  TRP  43           2HB      TRP  43  -7.392  -3.474  -0.756
  568    HB3  TRP  43           1HB      TRP  43  -7.446  -4.502   0.671
  569    HD1  TRP  43           HD       TRP  43  -6.774  -4.803  -3.133
  570    HE1  TRP  43           1HE      TRP  43  -5.168  -6.770  -3.505
  571    HE3  TRP  43           3HE      TRP  43  -6.412  -6.479   1.677
  572    HZ2  TRP  43           2HZ      TRP  43  -3.898  -8.763  -1.970
  573    HZ3  TRP  43           3HZ      TRP  43  -4.976  -8.425   2.143
  574    HH2  TRP  43           HH       TRP  43  -3.744  -9.539   0.350
  575    H    HIS  44           H        HIS  44  -9.231  -3.644   1.617
  576    HA   HIS  44           HA       HIS  44 -10.514  -1.200   0.734
  577    HB2  HIS  44           2HB      HIS  44 -12.270  -1.344   2.542
  578    HB3  HIS  44           1HB      HIS  44 -12.510  -2.471   1.212
  579    HD1  HIS  44           1HD      HIS  44 -12.826  -2.448   4.734
  580    HD2  HIS  44           2HD      HIS  44 -11.097  -5.062   1.997
  581    HE1  HIS  44           1HE      HIS  44 -12.560  -4.694   5.927
  582    H    SER  45           H        SER  45 -11.031  -0.056   3.196
  583    HA   SER  45           HA       SER  45  -8.473   0.784   3.936
  584    HB2  SER  45           2HB      SER  45 -10.525   1.200   5.989
  585    HB3  SER  45           1HB      SER  45  -9.598   2.380   5.060
  586    HG   SER  45           HG       SER  45 -12.045   1.136   4.453
  587    H    ARG  46           H        ARG  46 -10.550  -1.673   5.356
  588    HA   ARG  46           HA       ARG  46  -8.873  -1.977   7.679
  589    HB2  ARG  46           2HB      ARG  46 -11.503  -2.580   7.093
  590    HB3  ARG  46           1HB      ARG  46 -10.734  -4.160   7.120
  591    HG2  ARG  46           2HG      ARG  46 -10.474  -2.159   9.346
  592    HG3  ARG  46           1HG      ARG  46 -11.726  -3.400   9.289
  593    HD2  ARG  46           2HD      ARG  46  -9.133  -4.551   8.792
  594    HD3  ARG  46           1HD      ARG  46  -9.128  -3.646  10.304
  595    HE   ARG  46           HE       ARG  46 -11.112  -5.031  10.928
  596   HH11  ARG  46          2HH1      ARG  46  -8.807  -6.195   8.556
  597   HH12  ARG  46          1HH1      ARG  46  -9.114  -7.870   8.896
  598   HH21  ARG  46          2HH2      ARG  46 -11.511  -7.221  11.376
  599   HH22  ARG  46          1HH2      ARG  46 -10.672  -8.455  10.486
  600    H    CYS  47           H        CYS  47  -8.882  -3.241   4.493
  601    HA   CYS  47           HA       CYS  47  -7.446  -5.652   5.324
  602    HB2  CYS  47           2HB      CYS  47  -9.311  -5.042   3.215
  603    HB3  CYS  47           1HB      CYS  47  -7.826  -5.707   2.543
  604    H    LEU  48           H        LEU  48  -7.146  -2.879   3.147
  605    HA   LEU  48           HA       LEU  48  -4.639  -3.766   2.100
  606    HB2  LEU  48           2HB      LEU  48  -6.569  -2.139   1.163
  607    HB3  LEU  48           1HB      LEU  48  -5.445  -0.941   1.773
  608    HG   LEU  48           HG       LEU  48  -5.368  -1.965  -0.734
  609   HD11  LEU  48          1HD1      LEU  48  -2.758  -1.346  -0.336
  610   HD12  LEU  48          2HD1      LEU  48  -4.051  -0.171  -0.585
  611   HD13  LEU  48          3HD1      LEU  48  -3.525  -0.571   1.049
  612   HD21  LEU  48          3HD2      LEU  48  -3.146  -3.425   0.659
  613   HD22  LEU  48          1HD2      LEU  48  -4.699  -4.195   0.336
  614   HD23  LEU  48          2HD2      LEU  48  -3.717  -3.597  -1.001
  615    H    LYS  49           H        LYS  49  -3.684  -4.017   4.247
  616    HA   LYS  49           HA       LYS  49  -2.223  -1.580   4.964
  617    HB2  LYS  49           2HB      LYS  49  -3.607  -3.481   6.859
  618    HB3  LYS  49           1HB      LYS  49  -2.305  -2.419   7.376
  619    HG2  LYS  49           2HG      LYS  49  -3.661  -0.486   6.596
  620    HG3  LYS  49           1HG      LYS  49  -4.985  -1.607   6.277
  621    HD2  LYS  49           2HD      LYS  49  -4.043  -2.118   8.897
  622    HD3  LYS  49           1HD      LYS  49  -4.244  -0.373   8.734
  623    HE2  LYS  49           2HE      LYS  49  -6.516  -1.131   7.600
  624    HE3  LYS  49           1HE      LYS  49  -6.260  -2.548   8.618
  625    HZ1  LYS  49           3HZ      LYS  49  -6.311  -1.247  10.547
  626    HZ2  LYS  49           1HZ      LYS  49  -7.584  -0.643   9.601
  627    HZ3  LYS  49           2HZ      LYS  49  -6.117   0.206   9.695
  628    H    CYS  50           H        CYS  50  -0.165  -2.023   5.954
  629    HA   CYS  50           HA       CYS  50   1.313  -4.099   4.817
  630    HB2  CYS  50           2HB      CYS  50   2.367  -2.081   5.627
  631    HB3  CYS  50           1HB      CYS  50   1.805  -2.388   7.260
  632    H    SER  51           H        SER  51   1.769  -6.164   5.459
  633    HA   SER  51           HA       SER  51   0.070  -7.300   7.499
  634    HB2  SER  51           2HB      SER  51   2.234  -8.862   6.138
  635    HB3  SER  51           1HB      SER  51   0.609  -9.369   6.599
  636    HG   SER  51           HG       SER  51   0.311  -7.425   4.855
  637    H    SER  52           H        SER  52   2.915  -5.691   7.613
  638    HA   SER  52           HA       SER  52   4.030  -7.367   9.741
  639    HB2  SER  52           2HB      SER  52   5.662  -5.094   8.944
  640    HB3  SER  52           1HB      SER  52   6.061  -6.813   8.974
  641    HG   SER  52           HG       SER  52   4.703  -5.385   6.923
  642    H    CYS  53           H        CYS  53   3.303  -3.905   9.076
  643    HA   CYS  53           HA       CYS  53   3.180  -3.562  12.001
  644    HB2  CYS  53           2HB      CYS  53   3.788  -1.226  11.716
  645    HB3  CYS  53           1HB      CYS  53   5.003  -2.264  10.983
  646    H    GLN  54           H        GLN  54   1.324  -3.767   9.308
  647    HA   GLN  54           HA       GLN  54  -0.835  -3.369   8.811
  648    HB2  GLN  54           2HB      GLN  54  -0.750  -3.553  11.708
  649    HB3  GLN  54           1HB      GLN  54  -2.078  -2.547  11.148
  650    HG2  GLN  54           2HG      GLN  54  -1.916  -4.932   9.562
  651    HG3  GLN  54           1HG      GLN  54  -1.979  -5.339  11.276
  652   HE21  GLN  54          1HE2      GLN  54  -3.869  -5.134   8.738
  653   HE22  GLN  54          2HE2      GLN  54  -5.336  -4.561   9.450
  654    H    ALA  55           H        ALA  55   0.953  -1.239   8.418
  655    HA   ALA  55           HA       ALA  55  -0.459   1.182   9.141
  656    HB1  ALA  55           1HB      ALA  55   1.870   0.729   7.277
  657    HB2  ALA  55           2HB      ALA  55   1.239   2.305   7.754
  658    HB3  ALA  55           3HB      ALA  55   1.962   1.243   8.962
  659    H    GLN  56           H        GLN  56  -1.782   2.372   7.823
  660    HA   GLN  56           HA       GLN  56  -3.141   0.993   5.748
  661    HB2  GLN  56           2HB      GLN  56  -3.469   3.417   7.258
  662    HB3  GLN  56           1HB      GLN  56  -3.734   3.742   5.550
  663    HG2  GLN  56           2HG      GLN  56  -5.035   1.337   6.670
  664    HG3  GLN  56           1HG      GLN  56  -5.657   2.906   7.186
  665   HE21  GLN  56          1HE2      GLN  56  -7.524   2.991   6.124
  666   HE22  GLN  56          2HE2      GLN  56  -7.688   2.927   4.404
  667    H    LEU  57           H        LEU  57  -2.520   0.749   3.724
  668    HA   LEU  57           HA       LEU  57  -0.591   2.657   2.601
  669    HB2  LEU  57           2HB      LEU  57  -1.225  -0.067   1.500
  670    HB3  LEU  57           1HB      LEU  57   0.175   0.934   1.166
  671    HG   LEU  57           HG       LEU  57  -0.297  -0.064   3.949
  672   HD11  LEU  57          1HD1      LEU  57  -0.418  -2.124   2.929
  673   HD12  LEU  57          2HD1      LEU  57   0.642  -1.649   1.601
  674   HD13  LEU  57          3HD1      LEU  57   1.316  -1.953   3.203
  675   HD21  LEU  57          3HD2      LEU  57   1.911   0.417   4.289
  676   HD22  LEU  57          1HD2      LEU  57   2.345   0.149   2.602
  677   HD23  LEU  57          2HD2      LEU  57   1.514   1.630   3.073
  678    H    GLY  58           H        GLY  58  -3.835   1.915   2.522
  679    HA2  GLY  58           1HA      GLY  58  -4.138   2.552  -0.319
  680    HA3  GLY  58           2HA      GLY  58  -5.384   1.892   0.727
  681    H    ASP  59           H        ASP  59  -4.930   3.809   2.870
  682    HA   ASP  59           HA       ASP  59  -6.308   6.068   1.622
  683    HB2  ASP  59           2HB      ASP  59  -6.710   4.629   4.035
  684    HB3  ASP  59           1HB      ASP  59  -6.292   6.285   4.463
  685    H    ILE  60           H        ILE  60  -3.326   5.289   2.387
  686    HA   ILE  60           HA       ILE  60  -2.527   8.088   2.589
  687    HB   ILE  60           HB       ILE  60  -0.861   6.150   4.129
  688   HG12  ILE  60          2HG1      ILE  60  -3.254   7.505   5.386
  689   HG13  ILE  60          1HG1      ILE  60  -3.231   5.805   4.925
  690   HG21  ILE  60          1HG2      ILE  60  -0.436   8.663   3.586
  691   HG22  ILE  60          2HG2      ILE  60  -1.535   8.945   4.937
  692   HG23  ILE  60          3HG2      ILE  60  -0.048   8.030   5.187
  693   HD11  ILE  60          3HD1      ILE  60  -1.720   5.247   6.580
  694   HD12  ILE  60          1HD1      ILE  60  -1.139   6.903   6.751
  695   HD13  ILE  60          2HD1      ILE  60  -2.732   6.461   7.365
  696    H    GLY  61           H        GLY  61  -0.727   8.550   1.400
  697    HA2  GLY  61           1HA      GLY  61   0.075   6.668  -0.589
  698    HA3  GLY  61           2HA      GLY  61   0.766   8.261  -0.330
  699    H    THR  62           H        THR  62   0.667   5.091   1.265
  700    HA   THR  62           HA       THR  62   3.439   5.463   2.115
  701    HB   THR  62           HB       THR  62   1.825   3.061   2.863
  702    HG1  THR  62           1HG      THR  62   0.446   4.199   4.019
  703   HG21  THR  62          3HG2      THR  62   4.051   3.084   3.695
  704   HG22  THR  62          1HG2      THR  62   3.009   3.507   5.053
  705   HG23  THR  62          2HG2      THR  62   3.914   4.765   4.212
  706    H    SER  63           H        SER  63   5.072   4.347   1.263
  707    HA   SER  63           HA       SER  63   4.759   3.005  -1.202
  708    HB2  SER  63           2HB      SER  63   7.279   2.423   0.090
  709    HB3  SER  63           1HB      SER  63   6.964   3.443  -1.315
  710    HG   SER  63           HG       SER  63   6.642   5.189   0.007
  711    H    SER  64           H        SER  64   3.892   1.043  -1.401
  712    HA   SER  64           HA       SER  64   4.435  -0.969   0.677
  713    HB2  SER  64           2HB      SER  64   2.231  -1.708  -0.995
  714    HB3  SER  64           1HB      SER  64   2.221  -1.322   0.729
  715    HG   SER  64           HG       SER  64   2.165   0.939   0.034
  716    H    TYR  65           H        TYR  65   5.338  -2.855   0.123
  717    HA   TYR  65           HA       TYR  65   5.728  -3.436  -2.740
  718    HB2  TYR  65           2HB      TYR  65   7.810  -3.661  -0.550
  719    HB3  TYR  65           1HB      TYR  65   8.019  -4.232  -2.201
  720    HD1  TYR  65           1HD      TYR  65   8.136  -2.594  -4.063
  721    HD2  TYR  65           2HD      TYR  65   8.083  -1.354   0.002
  722    HE1  TYR  65           1HE      TYR  65   8.963  -0.380  -4.736
  723    HE2  TYR  65           2HE      TYR  65   8.906   0.866  -0.659
  724    HH   TYR  65           HH       TYR  65  10.350   1.735  -2.813
  725    H    THR  66           H        THR  66   6.577  -5.779  -2.983
  726    HA   THR  66           HA       THR  66   5.495  -7.548  -0.931
  727    HB   THR  66           HB       THR  66   3.707  -7.059  -2.674
  728    HG1  THR  66           1HG      THR  66   3.535  -8.894  -1.380
  729   HG21  THR  66          3HG2      THR  66   5.528  -8.756  -4.387
  730   HG22  THR  66          1HG2      THR  66   5.110  -7.065  -4.665
  731   HG23  THR  66          2HG2      THR  66   3.869  -8.312  -4.784
  732    H    LYS  67           H        LYS  67   5.802  -9.922  -1.833
  733    HA   LYS  67           HA       LYS  67   7.980 -10.479  -3.528
  734    HB2  LYS  67           2HB      LYS  67   9.031  -9.483  -1.323
  735    HB3  LYS  67           1HB      LYS  67   8.688 -11.081  -0.677
  736    HG2  LYS  67           2HG      LYS  67   9.997 -12.035  -2.591
  737    HG3  LYS  67           1HG      LYS  67  10.474 -10.384  -2.994
  738    HD2  LYS  67           2HD      LYS  67  11.143 -10.319  -0.447
  739    HD3  LYS  67           1HD      LYS  67  11.238 -12.067  -0.661
  740    HE2  LYS  67           2HE      LYS  67  13.401 -11.298  -1.111
  741    HE3  LYS  67           1HE      LYS  67  12.683 -11.571  -2.698
  742    HZ1  LYS  67           3HZ      LYS  67  12.061  -9.051  -2.439
  743    HZ2  LYS  67           1HZ      LYS  67  13.599  -9.510  -2.979
  744    HZ3  LYS  67           2HZ      LYS  67  13.373  -9.043  -1.369
  745    H    SER  68           H        SER  68   7.573 -12.117  -0.461
  746    HA   SER  68           HA       SER  68   6.710 -14.517  -1.784
  747    HB2  SER  68           2HB      SER  68   6.611 -14.576   1.118
  748    HB3  SER  68           1HB      SER  68   7.639 -15.494   0.014
  749    HG   SER  68           HG       SER  68   9.157 -14.269   0.801
  750    H    GLY  69           H        GLY  69   4.787 -12.606  -2.203
  751    HA2  GLY  69           1HA      GLY  69   2.488 -12.483  -2.200
  752    HA3  GLY  69           2HA      GLY  69   2.468 -13.915  -1.185
  753    H    MET  70           H        MET  70   4.403 -11.609   0.239
  754    HA   MET  70           HA       MET  70   2.295 -10.991   2.163
  755    HB2  MET  70           2HB      MET  70   4.661 -11.927   2.729
  756    HB3  MET  70           1HB      MET  70   5.185 -10.262   2.514
  757    HG2  MET  70           2HG      MET  70   3.634  -9.542   4.251
  758    HG3  MET  70           1HG      MET  70   3.083 -11.203   4.454
  759    HE1  MET  70           3HE      MET  70   5.857 -13.066   6.077
  760    HE2  MET  70           1HE      MET  70   4.631 -13.097   4.811
  761    HE3  MET  70           2HE      MET  70   6.314 -12.756   4.402
  762    H    ILE  71           H        ILE  71   1.773  -8.905   2.788
  763    HA   ILE  71           HA       ILE  71   2.520  -6.803   0.888
  764    HB   ILE  71           HB       ILE  71   0.362  -6.827   3.009
  765   HG12  ILE  71          2HG1      ILE  71  -0.779  -6.648   0.451
  766   HG13  ILE  71          1HG1      ILE  71   0.451  -7.902   0.324
  767   HG21  ILE  71          1HG2      ILE  71   0.657  -4.594   2.754
  768   HG22  ILE  71          2HG2      ILE  71   1.339  -4.752   1.137
  769   HG23  ILE  71          3HG2      ILE  71  -0.406  -4.874   1.377
  770   HD11  ILE  71          3HD1      ILE  71  -2.134  -7.961   1.608
  771   HD12  ILE  71          1HD1      ILE  71  -1.071  -9.286   1.134
  772   HD13  ILE  71          2HD1      ILE  71  -0.841  -8.484   2.688
  773    H    LEU  72           H        LEU  72   4.252  -5.619   1.495
  774    HA   LEU  72           HA       LEU  72   4.548  -5.034   4.371
  775    HB2  LEU  72           2HB      LEU  72   6.862  -5.430   2.490
  776    HB3  LEU  72           1HB      LEU  72   6.898  -5.332   4.240
  777    HG   LEU  72           HG       LEU  72   5.238  -7.529   3.576
  778   HD11  LEU  72          1HD1      LEU  72   6.405  -8.834   2.087
  779   HD12  LEU  72          2HD1      LEU  72   6.590  -7.235   1.366
  780   HD13  LEU  72          3HD1      LEU  72   7.906  -7.935   2.308
  781   HD21  LEU  72          3HD2      LEU  72   6.846  -8.764   4.836
  782   HD22  LEU  72          1HD2      LEU  72   8.083  -7.540   4.558
  783   HD23  LEU  72          2HD2      LEU  72   6.689  -7.170   5.571
  784    H    CYS  73           H        CYS  73   5.381  -3.006   4.908
  785    HA   CYS  73           HA       CYS  73   5.121  -0.974   2.886
  786    HB2  CYS  73           2HB      CYS  73   5.541   0.605   4.707
  787    HB3  CYS  73           1HB      CYS  73   4.318  -0.569   5.180
  788    H    ARG  74           H        ARG  74   6.976   0.821   3.158
  789    HA   ARG  74           HA       ARG  74   9.178  -0.174   1.773
  790    HB2  ARG  74           2HB      ARG  74   8.210   2.334   2.478
  791    HB3  ARG  74           1HB      ARG  74   9.790   2.261   3.243
  792    HG2  ARG  74           2HG      ARG  74  10.237   1.273   0.699
  793    HG3  ARG  74           1HG      ARG  74   9.092   2.594   0.459
  794    HD2  ARG  74           2HD      ARG  74  10.614   4.157   0.981
  795    HD3  ARG  74           1HD      ARG  74  11.259   3.214   2.324
  796    HE   ARG  74           HE       ARG  74  12.642   2.026   0.753
  797   HH11  ARG  74          2HH1      ARG  74  11.065   4.894  -0.503
  798   HH12  ARG  74          1HH1      ARG  74  12.189   5.082  -1.825
  799   HH21  ARG  74          2HH2      ARG  74  14.088   2.250  -0.978
  800   HH22  ARG  74          1HH2      ARG  74  13.898   3.561  -2.106
  801    H    ASN  75           H        ASN  75   8.973   0.826   5.186
  802    HA   ASN  75           HA       ASN  75  11.711   0.248   5.724
  803    HB2  ASN  75           2HB      ASN  75   9.537   1.474   7.082
  804    HB3  ASN  75           1HB      ASN  75  10.153   0.195   8.124
  805   HD21  ASN  75          1HD2      ASN  75  11.788   0.693   9.383
  806   HD22  ASN  75          2HD2      ASN  75  12.862   2.033   9.168
  807    H    ASP  76           H        ASP  76   8.720  -1.548   6.044
  808    HA   ASP  76           HA       ASP  76   9.835  -3.531   7.796
  809    HB2  ASP  76           2HB      ASP  76   7.210  -2.968   6.589
  810    HB3  ASP  76           1HB      ASP  76   7.553  -4.673   6.864
  811    H    TYR  77           H        TYR  77   9.169  -3.287   4.360
  812    HA   TYR  77           HA       TYR  77   9.407  -5.947   3.611
  813    HB2  TYR  77           2HB      TYR  77   8.680  -4.139   2.096
  814    HB3  TYR  77           1HB      TYR  77  10.324  -3.512   2.068
  815    HD1  TYR  77           1HD      TYR  77   9.767  -7.124   2.062
  816    HD2  TYR  77           2HD      TYR  77  10.415  -3.689  -0.356
  817    HE1  TYR  77           1HE      TYR  77  10.233  -8.578   0.131
  818    HE2  TYR  77           2HE      TYR  77  10.899  -5.127  -2.287
  819    HH   TYR  77           HH       TYR  77  10.010  -7.845  -2.787
  820    H    ILE  78           H        ILE  78  11.936  -3.465   3.802
  821    HA   ILE  78           HA       ILE  78  13.960  -5.249   2.891
  822    HB   ILE  78           HB       ILE  78  14.623  -2.773   4.442
  823   HG12  ILE  78          2HG1      ILE  78  13.971  -2.586   1.525
  824   HG13  ILE  78          1HG1      ILE  78  12.670  -2.478   2.704
  825   HG21  ILE  78          1HG2      ILE  78  15.835  -3.619   1.853
  826   HG22  ILE  78          2HG2      ILE  78  16.559  -2.742   3.199
  827   HG23  ILE  78          3HG2      ILE  78  16.257  -4.475   3.335
  828   HD11  ILE  78          3HD1      ILE  78  13.197  -0.393   3.227
  829   HD12  ILE  78          1HD1      ILE  78  14.909  -0.779   3.389
  830   HD13  ILE  78          2HD1      ILE  78  14.235  -0.407   1.802
  831    H    ARG  79           H        ARG  79  12.653  -4.418   5.971
  832    HA   ARG  79           HA       ARG  79  14.794  -5.382   7.584
  833    HB2  ARG  79           2HB      ARG  79  11.916  -4.708   8.057
  834    HB3  ARG  79           1HB      ARG  79  12.830  -5.548   9.301
  835    HG2  ARG  79           2HG      ARG  79  14.532  -3.660   9.077
  836    HG3  ARG  79           1HG      ARG  79  13.271  -2.806   8.185
  837    HD2  ARG  79           2HD      ARG  79  12.905  -2.060  10.331
  838    HD3  ARG  79           1HD      ARG  79  11.786  -3.418  10.229
  839    HE   ARG  79           HE       ARG  79  13.832  -4.664  11.279
  840   HH11  ARG  79          2HH1      ARG  79  12.669  -1.447  12.008
  841   HH12  ARG  79          1HH1      ARG  79  13.256  -1.463  13.649
  842   HH21  ARG  79          2HH2      ARG  79  14.542  -4.733  13.441
  843   HH22  ARG  79          1HH2      ARG  79  14.307  -3.355  14.476
  844    H    LEU  80           H        LEU  80  11.810  -6.787   6.321
  845    HA   LEU  80           HA       LEU  80  12.227  -9.290   7.675
  846    HB2  LEU  80           2HB      LEU  80  10.125  -8.044   6.120
  847    HB3  LEU  80           1HB      LEU  80  10.378  -9.707   5.625
  848    HG   LEU  80           HG       LEU  80  10.231  -9.300   8.536
  849   HD11  LEU  80          1HD1      LEU  80   7.713  -9.228   8.410
  850   HD12  LEU  80          2HD1      LEU  80   8.548  -7.727   8.014
  851   HD13  LEU  80          3HD1      LEU  80   7.897  -8.739   6.726
  852   HD21  LEU  80          3HD2      LEU  80   9.664 -11.330   6.521
  853   HD22  LEU  80          1HD2      LEU  80  10.096 -11.509   8.221
  854   HD23  LEU  80          2HD2      LEU  80   8.418 -11.216   7.764
  855    H    PHE  81           H        PHE  81  12.168  -8.365   4.224
  856    HA   PHE  81           HA       PHE  81  13.729 -10.807   3.682
  857    HB2  PHE  81           2HB      PHE  81  11.763  -9.356   1.900
  858    HB3  PHE  81           1HB      PHE  81  12.732 -10.739   1.405
  859    HD1  PHE  81           2HD      PHE  81  12.309 -12.957   2.379
  860    HD2  PHE  81           1HD      PHE  81   9.819  -9.618   3.234
  861    HE1  PHE  81           2HE      PHE  81  10.566 -14.480   3.218
  862    HE2  PHE  81           1HE      PHE  81   8.065 -11.133   4.070
  863    HZ   PHE  81           HZ       PHE  81   8.439 -13.567   4.062
  864    H    GLY  82           H        GLY  82  13.153  -7.524   2.433
  865    HA2  GLY  82           1HA      GLY  82  14.698  -6.013   1.581
  866    HA3  GLY  82           2HA      GLY  82  15.974  -7.192   1.883
  Start of MODEL    9
    1    H    SER 641           1H       SER 641  27.160  11.444  16.332
    2    HA   SER 641           HA       SER 641  25.530  12.496  18.326
    3    HB2  SER 641           2HB      SER 641  23.687  11.898  16.136
    4    HB3  SER 641           1HB      SER 641  23.662  13.231  17.295
    5    HG   SER 641           HG       SER 641  24.370  14.448  15.740
    6    H    LEU 642           H        LEU 642  25.985  10.614  19.351
    7    HA   LEU 642           HA       LEU 642  24.746   8.203  18.231
    8    HB2  LEU 642           2HB      LEU 642  27.539   8.508  19.293
    9    HB3  LEU 642           1HB      LEU 642  26.718   6.961  19.368
   10    HG   LEU 642           HG       LEU 642  27.122   8.483  16.794
   11   HD11  LEU 642          1HD1      LEU 642  29.115   7.281  18.342
   12   HD12  LEU 642          2HD1      LEU 642  28.744   6.124  17.063
   13   HD13  LEU 642          3HD1      LEU 642  29.220   7.772  16.652
   14   HD21  LEU 642          3HD2      LEU 642  25.305   6.712  17.036
   15   HD22  LEU 642          1HD2      LEU 642  26.454   6.508  15.712
   16   HD23  LEU 642          2HD2      LEU 642  26.621   5.548  17.183
   17    H    GLN 643           H        GLN 643  23.008   8.518  19.590
   18    HA   GLN 643           HA       GLN 643  21.759   8.197  21.456
   19    HB2  GLN 643           2HB      GLN 643  23.516   6.225  21.652
   20    HB3  GLN 643           1HB      GLN 643  24.079   7.158  23.030
   21    HG2  GLN 643           2HG      GLN 643  21.485   7.138  23.607
   22    HG3  GLN 643           1HG      GLN 643  21.557   5.658  22.651
   23   HE21  GLN 643          1HE2      GLN 643  22.035   3.876  23.703
   24   HE22  GLN 643          2HE2      GLN 643  22.842   3.787  25.234
   25    H    ASN 644           H        ASN 644  22.848  10.684  20.996
   26    HA   ASN 644           HA       ASN 644  23.681  11.588  23.675
   27    HB2  ASN 644           2HB      ASN 644  25.084  11.951  21.437
   28    HB3  ASN 644           1HB      ASN 644  24.029  13.358  21.307
   29   HD21  ASN 644          1HD2      ASN 644  26.854  12.181  22.560
   30   HD22  ASN 644          2HD2      ASN 644  27.166  13.401  23.753
   31    H    ASN 645           H        ASN 645  22.516  13.687  21.115
   32    HA   ASN 645           HA       ASN 645  20.072  14.181  22.666
   33    HB2  ASN 645           2HB      ASN 645  22.019  15.831  23.136
   34    HB3  ASN 645           1HB      ASN 645  21.658  16.468  21.535
   35   HD21  ASN 645          1HD2      ASN 645  21.294  17.298  24.506
   36   HD22  ASN 645          2HD2      ASN 645  19.703  17.982  24.505
   37    H    GLN 646           H        GLN 646  21.711  15.488  19.772
   38    HA   GLN 646           HA       GLN 646  19.176  15.568  18.367
   39    HB2  GLN 646           2HB      GLN 646  21.420  17.127  18.258
   40    HB3  GLN 646           1HB      GLN 646  21.619  16.118  16.830
   41    HG2  GLN 646           2HG      GLN 646  20.367  17.680  15.834
   42    HG3  GLN 646           1HG      GLN 646  19.021  16.831  16.595
   43   HE21  GLN 646          1HE2      GLN 646  19.106  19.578  15.842
   44   HE22  GLN 646          2HE2      GLN 646  18.920  20.516  17.289
   45    H    ASP 647           H        ASP 647  19.415  13.061  18.882
   46    HA   ASP 647           HA       ASP 647  20.843  11.661  16.750
   47    HB2  ASP 647           2HB      ASP 647  19.754  10.963  19.412
   48    HB3  ASP 647           1HB      ASP 647  19.624   9.703  18.191
   49    H    VAL 648           H        VAL 648  19.022  12.993  15.476
   50    HA   VAL 648           HA       VAL 648  16.652  11.260  15.242
   51    HB   VAL 648           HB       VAL 648  16.364  13.930  14.086
   52   HG11  VAL 648          1HG1      VAL 648  14.790  12.075  15.818
   53   HG12  VAL 648          2HG1      VAL 648  14.277  13.748  15.603
   54   HG13  VAL 648          3HG1      VAL 648  14.424  12.686  14.205
   55   HG21  VAL 648          3HG2      VAL 648  16.631  13.707  17.087
   56   HG22  VAL 648          1HG2      VAL 648  17.745  14.560  16.018
   57   HG23  VAL 648          2HG2      VAL 648  16.084  15.125  16.192
   58    H    SER 649           H        SER 649  18.055  13.790  13.162
   59    HA   SER 649           HA       SER 649  17.626  11.991  10.890
   60    HB2  SER 649           2HB      SER 649  18.412  14.798  10.390
   61    HB3  SER 649           1HB      SER 649  17.150  13.827   9.632
   62    HG   SER 649           HG       SER 649  16.961  15.615  11.656
   63    H    PHE 650           H        PHE 650  19.256  11.135   9.796
   64    HA   PHE 650           HA       PHE 650  21.980  11.988  10.457
   65    HB2  PHE 650           2HB      PHE 650  20.838   9.442   9.331
   66    HB3  PHE 650           1HB      PHE 650  22.558   9.804   9.215
   67    HD1  PHE 650           1HD      PHE 650  23.068  11.090  11.809
   68    HD2  PHE 650           2HD      PHE 650  20.708   7.680  10.842
   69    HE1  PHE 650           1HE      PHE 650  23.416  10.212  14.080
   70    HE2  PHE 650           2HE      PHE 650  21.052   6.796  13.116
   71    HZ   PHE 650           HZ       PHE 650  22.410   8.067  14.736
   72    H    GLU 651           H        GLU 651  22.263  13.741   9.177
   73    HA   GLU 651           HA       GLU 651  21.404  14.009   6.510
   74    HB2  GLU 651           2HB      GLU 651  23.450  15.761   6.629
   75    HB3  GLU 651           1HB      GLU 651  21.865  16.075   7.321
   76    HG2  GLU 651           2HG      GLU 651  22.949  16.499   9.211
   77    HG3  GLU 651           1HG      GLU 651  23.149  14.753   9.348
   78    H    ASN 652           H        ASN 652  24.078  12.377   7.869
   79    HA   ASN 652           HA       ASN 652  25.937  12.622   5.775
   80    HB2  ASN 652           2HB      ASN 652  25.806  11.312   8.284
   81    HB3  ASN 652           1HB      ASN 652  26.263  10.105   7.084
   82   HD21  ASN 652          1HD2      ASN 652  27.024  13.421   8.099
   83   HD22  ASN 652          2HD2      ASN 652  28.719  13.303   7.753
   84    H    ILE 653           H        ILE 653  23.182  10.533   6.190
   85    HA   ILE 653           HA       ILE 653  23.980   9.058   3.773
   86    HB   ILE 653           HB       ILE 653  21.917   7.592   4.560
   87   HG12  ILE 653          2HG1      ILE 653  23.026   8.192   7.261
   88   HG13  ILE 653          1HG1      ILE 653  21.831   9.310   6.611
   89   HG21  ILE 653          1HG2      ILE 653  24.723   7.470   4.699
   90   HG22  ILE 653          2HG2      ILE 653  24.103   6.790   6.206
   91   HG23  ILE 653          3HG2      ILE 653  23.576   6.129   4.659
   92   HD11  ILE 653          3HD1      ILE 653  21.147   6.454   6.432
   93   HD12  ILE 653          1HD1      ILE 653  21.218   7.138   8.056
   94   HD13  ILE 653          2HD1      ILE 653  20.144   7.843   6.847
   95    H    GLN 654           H        GLN 654  23.092  11.576   3.432
   96    HA   GLN 654           HA       GLN 654  20.300  11.365   2.596
   97    HB2  GLN 654           2HB      GLN 654  22.161  13.603   3.162
   98    HB3  GLN 654           1HB      GLN 654  20.981  13.872   1.888
   99    HG2  GLN 654           2HG      GLN 654  20.356  13.048   4.712
  100    HG3  GLN 654           1HG      GLN 654  20.191  14.674   4.048
  101   HE21  GLN 654          1HE2      GLN 654  18.255  12.687   5.185
  102   HE22  GLN 654          2HE2      GLN 654  16.995  12.596   4.005
  103    H    TRP 655           H        TRP 655  20.948   9.765   0.974
  104    HA   TRP 655           HA       TRP 655  22.582  10.471  -1.229
  105    HB2  TRP 655           2HB      TRP 655  20.703   8.588  -2.145
  106    HB3  TRP 655           1HB      TRP 655  22.341   8.271  -1.586
  107    HD1  TRP 655           HD       TRP 655  22.621   7.013   0.693
  108    HE1  TRP 655           1HE      TRP 655  20.972   5.956   2.363
  109    HE3  TRP 655           3HE      TRP 655  18.254   8.953  -1.135
  110    HZ2  TRP 655           2HZ      TRP 655  18.197   5.948   2.844
  111    HZ3  TRP 655           3HZ      TRP 655  16.145   8.370  -0.006
  112    HH2  TRP 655           HH       TRP 655  16.119   6.899   1.941
  113    H    SER 656           H        SER 656  21.981  11.105  -3.340
  114    HA   SER 656           HA       SER 656  19.374  12.483  -3.430
  115    HB2  SER 656           2HB      SER 656  21.801  13.321  -5.011
  116    HB3  SER 656           1HB      SER 656  20.353  14.259  -4.644
  117    HG   SER 656           HG       SER 656  22.153  13.337  -2.646
  118    H    ILE 657           H        ILE 657  19.328   9.920  -4.141
  119    HA   ILE 657           HA       ILE 657  19.254   9.973  -7.085
  120    HB   ILE 657           HB       ILE 657  19.375   7.359  -6.709
  121   HG12  ILE 657          2HG1      ILE 657  21.380   7.427  -4.793
  122   HG13  ILE 657          1HG1      ILE 657  20.139   8.477  -4.118
  123   HG21  ILE 657          1HG2      ILE 657  21.605   9.351  -6.826
  124   HG22  ILE 657          2HG2      ILE 657  21.939   7.619  -6.819
  125   HG23  ILE 657          3HG2      ILE 657  20.957   8.320  -8.104
  126   HD11  ILE 657          3HD1      ILE 657  19.075   6.681  -3.405
  127   HD12  ILE 657          1HD1      ILE 657  18.809   6.201  -5.083
  128   HD13  ILE 657          2HD1      ILE 657  20.236   5.630  -4.217
  129    H    ASP 658           H        ASP 658  17.843   7.728  -7.602
  130    HA   ASP 658           HA       ASP 658  15.172   8.460  -6.870
  131    HB2  ASP 658           2HB      ASP 658  15.934   7.395  -9.072
  132    HB3  ASP 658           1HB      ASP 658  16.001   5.875  -8.190
  133    HA   PRO 659           HA       PRO 659  15.244   6.111  -3.032
  134    HB2  PRO 659           2HB      PRO 659  12.577   6.524  -2.491
  135    HB3  PRO 659           1HB      PRO 659  13.863   7.657  -2.070
  136    HG2  PRO 659           2HG      PRO 659  11.998   7.693  -4.405
  137    HG3  PRO 659           1HG      PRO 659  12.558   9.042  -3.398
  138    HD2  PRO 659           2HD      PRO 659  13.588   8.578  -5.831
  139    HD3  PRO 659           1HD      PRO 659  14.590   9.181  -4.495
  140    H    GLY 660           H        GLY 660  13.208   5.692  -5.814
  141    HA2  GLY 660           1HA      GLY 660  12.407   3.009  -4.883
  142    HA3  GLY 660           2HA      GLY 660  11.596   3.931  -6.141
  143    H    ALA 661           H        ALA 661  15.065   3.752  -5.989
  144    HA   ALA 661           HA       ALA 661  15.301   2.712  -8.607
  145    HB1  ALA 661           1HB      ALA 661  17.320   3.025  -6.393
  146    HB2  ALA 661           2HB      ALA 661  17.729   2.447  -8.010
  147    HB3  ALA 661           3HB      ALA 661  17.073   4.070  -7.793
  148    H    ASP 662           H        ASP 662  15.977   1.235  -5.439
  149    HA   ASP 662           HA       ASP 662  16.179  -1.398  -6.623
  150    HB2  ASP 662           2HB      ASP 662  17.399  -0.382  -4.473
  151    HB3  ASP 662           1HB      ASP 662  15.969  -1.021  -3.671
  152    H    LEU 663           H        LEU 663  14.874  -3.183  -5.679
  153    HA   LEU 663           HA       LEU 663  12.842  -4.211  -5.680
  154    HB2  LEU 663           2HB      LEU 663  11.375  -2.573  -3.883
  155    HB3  LEU 663           1HB      LEU 663  12.137  -4.119  -3.580
  156    HG   LEU 663           HG       LEU 663  13.932  -1.770  -3.478
  157   HD11  LEU 663          1HD1      LEU 663  13.130  -1.465  -1.041
  158   HD12  LEU 663          2HD1      LEU 663  12.251  -0.663  -2.344
  159   HD13  LEU 663          3HD1      LEU 663  11.616  -2.148  -1.630
  160   HD21  LEU 663          3HD2      LEU 663  15.159  -3.104  -2.149
  161   HD22  LEU 663          1HD2      LEU 663  13.753  -3.671  -1.249
  162   HD23  LEU 663          2HD2      LEU 663  14.149  -4.391  -2.809
  163    H    SER 664           H        SER 664  13.085  -2.286  -7.741
  164    HA   SER 664           HA       SER 664  10.938  -0.471  -7.854
  165    HB2  SER 664           2HB      SER 664  11.750  -1.245 -10.486
  166    HB3  SER 664           1HB      SER 664  12.133   0.236  -9.606
  167    HG   SER 664           HG       SER 664  14.028  -0.564  -9.024
  168    H    GLN 665           H        GLN 665  11.294  -3.776  -9.041
  169    HA   GLN 665           HA       GLN 665   8.642  -3.722 -10.214
  170    HB2  GLN 665           2HB      GLN 665  10.846  -5.757 -10.117
  171    HB3  GLN 665           1HB      GLN 665   9.229  -6.203 -10.648
  172    HG2  GLN 665           2HG      GLN 665  11.000  -4.101 -11.880
  173    HG3  GLN 665           1HG      GLN 665  10.629  -5.688 -12.553
  174   HE21  GLN 665          1HE2      GLN 665   9.940  -2.538 -12.860
  175   HE22  GLN 665          2HE2      GLN 665   8.324  -2.634 -13.485
  176    H    TYR 666           H        TYR 666   9.849  -4.192  -7.147
  177    HA   TYR 666           HA       TYR 666   8.128  -6.425  -6.438
  178    HB2  TYR 666           2HB      TYR 666  10.191  -4.834  -4.938
  179    HB3  TYR 666           1HB      TYR 666   9.106  -5.948  -4.103
  180    HD1  TYR 666           2HD      TYR 666   8.949  -8.238  -5.858
  181    HD2  TYR 666           1HD      TYR 666  12.291  -5.764  -4.981
  182    HE1  TYR 666           2HE      TYR 666  10.460 -10.101  -6.396
  183    HE2  TYR 666           1HE      TYR 666  13.812  -7.614  -5.521
  184    HH   TYR 666           HH       TYR 666  13.521  -9.822  -7.142
  185    H    LYS 667           H        LYS 667   7.824  -3.059  -6.571
  186    HA   LYS 667           HA       LYS 667   6.023  -2.858  -4.324
  187    HB2  LYS 667           2HB      LYS 667   5.610  -0.526  -5.383
  188    HB3  LYS 667           1HB      LYS 667   7.152  -0.856  -4.614
  189    HG2  LYS 667           2HG      LYS 667   8.182  -0.254  -6.472
  190    HG3  LYS 667           1HG      LYS 667   7.410  -1.592  -7.325
  191    HD2  LYS 667           2HD      LYS 667   5.517   0.522  -7.007
  192    HD3  LYS 667           1HD      LYS 667   7.003   1.180  -7.696
  193    HE2  LYS 667           2HE      LYS 667   6.936  -0.718  -9.353
  194    HE3  LYS 667           1HE      LYS 667   5.319  -1.079  -8.754
  195    HZ1  LYS 667           3HZ      LYS 667   4.748   1.286  -9.319
  196    HZ2  LYS 667           1HZ      LYS 667   5.048   0.264 -10.642
  197    HZ3  LYS 667           2HZ      LYS 667   6.233   1.369 -10.140
  198    H    MET 668           H        MET 668   3.975  -3.384  -4.374
  199    HA   MET 668           HA       MET 668   2.614  -3.811  -6.903
  200    HB2  MET 668           2HB      MET 668   2.265  -4.680  -4.150
  201    HB3  MET 668           1HB      MET 668   0.759  -4.078  -4.828
  202    HG2  MET 668           2HG      MET 668   0.587  -5.763  -6.327
  203    HG3  MET 668           1HG      MET 668   2.332  -5.953  -6.489
  204    HE1  MET 668           3HE      MET 668   0.804  -9.275  -5.626
  205    HE2  MET 668           1HE      MET 668   1.533  -8.198  -6.819
  206    HE3  MET 668           2HE      MET 668   2.556  -9.064  -5.672
  207    H    ASP 669           H        ASP 669   2.394  -1.777  -7.762
  208    HA   ASP 669           HA       ASP 669   1.653   0.513  -6.314
  209    HB2  ASP 669           2HB      ASP 669   2.358  -0.082  -8.990
  210    HB3  ASP 669           1HB      ASP 669   0.807   0.756  -9.041
  211    H    VAL 670           H        VAL 670  -0.242   1.208  -5.596
  212    HA   VAL 670           HA       VAL 670  -2.419  -0.667  -5.803
  213    HB   VAL 670           HB       VAL 670  -2.142   1.862  -4.176
  214   HG11  VAL 670          1HG1      VAL 670  -4.123  -0.204  -3.449
  215   HG12  VAL 670          2HG1      VAL 670  -4.199   1.549  -3.288
  216   HG13  VAL 670          3HG1      VAL 670  -4.502   0.792  -4.853
  217   HG21  VAL 670          3HG2      VAL 670  -1.531   0.518  -2.367
  218   HG22  VAL 670          1HG2      VAL 670  -2.113  -0.956  -3.144
  219   HG23  VAL 670          2HG2      VAL 670  -0.639  -0.174  -3.722
  220    H    THR 671           H        THR 671  -3.817  -0.557  -7.372
  221    HA   THR 671           HA       THR 671  -4.581   1.965  -8.586
  222    HB   THR 671           HB       THR 671  -6.038  -0.556  -9.236
  223    HG1  THR 671           1HG      THR 671  -3.284  -0.092  -9.881
  224   HG21  THR 671          3HG2      THR 671  -5.495   0.352 -11.570
  225   HG22  THR 671          1HG2      THR 671  -4.920   1.799 -10.744
  226   HG23  THR 671          2HG2      THR 671  -6.603   1.295 -10.575
  227    H    VAL 672           H        VAL 672  -6.363   3.112  -7.998
  228    HA   VAL 672           HA       VAL 672  -8.078   1.871  -5.963
  229    HB   VAL 672           HB       VAL 672  -6.962   4.048  -5.420
  230   HG11  VAL 672          1HG1      VAL 672  -8.824   5.115  -7.532
  231   HG12  VAL 672          2HG1      VAL 672  -8.010   6.117  -6.331
  232   HG13  VAL 672          3HG1      VAL 672  -7.065   5.206  -7.508
  233   HG21  VAL 672          3HG2      VAL 672  -8.898   3.315  -4.179
  234   HG22  VAL 672          1HG2      VAL 672  -8.969   5.063  -4.412
  235   HG23  VAL 672          2HG2      VAL 672  -9.975   3.999  -5.397
  236    H    ILE 673           H        ILE 673 -10.160   1.441  -6.298
  237    HA   ILE 673           HA       ILE 673 -11.143   1.783  -9.013
  238    HB   ILE 673           HB       ILE 673 -12.126   0.143  -6.684
  239   HG12  ILE 673          2HG1      ILE 673 -11.845  -1.552  -8.774
  240   HG13  ILE 673          1HG1      ILE 673 -10.642  -0.341  -9.207
  241   HG21  ILE 673          1HG2      ILE 673 -13.958   1.245  -8.130
  242   HG22  ILE 673          2HG2      ILE 673 -13.439   0.107  -9.376
  243   HG23  ILE 673          3HG2      ILE 673 -14.045  -0.493  -7.833
  244   HD11  ILE 673          3HD1      ILE 673 -10.687  -2.245  -6.940
  245   HD12  ILE 673          1HD1      ILE 673  -9.353  -1.751  -7.983
  246   HD13  ILE 673          2HD1      ILE 673  -9.911  -0.681  -6.696
  247    H    ASP 674           H        ASP 674 -12.434   3.364  -9.573
  248    HA   ASP 674           HA       ASP 674 -13.526   5.205  -7.702
  249    HB2  ASP 674           2HB      ASP 674 -13.006   6.174  -9.763
  250    HB3  ASP 674           1HB      ASP 674 -13.712   4.845 -10.676
  251    H    THR 675           H        THR 675 -15.139   4.634  -6.401
  252    HA   THR 675           HA       THR 675 -17.310   2.974  -7.352
  253    HB   THR 675           HB       THR 675 -17.654   4.301  -4.755
  254    HG1  THR 675           1HG      THR 675 -15.956   2.762  -3.893
  255   HG21  THR 675          3HG2      THR 675 -18.760   2.397  -4.323
  256   HG22  THR 675          1HG2      THR 675 -17.391   1.401  -4.818
  257   HG23  THR 675          2HG2      THR 675 -18.531   2.000  -6.026
  258    H    LYS 676           H        LYS 676 -18.414   4.113  -8.857
  259    HA   LYS 676           HA       LYS 676 -18.925   6.871  -8.784
  260    HB2  LYS 676           2HB      LYS 676 -19.184   6.163 -10.916
  261    HB3  LYS 676           1HB      LYS 676 -19.736   4.568 -10.432
  262    HG2  LYS 676           2HG      LYS 676 -21.709   6.599  -9.841
  263    HG3  LYS 676           1HG      LYS 676 -21.255   6.595 -11.548
  264    HD2  LYS 676           2HD      LYS 676 -21.518   3.978 -11.233
  265    HD3  LYS 676           1HD      LYS 676 -22.593   4.486  -9.927
  266    HE2  LYS 676           2HE      LYS 676 -22.948   5.898 -12.483
  267    HE3  LYS 676           1HE      LYS 676 -23.353   4.182 -12.508
  268    HZ1  LYS 676           3HZ      LYS 676 -24.380   5.875 -10.335
  269    HZ2  LYS 676           1HZ      LYS 676 -25.040   4.461 -11.008
  270    HZ3  LYS 676           2HZ      LYS 676 -25.129   5.929 -11.857
  271    H    ASP 677           H        ASP 677 -20.751   4.111  -7.591
  272    HA   ASP 677           HA       ASP 677 -23.113   5.607  -6.967
  273    HB2  ASP 677           2HB      ASP 677 -22.956   3.080  -7.308
  274    HB3  ASP 677           1HB      ASP 677 -22.291   3.002  -5.680
  275    H    GLY 678           H        GLY 678 -22.014   7.395  -5.936
  276    HA2  GLY 678           1HA      GLY 678 -22.352   7.595  -3.235
  277    HA3  GLY 678           2HA      GLY 678 -20.695   7.031  -3.416
  278    H    SER 679           H        SER 679 -19.631   8.319  -5.417
  279    HA   SER 679           HA       SER 679 -19.506  11.044  -4.519
  280    HB2  SER 679           2HB      SER 679 -18.118  10.369  -7.020
  281    HB3  SER 679           1HB      SER 679 -17.484  11.065  -5.527
  282    HG   SER 679           HG       SER 679 -16.945   8.729  -6.282
  283    H    GLN 680           H        GLN 680 -20.605   9.355  -7.437
  284    HA   GLN 680           HA       GLN 680 -21.366  11.736  -8.810
  285    HB2  GLN 680           2HB      GLN 680 -20.877   9.477  -9.869
  286    HB3  GLN 680           1HB      GLN 680 -22.452   8.957  -9.288
  287    HG2  GLN 680           2HG      GLN 680 -22.875  11.383 -10.632
  288    HG3  GLN 680           1HG      GLN 680 -21.784  10.431 -11.640
  289   HE21  GLN 680          1HE2      GLN 680 -24.393  11.101 -12.377
  290   HE22  GLN 680          2HE2      GLN 680 -25.326   9.640 -12.461
  291    H    SER 681           H        SER 681 -22.872  13.042  -7.961
  292    HA   SER 681           HA       SER 681 -25.333  11.812  -6.907
  293    HB2  SER 681           2HB      SER 681 -24.837  14.197  -5.451
  294    HB3  SER 681           1HB      SER 681 -24.854  12.541  -4.844
  295    HG   SER 681           HG       SER 681 -22.564  12.683  -5.962
  296    H    LYS 682           H        LYS 682 -24.599  13.173  -9.472
  297    HA   LYS 682           HA       LYS 682 -26.041  15.681  -9.395
  298    HB2  LYS 682           2HB      LYS 682 -24.060  14.756 -11.009
  299    HB3  LYS 682           1HB      LYS 682 -25.465  14.457 -12.020
  300    HG2  LYS 682           2HG      LYS 682 -25.323  16.565 -12.679
  301    HG3  LYS 682           1HG      LYS 682 -25.834  17.037 -11.056
  302    HD2  LYS 682           2HD      LYS 682 -22.978  16.574 -11.902
  303    HD3  LYS 682           1HD      LYS 682 -23.751  18.156 -11.785
  304    HE2  LYS 682           2HE      LYS 682 -23.945  16.444  -9.389
  305    HE3  LYS 682           1HE      LYS 682 -22.329  17.020  -9.797
  306    HZ1  LYS 682           3HZ      LYS 682 -24.529  18.448  -8.678
  307    HZ2  LYS 682           1HZ      LYS 682 -23.934  19.222 -10.066
  308    HZ3  LYS 682           2HZ      LYS 682 -22.895  18.886  -8.770
  309    H    LEU 683           H        LEU 683 -26.728  12.372 -10.053
  310    HA   LEU 683           HA       LEU 683 -29.522  13.086 -10.546
  311    HB2  LEU 683           2HB      LEU 683 -27.818  12.080 -12.530
  312    HB3  LEU 683           1HB      LEU 683 -28.763  10.700 -12.004
  313    HG   LEU 683           HG       LEU 683 -30.385  13.085 -12.476
  314   HD11  LEU 683          1HD1      LEU 683 -28.321  12.744 -14.280
  315   HD12  LEU 683          2HD1      LEU 683 -29.693  11.943 -15.047
  316   HD13  LEU 683          3HD1      LEU 683 -29.821  13.632 -14.555
  317   HD21  LEU 683          3HD2      LEU 683 -30.915  10.497 -12.208
  318   HD22  LEU 683          1HD2      LEU 683 -31.922  11.567 -13.185
  319   HD23  LEU 683          2HD2      LEU 683 -30.717  10.539 -13.960
  320    H    GLY 684           H        GLY 684 -31.009  11.386  -9.965
  321    HA2  GLY 684           1HA      GLY 684 -30.284   8.913  -8.904
  322    HA3  GLY 684           2HA      GLY 684 -30.290  10.069  -7.578
  323    H    GLY 685           H        GLY 685 -31.991   8.425  -6.929
  324    HA2  GLY 685           1HA      GLY 685 -34.587   9.575  -7.639
  325    HA3  GLY 685           2HA      GLY 685 -34.378   7.844  -7.877
  326    H    GLY 901           H        GLY 901 -35.628  10.018  -5.822
  327    HA2  GLY 901           1HA      GLY 901 -35.050   8.329  -3.460
  328    HA3  GLY 901           2HA      GLY 901 -35.309  10.065  -3.362
  329    H    GLY 902           H        GLY 902 -37.149  10.391  -2.334
  330    HA2  GLY 902           1HA      GLY 902 -39.414  10.411  -1.934
  331    HA3  GLY 902           2HA      GLY 902 -39.637   9.504  -3.423
  332    H    SER 903           H        SER 903 -41.297   8.365  -2.230
  333    HA   SER 903           HA       SER 903 -40.562   6.645  -0.059
  334    HB2  SER 903           2HB      SER 903 -42.987   5.894  -1.481
  335    HB3  SER 903           1HB      SER 903 -42.792   6.453   0.181
  336    HG   SER 903           HG       SER 903 -43.744   8.187  -0.544
  337    H    GLY 904           H        GLY 904 -38.775   5.521  -0.998
  338    HA2  GLY 904           1HA      GLY 904 -38.164   3.325  -1.700
  339    HA3  GLY 904           2HA      GLY 904 -39.603   3.280  -2.714
  340    H    GLY 905           H        GLY 905 -36.462   4.863  -2.341
  341    HA2  GLY 905           1HA      GLY 905 -36.507   5.849  -5.059
  342    HA3  GLY 905           2HA      GLY 905 -35.191   6.016  -3.908
  343    H    HIS 906           H        HIS 906 -35.317   3.049  -3.409
  344    HA   HIS 906           HA       HIS 906 -33.906   2.244  -5.867
  345    HB2  HIS 906           2HB      HIS 906 -32.637   2.610  -3.566
  346    HB3  HIS 906           1HB      HIS 906 -33.253   0.996  -3.228
  347    HD1  HIS 906           1HD      HIS 906 -31.353   2.670  -6.106
  348    HD2  HIS 906           2HD      HIS 906 -31.528  -0.902  -3.982
  349    HE1  HIS 906           1HE      HIS 906 -29.537   1.185  -7.056
  350    H    MET 907           H        MET 907 -34.415   0.315  -6.765
  351    HA   MET 907           HA       MET 907 -36.765  -1.050  -5.772
  352    HB2  MET 907           2HB      MET 907 -36.564  -0.712  -8.162
  353    HB3  MET 907           1HB      MET 907 -35.004  -1.517  -8.187
  354    HG2  MET 907           2HG      MET 907 -36.674  -3.416  -7.092
  355    HG3  MET 907           1HG      MET 907 -37.683  -2.632  -8.305
  356    HE1  MET 907           3HE      MET 907 -35.408  -5.000  -7.297
  357    HE2  MET 907           1HE      MET 907 -35.718  -6.074  -8.663
  358    HE3  MET 907           2HE      MET 907 -34.160  -5.260  -8.515
  359    H    GLY 908           H        GLY 908 -33.328  -1.652  -6.153
  360    HA2  GLY 908           1HA      GLY 908 -32.706  -3.049  -3.993
  361    HA3  GLY 908           2HA      GLY 908 -33.549  -4.286  -4.921
  362    H    SER 909           H        SER 909 -30.588  -3.496  -4.113
  363    HA   SER 909           HA       SER 909 -29.250  -3.356  -6.632
  364    HB2  SER 909           2HB      SER 909 -27.863  -4.418  -4.212
  365    HB3  SER 909           1HB      SER 909 -27.290  -3.271  -5.421
  366    HG   SER 909           HG       SER 909 -29.211  -1.985  -4.349
  367    H    GLY 910           H        GLY 910 -29.190  -4.969  -8.059
  368    HA2  GLY 910           1HA      GLY 910 -29.721  -7.691  -7.321
  369    HA3  GLY 910           2HA      GLY 910 -29.302  -7.109  -8.924
  370    H    GLY 911           H        GLY 911 -27.873  -7.657  -5.731
  371    HA2  GLY 911           1HA      GLY 911 -25.954  -9.406  -6.047
  372    HA3  GLY 911           2HA      GLY 911 -25.256  -8.091  -6.985
  373    H    LEU  18           H        LEU  18 -26.158  -9.195  -3.811
  374    HA   LEU  18           HA       LEU  18 -25.280  -6.712  -2.565
  375    HB2  LEU  18           2HB      LEU  18 -26.346  -9.239  -1.301
  376    HB3  LEU  18           1HB      LEU  18 -26.084  -7.709  -0.486
  377    HG   LEU  18           HG       LEU  18 -27.799  -7.230  -2.708
  378   HD11  LEU  18          1HD1      LEU  18 -29.373  -8.825  -2.707
  379   HD12  LEU  18          2HD1      LEU  18 -28.091  -9.838  -2.039
  380   HD13  LEU  18          3HD1      LEU  18 -29.261  -9.078  -0.963
  381   HD21  LEU  18          3HD2      LEU  18 -27.790  -6.937   0.225
  382   HD22  LEU  18          1HD2      LEU  18 -28.180  -5.766  -1.035
  383   HD23  LEU  18          2HD2      LEU  18 -29.376  -6.966  -0.543
  384    H    SER  19           H        SER  19 -23.563  -8.975  -3.875
  385    HA   SER  19           HA       SER  19 -21.807  -9.564  -1.633
  386    HB2  SER  19           2HB      SER  19 -20.915 -10.372  -4.308
  387    HB3  SER  19           1HB      SER  19 -21.122 -11.339  -2.849
  388    HG   SER  19           HG       SER  19 -23.350 -11.424  -3.273
  389    H    TRP  20           H        TRP  20 -21.959  -7.624  -4.523
  390    HA   TRP  20           HA       TRP  20 -20.604  -6.086  -5.483
  391    HB2  TRP  20           2HB      TRP  20 -19.425  -5.422  -2.812
  392    HB3  TRP  20           1HB      TRP  20 -19.896  -4.343  -4.116
  393    HD1  TRP  20           HD       TRP  20 -22.890  -4.718  -4.476
  394    HE1  TRP  20           1HE      TRP  20 -24.579  -4.301  -2.573
  395    HE3  TRP  20           3HE      TRP  20 -19.749  -5.199  -0.473
  396    HZ2  TRP  20           2HZ      TRP  20 -24.576  -4.177   0.233
  397    HZ3  TRP  20           3HZ      TRP  20 -20.671  -4.907   1.791
  398    HH2  TRP  20           HH       TRP  20 -23.035  -4.407   2.135
  399    H    LYS  21           H        LYS  21 -18.076  -5.683  -3.411
  400    HA   LYS  21           HA       LYS  21 -16.380  -7.496  -4.983
  401    HB2  LYS  21           2HB      LYS  21 -16.082  -4.708  -4.119
  402    HB3  LYS  21           1HB      LYS  21 -14.665  -5.700  -3.813
  403    HG2  LYS  21           2HG      LYS  21 -14.439  -4.638  -5.948
  404    HG3  LYS  21           1HG      LYS  21 -14.669  -6.369  -6.190
  405    HD2  LYS  21           2HD      LYS  21 -16.570  -6.060  -7.334
  406    HD3  LYS  21           1HD      LYS  21 -17.179  -4.895  -6.159
  407    HE2  LYS  21           2HE      LYS  21 -15.595  -3.223  -7.204
  408    HE3  LYS  21           1HE      LYS  21 -15.353  -4.398  -8.496
  409    HZ1  LYS  21           3HZ      LYS  21 -17.314  -2.510  -8.399
  410    HZ2  LYS  21           1HZ      LYS  21 -18.122  -3.929  -7.931
  411    HZ3  LYS  21           2HZ      LYS  21 -17.299  -3.874  -9.411
  412    H    ARG  22           H        ARG  22 -15.027  -8.868  -3.965
  413    HA   ARG  22           HA       ARG  22 -15.670  -9.554  -1.255
  414    HB2  ARG  22           2HB      ARG  22 -15.188 -11.191  -3.110
  415    HB3  ARG  22           1HB      ARG  22 -13.500 -10.710  -3.016
  416    HG2  ARG  22           2HG      ARG  22 -13.437 -12.536  -1.683
  417    HG3  ARG  22           1HG      ARG  22 -13.852 -11.324  -0.469
  418    HD2  ARG  22           2HD      ARG  22 -16.308 -12.025  -1.388
  419    HD3  ARG  22           1HD      ARG  22 -15.434 -13.549  -1.544
  420    HE   ARG  22           HE       ARG  22 -15.461 -12.058   0.999
  421   HH11  ARG  22          2HH1      ARG  22 -16.088 -14.960  -0.858
  422   HH12  ARG  22          1HH1      ARG  22 -16.375 -15.953   0.544
  423   HH21  ARG  22          2HH2      ARG  22 -15.818 -13.363   2.852
  424   HH22  ARG  22          1HH2      ARG  22 -16.209 -15.046   2.655
  425    H    CYS  23           H        CYS  23 -14.490  -9.263   0.566
  426    HA   CYS  23           HA       CYS  23 -12.078  -7.631   0.346
  427    HB2  CYS  23           2HB      CYS  23 -12.927  -6.547   2.121
  428    HB3  CYS  23           1HB      CYS  23 -14.318  -7.615   2.097
  429    H    ALA  24           H        ALA  24 -10.101  -8.423   0.935
  430    HA   ALA  24           HA       ALA  24 -10.039 -11.338   0.997
  431    HB1  ALA  24           1HB      ALA  24  -8.040  -9.257   0.185
  432    HB2  ALA  24           2HB      ALA  24  -7.605 -10.958   0.367
  433    HB3  ALA  24           3HB      ALA  24  -8.830 -10.480  -0.810
  434    H    GLY  25           H        GLY  25  -8.481  -8.611   2.691
  435    HA2  GLY  25           1HA      GLY  25  -6.716 -10.156   4.236
  436    HA3  GLY  25           2HA      GLY  25  -7.254  -8.529   4.625
  437    H    CYS  26           H        CYS  26  -9.712  -8.592   5.354
  438    HA   CYS  26           HA       CYS  26  -9.846 -10.160   7.718
  439    HB2  CYS  26           2HB      CYS  26 -12.340  -8.955   6.665
  440    HB3  CYS  26           1HB      CYS  26 -11.632  -8.857   8.275
  441    H    GLY  27           H        GLY  27 -11.649 -10.218   4.648
  442    HA2  GLY  27           1HA      GLY  27 -11.870 -12.385   3.561
  443    HA3  GLY  27           2HA      GLY  27 -12.133 -13.084   5.148
  444    H    GLY  28           H        GLY  28 -13.595 -10.069   4.126
  445    HA2  GLY  28           1HA      GLY  28 -16.197 -11.473   4.094
  446    HA3  GLY  28           2HA      GLY  28 -15.972  -9.881   4.808
  447    H    LYS  29           H        LYS  29 -16.930  -8.412   3.584
  448    HA   LYS  29           HA       LYS  29 -16.255  -8.311   0.741
  449    HB2  LYS  29           2HB      LYS  29 -18.862  -7.406   0.757
  450    HB3  LYS  29           1HB      LYS  29 -18.318  -8.968   0.163
  451    HG2  LYS  29           2HG      LYS  29 -19.594  -9.960   1.668
  452    HG3  LYS  29           1HG      LYS  29 -18.639  -9.216   2.953
  453    HD2  LYS  29           2HD      LYS  29 -20.844  -8.554   3.390
  454    HD3  LYS  29           1HD      LYS  29 -20.103  -7.156   2.605
  455    HE2  LYS  29           2HE      LYS  29 -22.054  -7.282   1.424
  456    HE3  LYS  29           1HE      LYS  29 -21.028  -8.317   0.432
  457    HZ1  LYS  29           3HZ      LYS  29 -22.426  -9.980   0.774
  458    HZ2  LYS  29           1HZ      LYS  29 -23.419  -8.977   1.715
  459    HZ3  LYS  29           2HZ      LYS  29 -22.188  -9.879   2.450
  460    H    ILE  30           H        ILE  30 -16.097  -6.219  -0.070
  461    HA   ILE  30           HA       ILE  30 -15.476  -4.301   1.956
  462    HB   ILE  30           HB       ILE  30 -15.521  -3.990  -1.044
  463   HG12  ILE  30          2HG1      ILE  30 -12.975  -4.042   0.444
  464   HG13  ILE  30          1HG1      ILE  30 -13.855  -5.567   0.410
  465   HG21  ILE  30          1HG2      ILE  30 -15.696  -1.881   0.434
  466   HG22  ILE  30          2HG2      ILE  30 -14.013  -2.220   0.846
  467   HG23  ILE  30          3HG2      ILE  30 -14.466  -1.928  -0.831
  468   HD11  ILE  30          3HD1      ILE  30 -12.879  -5.928  -1.543
  469   HD12  ILE  30          1HD1      ILE  30 -13.956  -4.693  -2.202
  470   HD13  ILE  30          2HD1      ILE  30 -12.334  -4.256  -1.664
  471    H    ALA  31           H        ALA  31 -17.077  -3.356   3.015
  472    HA   ALA  31           HA       ALA  31 -19.173  -2.025   1.431
  473    HB1  ALA  31           1HB      ALA  31 -20.554  -3.157   2.791
  474    HB2  ALA  31           2HB      ALA  31 -19.266  -3.526   3.939
  475    HB3  ALA  31           3HB      ALA  31 -20.088  -1.967   4.007
  476    H    ASP  32           H        ASP  32 -16.349  -1.317   2.296
  477    HA   ASP  32           HA       ASP  32 -16.551   0.907   4.064
  478    HB2  ASP  32           2HB      ASP  32 -14.442  -0.391   3.507
  479    HB3  ASP  32           1HB      ASP  32 -14.426   0.439   1.957
  480    H    ARG  33           H        ARG  33 -15.300   1.299   0.808
  481    HA   ARG  33           HA       ARG  33 -17.507   2.560  -0.363
  482    HB2  ARG  33           2HB      ARG  33 -16.803   4.321   1.376
  483    HB3  ARG  33           1HB      ARG  33 -15.375   4.562   0.378
  484    HG2  ARG  33           2HG      ARG  33 -16.805   5.140  -1.524
  485    HG3  ARG  33           1HG      ARG  33 -18.230   4.914  -0.510
  486    HD2  ARG  33           2HD      ARG  33 -16.771   6.640   0.997
  487    HD3  ARG  33           1HD      ARG  33 -16.332   7.145  -0.634
  488    HE   ARG  33           HE       ARG  33 -19.161   6.887   0.140
  489   HH11  ARG  33          2HH1      ARG  33 -16.473   8.871  -0.927
  490   HH12  ARG  33          1HH1      ARG  33 -17.483  10.205  -1.404
  491   HH21  ARG  33          2HH2      ARG  33 -20.482   8.645  -0.443
  492   HH22  ARG  33          1HH2      ARG  33 -19.767  10.094  -1.101
  493    H    PHE  34           H        PHE  34 -14.061   3.433  -0.350
  494    HA   PHE  34           HA       PHE  34 -13.952   2.737  -3.191
  495    HB2  PHE  34           2HB      PHE  34 -12.531   4.647  -1.445
  496    HB3  PHE  34           1HB      PHE  34 -11.523   3.843  -2.645
  497    HD1  PHE  34           2HD      PHE  34 -14.912   5.405  -2.497
  498    HD2  PHE  34           1HD      PHE  34 -11.249   4.970  -4.615
  499    HE1  PHE  34           2HE      PHE  34 -15.735   6.948  -4.221
  500    HE2  PHE  34           1HE      PHE  34 -12.065   6.513  -6.348
  501    HZ   PHE  34           HZ       PHE  34 -14.311   7.495  -6.156
  502    H    LEU  35           H        LEU  35 -12.790   1.058  -3.930
  503    HA   LEU  35           HA       LEU  35 -11.461  -0.598  -1.911
  504    HB2  LEU  35           2HB      LEU  35 -11.530  -2.112  -4.205
  505    HB3  LEU  35           1HB      LEU  35 -12.651  -2.218  -2.863
  506    HG   LEU  35           HG       LEU  35 -13.262  -0.244  -5.003
  507   HD11  LEU  35          1HD1      LEU  35 -14.317  -2.903  -5.559
  508   HD12  LEU  35          2HD1      LEU  35 -13.626  -1.705  -6.651
  509   HD13  LEU  35          3HD1      LEU  35 -12.567  -2.791  -5.748
  510   HD21  LEU  35          3HD2      LEU  35 -14.869  -2.115  -3.268
  511   HD22  LEU  35          1HD2      LEU  35 -14.761  -0.360  -3.142
  512   HD23  LEU  35          2HD2      LEU  35 -15.565  -1.096  -4.527
  513    H    LEU  36           H        LEU  36  -9.420  -1.384  -2.196
  514    HA   LEU  36           HA       LEU  36  -7.761   0.137  -4.094
  515    HB2  LEU  36           2HB      LEU  36  -7.285  -0.893  -1.316
  516    HB3  LEU  36           1HB      LEU  36  -5.930  -0.588  -2.385
  517    HG   LEU  36           HG       LEU  36  -7.043   1.783  -2.640
  518   HD11  LEU  36          1HD1      LEU  36  -7.817   1.542   0.175
  519   HD12  LEU  36          2HD1      LEU  36  -8.592   2.421  -1.144
  520   HD13  LEU  36          3HD1      LEU  36  -8.886   0.695  -0.945
  521   HD21  LEU  36          3HD2      LEU  36  -5.806   1.492   0.018
  522   HD22  LEU  36          1HD2      LEU  36  -4.890   0.827  -1.335
  523   HD23  LEU  36          2HD2      LEU  36  -5.357   2.528  -1.337
  524    H    TYR  37           H        TYR  37  -6.075  -0.922  -5.155
  525    HA   TYR  37           HA       TYR  37  -6.381  -3.846  -5.374
  526    HB2  TYR  37           2HB      TYR  37  -6.287  -1.742  -7.311
  527    HB3  TYR  37           1HB      TYR  37  -4.874  -2.765  -7.533
  528    HD1  TYR  37           1HD      TYR  37  -6.520  -5.261  -6.421
  529    HD2  TYR  37           2HD      TYR  37  -7.110  -2.396  -9.502
  530    HE1  TYR  37           1HE      TYR  37  -7.891  -6.883  -7.651
  531    HE2  TYR  37           2HE      TYR  37  -8.476  -3.995 -10.746
  532    HH   TYR  37           HH       TYR  37  -8.836  -6.369 -10.933
  533    H    ALA  38           H        ALA  38  -4.795  -4.907  -4.359
  534    HA   ALA  38           HA       ALA  38  -2.092  -3.740  -4.414
  535    HB1  ALA  38           1HB      ALA  38  -2.889  -3.933  -2.153
  536    HB2  ALA  38           2HB      ALA  38  -3.316  -5.626  -2.404
  537    HB3  ALA  38           3HB      ALA  38  -1.622  -5.133  -2.415
  538    H    MET  39           H        MET  39  -2.554  -6.984  -3.382
  539    HA   MET  39           HA       MET  39  -0.707  -8.079  -5.153
  540    HB2  MET  39           2HB      MET  39  -1.761  -8.982  -2.923
  541    HB3  MET  39           1HB      MET  39  -2.913  -9.753  -4.008
  542    HG2  MET  39           2HG      MET  39  -1.461 -11.327  -4.588
  543    HG3  MET  39           1HG      MET  39  -0.164 -10.163  -4.841
  544    HE1  MET  39           3HE      MET  39   1.050  -9.007  -2.928
  545    HE2  MET  39           1HE      MET  39  -0.080  -8.917  -1.576
  546    HE3  MET  39           2HE      MET  39   1.449  -9.777  -1.392
  547    H    ASP  40           H        ASP  40  -4.200  -8.666  -5.139
  548    HA   ASP  40           HA       ASP  40  -4.576  -8.257  -7.901
  549    HB2  ASP  40           2HB      ASP  40  -4.730 -10.426  -8.771
  550    HB3  ASP  40           1HB      ASP  40  -3.291 -10.512  -7.761
  551    H    SER  41           H        SER  41  -5.534  -8.678  -4.806
  552    HA   SER  41           HA       SER  41  -8.318  -9.330  -5.409
  553    HB2  SER  41           2HB      SER  41  -7.908  -9.051  -2.624
  554    HB3  SER  41           1HB      SER  41  -8.123 -10.551  -3.530
  555    HG   SER  41           HG       SER  41  -6.077 -10.967  -3.292
  556    H    TYR  42           H        TYR  42  -9.904  -8.087  -3.962
  557    HA   TYR  42           HA       TYR  42  -9.290  -5.239  -4.172
  558    HB2  TYR  42           2HB      TYR  42 -11.905  -6.690  -3.710
  559    HB3  TYR  42           1HB      TYR  42 -11.735  -4.942  -3.822
  560    HD1  TYR  42           1HD      TYR  42 -10.620  -4.056  -6.009
  561    HD2  TYR  42           2HD      TYR  42 -12.381  -7.905  -5.622
  562    HE1  TYR  42           1HE      TYR  42 -10.881  -4.173  -8.445
  563    HE2  TYR  42           2HE      TYR  42 -12.641  -8.038  -8.063
  564    HH   TYR  42           HH       TYR  42 -11.025  -6.139 -10.170
  565    H    TRP  43           H        TRP  43  -9.041  -3.963  -2.441
  566    HA   TRP  43           HA       TRP  43  -9.578  -5.122   0.214
  567    HB2  TRP  43           2HB      TRP  43  -7.278  -3.249  -0.324
  568    HB3  TRP  43           1HB      TRP  43  -7.531  -4.292   1.068
  569    HD1  TRP  43           HD       TRP  43  -6.687  -4.619  -2.701
  570    HE1  TRP  43           1HE      TRP  43  -5.219  -6.704  -3.009
  571    HE3  TRP  43           3HE      TRP  43  -6.690  -6.348   2.115
  572    HZ2  TRP  43           2HZ      TRP  43  -4.168  -8.792  -1.424
  573    HZ3  TRP  43           3HZ      TRP  43  -5.416  -8.387   2.633
  574    HH2  TRP  43           HH       TRP  43  -4.184  -9.582   0.899
  575    H    HIS  44           H        HIS  44 -10.147  -3.640   1.846
  576    HA   HIS  44           HA       HIS  44 -10.873  -0.942   0.912
  577    HB2  HIS  44           2HB      HIS  44 -12.335  -0.894   3.032
  578    HB3  HIS  44           1HB      HIS  44 -12.895  -1.913   1.712
  579    HD1  HIS  44           1HD      HIS  44 -13.242  -2.165   5.082
  580    HD2  HIS  44           2HD      HIS  44 -11.173  -4.561   2.391
  581    HE1  HIS  44           1HE      HIS  44 -12.891  -4.418   6.227
  582    H    SER  45           H        SER  45 -10.959   0.468   3.198
  583    HA   SER  45           HA       SER  45  -8.383   1.269   3.551
  584    HB2  SER  45           2HB      SER  45 -10.336   1.545   5.804
  585    HB3  SER  45           1HB      SER  45  -9.184   2.724   5.172
  586    HG   SER  45           HG       SER  45 -11.763   2.306   4.458
  587    H    ARG  46           H        ARG  46 -10.117  -1.033   5.673
  588    HA   ARG  46           HA       ARG  46  -7.706  -1.272   7.295
  589    HB2  ARG  46           2HB      ARG  46  -9.010  -2.285   8.961
  590    HB3  ARG  46           1HB      ARG  46 -10.032  -1.024   8.288
  591    HG2  ARG  46           2HG      ARG  46 -11.603  -2.583   8.122
  592    HG3  ARG  46           1HG      ARG  46 -10.670  -3.241   6.777
  593    HD2  ARG  46           2HD      ARG  46 -10.731  -5.121   8.032
  594    HD3  ARG  46           1HD      ARG  46  -9.354  -4.360   8.828
  595    HE   ARG  46           HE       ARG  46 -11.227  -3.428  10.366
  596   HH11  ARG  46          2HH1      ARG  46 -11.169  -6.616   8.886
  597   HH12  ARG  46          1HH1      ARG  46 -12.021  -7.370  10.199
  598   HH21  ARG  46          2HH2      ARG  46 -12.385  -4.416  12.070
  599   HH22  ARG  46          1HH2      ARG  46 -12.690  -6.124  12.026
  600    H    CYS  47           H        CYS  47  -8.721  -2.764   4.536
  601    HA   CYS  47           HA       CYS  47  -7.932  -5.450   5.318
  602    HB2  CYS  47           2HB      CYS  47  -9.560  -4.454   3.296
  603    HB3  CYS  47           1HB      CYS  47  -8.123  -5.025   2.453
  604    H    LEU  48           H        LEU  48  -6.791  -2.963   3.059
  605    HA   LEU  48           HA       LEU  48  -4.327  -4.309   2.562
  606    HB2  LEU  48           2HB      LEU  48  -5.709  -2.025   1.549
  607    HB3  LEU  48           1HB      LEU  48  -4.085  -1.538   1.990
  608    HG   LEU  48           HG       LEU  48  -4.993  -3.385  -0.156
  609   HD11  LEU  48          1HD1      LEU  48  -2.676  -1.470  -0.030
  610   HD12  LEU  48          2HD1      LEU  48  -3.413  -2.188  -1.463
  611   HD13  LEU  48          3HD1      LEU  48  -4.310  -1.009  -0.508
  612   HD21  LEU  48          3HD2      LEU  48  -3.008  -4.613  -0.270
  613   HD22  LEU  48          1HD2      LEU  48  -2.182  -3.568   0.889
  614   HD23  LEU  48          2HD2      LEU  48  -3.448  -4.665   1.436
  615    H    LYS  49           H        LYS  49  -3.430  -4.695   4.578
  616    HA   LYS  49           HA       LYS  49  -2.119  -2.343   5.726
  617    HB2  LYS  49           2HB      LYS  49  -2.360  -3.972   7.918
  618    HB3  LYS  49           1HB      LYS  49  -3.366  -2.573   7.584
  619    HG2  LYS  49           2HG      LYS  49  -5.051  -4.012   7.865
  620    HG3  LYS  49           1HG      LYS  49  -4.690  -4.482   6.202
  621    HD2  LYS  49           2HD      LYS  49  -3.453  -6.366   6.892
  622    HD3  LYS  49           1HD      LYS  49  -3.354  -5.788   8.557
  623    HE2  LYS  49           2HE      LYS  49  -4.999  -7.670   8.100
  624    HE3  LYS  49           1HE      LYS  49  -5.619  -6.268   8.971
  625    HZ1  LYS  49           3HZ      LYS  49  -6.836  -5.569   7.170
  626    HZ2  LYS  49           1HZ      LYS  49  -6.956  -7.252   7.008
  627    HZ3  LYS  49           2HZ      LYS  49  -5.868  -6.383   6.041
  628    H    CYS  50           H        CYS  50  -0.056  -2.667   6.400
  629    HA   CYS  50           HA       CYS  50   1.465  -4.691   5.215
  630    HB2  CYS  50           2HB      CYS  50   2.591  -2.709   5.742
  631    HB3  CYS  50           1HB      CYS  50   1.949  -2.661   7.376
  632    H    SER  51           H        SER  51   2.110  -6.670   5.892
  633    HA   SER  51           HA       SER  51   0.571  -7.859   8.006
  634    HB2  SER  51           2HB      SER  51   2.815  -9.281   6.596
  635    HB3  SER  51           1HB      SER  51   1.282  -9.928   7.176
  636    HG   SER  51           HG       SER  51   1.270  -7.983   5.142
  637    H    SER  52           H        SER  52   3.304  -6.052   8.115
  638    HA   SER  52           HA       SER  52   4.538  -7.676  10.229
  639    HB2  SER  52           2HB      SER  52   6.106  -5.381   9.455
  640    HB3  SER  52           1HB      SER  52   6.515  -7.095   9.380
  641    HG   SER  52           HG       SER  52   5.052  -5.609   7.441
  642    H    CYS  53           H        CYS  53   3.682  -4.256   9.520
  643    HA   CYS  53           HA       CYS  53   3.680  -3.852  12.437
  644    HB2  CYS  53           2HB      CYS  53   4.227  -1.537  12.092
  645    HB3  CYS  53           1HB      CYS  53   5.375  -2.522  11.198
  646    H    GLN  54           H        GLN  54   1.645  -4.429  10.042
  647    HA   GLN  54           HA       GLN  54  -0.581  -4.253   9.760
  648    HB2  GLN  54           2HB      GLN  54  -0.158  -4.142  12.566
  649    HB3  GLN  54           1HB      GLN  54  -1.437  -3.001  12.174
  650    HG2  GLN  54           2HG      GLN  54  -1.742  -5.549  10.808
  651    HG3  GLN  54           1HG      GLN  54  -1.734  -5.702  12.563
  652   HE21  GLN  54          1HE2      GLN  54  -3.109  -3.538  10.095
  653   HE22  GLN  54          2HE2      GLN  54  -4.678  -3.448  10.817
  654    H    ALA  55           H        ALA  55   1.233  -1.937   9.201
  655    HA   ALA  55           HA       ALA  55  -0.128   0.477   9.630
  656    HB1  ALA  55           1HB      ALA  55   1.334   1.439   8.109
  657    HB2  ALA  55           2HB      ALA  55   2.250   0.049   8.692
  658    HB3  ALA  55           3HB      ALA  55   1.439  -0.022   7.128
  659    H    GLN  56           H        GLN  56  -2.021   1.142   8.908
  660    HA   GLN  56           HA       GLN  56  -3.491  -0.443   7.017
  661    HB2  GLN  56           2HB      GLN  56  -4.084   1.969   8.693
  662    HB3  GLN  56           1HB      GLN  56  -5.170   1.544   7.377
  663    HG2  GLN  56           2HG      GLN  56  -5.449  -0.697   8.369
  664    HG3  GLN  56           1HG      GLN  56  -4.427  -0.200   9.715
  665   HE21  GLN  56          1HE2      GLN  56  -6.538   2.130   8.297
  666   HE22  GLN  56          2HE2      GLN  56  -7.714   2.147   9.572
  667    H    LEU  57           H        LEU  57  -2.338  -0.256   5.102
  668    HA   LEU  57           HA       LEU  57  -1.693   2.285   3.949
  669    HB2  LEU  57           2HB      LEU  57  -1.834  -0.193   2.297
  670    HB3  LEU  57           1HB      LEU  57  -0.648   1.097   2.271
  671    HG   LEU  57           HG       LEU  57  -0.745  -0.635   4.688
  672   HD11  LEU  57          1HD1      LEU  57  -0.906  -2.167   2.704
  673   HD12  LEU  57          2HD1      LEU  57   0.655  -1.537   2.176
  674   HD13  LEU  57          3HD1      LEU  57   0.521  -2.388   3.716
  675   HD21  LEU  57          3HD2      LEU  57   0.810   1.415   4.052
  676   HD22  LEU  57          1HD2      LEU  57   1.407   0.040   4.984
  677   HD23  LEU  57          2HD2      LEU  57   1.734   0.142   3.253
  678    H    GLY  58           H        GLY  58  -4.514   0.452   4.157
  679    HA2  GLY  58           1HA      GLY  58  -5.712   0.855   1.649
  680    HA3  GLY  58           2HA      GLY  58  -6.572   0.575   3.154
  681    H    ASP  59           H        ASP  59  -6.210   2.745   4.657
  682    HA   ASP  59           HA       ASP  59  -7.665   4.715   3.114
  683    HB2  ASP  59           2HB      ASP  59  -7.823   5.903   5.366
  684    HB3  ASP  59           1HB      ASP  59  -8.641   4.354   5.216
  685    H    ILE  60           H        ILE  60  -4.630   4.179   3.079
  686    HA   ILE  60           HA       ILE  60  -3.851   7.007   3.219
  687    HB   ILE  60           HB       ILE  60  -2.073   4.573   3.361
  688   HG12  ILE  60          2HG1      ILE  60  -2.764   6.662   5.443
  689   HG13  ILE  60          1HG1      ILE  60  -3.331   4.995   5.429
  690   HG21  ILE  60          1HG2      ILE  60  -1.340   6.901   2.256
  691   HG22  ILE  60          2HG2      ILE  60  -1.001   7.263   3.949
  692   HG23  ILE  60          3HG2      ILE  60  -0.237   5.876   3.172
  693   HD11  ILE  60          3HD1      ILE  60  -1.224   4.155   5.972
  694   HD12  ILE  60          1HD1      ILE  60  -0.409   5.653   5.521
  695   HD13  ILE  60          2HD1      ILE  60  -1.396   5.590   6.981
  696    H    GLY  61           H        GLY  61  -3.486   4.050   1.389
  697    HA2  GLY  61           1HA      GLY  61  -3.809   3.926  -0.968
  698    HA3  GLY  61           2HA      GLY  61  -3.393   5.630  -1.084
  699    H    THR  62           H        THR  62  -1.410   3.695   0.923
  700    HA   THR  62           HA       THR  62   0.885   4.283  -0.682
  701    HB   THR  62           HB       THR  62   1.514   2.388   1.344
  702    HG1  THR  62           1HG      THR  62   0.561   4.052   3.020
  703   HG21  THR  62          3HG2      THR  62   2.917   4.076   2.135
  704   HG22  THR  62          1HG2      THR  62   1.819   5.360   1.631
  705   HG23  THR  62          2HG2      THR  62   2.750   4.472   0.425
  706    H    SER  63           H        SER  63   1.654   3.089  -2.290
  707    HA   SER  63           HA       SER  63   0.732   0.474  -2.895
  708    HB2  SER  63           2HB      SER  63   3.215   1.888  -3.904
  709    HB3  SER  63           1HB      SER  63   2.422   0.500  -4.657
  710    HG   SER  63           HG       SER  63   1.731   2.358  -5.706
  711    H    SER  64           H        SER  64   1.170  -1.221  -1.670
  712    HA   SER  64           HA       SER  64   3.417  -1.279   0.110
  713    HB2  SER  64           2HB      SER  64   2.074  -3.814  -0.135
  714    HB3  SER  64           1HB      SER  64   2.079  -2.692   1.220
  715    HG   SER  64           HG       SER  64   0.381  -1.557   0.200
  716    H    TYR  65           H        TYR  65   4.919  -3.132   0.192
  717    HA   TYR  65           HA       TYR  65   5.748  -3.870  -2.533
  718    HB2  TYR  65           2HB      TYR  65   7.269  -3.591   0.053
  719    HB3  TYR  65           1HB      TYR  65   7.940  -4.454  -1.325
  720    HD1  TYR  65           1HD      TYR  65   6.564  -1.155  -0.308
  721    HD2  TYR  65           2HD      TYR  65   9.072  -3.282  -3.006
  722    HE1  TYR  65           1HE      TYR  65   7.385   0.974  -1.211
  723    HE2  TYR  65           2HE      TYR  65   9.898  -1.155  -3.920
  724    HH   TYR  65           HH       TYR  65   9.873   1.059  -3.742
  725    H    THR  66           H        THR  66   6.672  -6.067  -2.796
  726    HA   THR  66           HA       THR  66   5.829  -8.019  -0.834
  727    HB   THR  66           HB       THR  66   3.837  -7.420  -2.381
  728    HG1  THR  66           1HG      THR  66   3.973  -9.253  -0.958
  729   HG21  THR  66          3HG2      THR  66   5.503  -9.145  -4.214
  730   HG22  THR  66          1HG2      THR  66   4.920  -7.510  -4.522
  731   HG23  THR  66          2HG2      THR  66   3.778  -8.851  -4.434
  732    H    LYS  67           H        LYS  67   6.212 -10.280  -1.743
  733    HA   LYS  67           HA       LYS  67   8.105 -10.614  -3.847
  734    HB2  LYS  67           2HB      LYS  67   9.266  -9.870  -1.489
  735    HB3  LYS  67           1HB      LYS  67   9.267 -11.623  -1.329
  736    HG2  LYS  67           2HG      LYS  67  10.385 -11.754  -3.551
  737    HG3  LYS  67           1HG      LYS  67  10.518  -9.994  -3.528
  738    HD2  LYS  67           2HD      LYS  67  12.279 -10.062  -2.151
  739    HD3  LYS  67           1HD      LYS  67  11.478 -11.202  -1.067
  740    HE2  LYS  67           2HE      LYS  67  12.418 -13.012  -2.057
  741    HE3  LYS  67           1HE      LYS  67  12.423 -12.271  -3.656
  742    HZ1  LYS  67           3HZ      LYS  67  14.246 -10.783  -2.689
  743    HZ2  LYS  67           1HZ      LYS  67  14.651 -12.385  -3.085
  744    HZ3  LYS  67           2HZ      LYS  67  14.373 -11.952  -1.466
  745    H    SER  68           H        SER  68   7.765 -12.389  -0.808
  746    HA   SER  68           HA       SER  68   6.912 -14.747  -2.267
  747    HB2  SER  68           2HB      SER  68   7.164 -14.730   0.703
  748    HB3  SER  68           1HB      SER  68   7.678 -15.947  -0.468
  749    HG   SER  68           HG       SER  68   9.554 -15.003  -0.632
  750    H    GLY  69           H        GLY  69   4.991 -12.754  -2.361
  751    HA2  GLY  69           1HA      GLY  69   2.683 -12.697  -2.229
  752    HA3  GLY  69           2HA      GLY  69   2.741 -14.140  -1.232
  753    H    MET  70           H        MET  70   4.788 -12.145   0.272
  754    HA   MET  70           HA       MET  70   2.828 -11.445   2.277
  755    HB2  MET  70           2HB      MET  70   5.610 -12.008   2.227
  756    HB3  MET  70           1HB      MET  70   5.415 -10.381   2.861
  757    HG2  MET  70           2HG      MET  70   3.770 -11.287   4.489
  758    HG3  MET  70           1HG      MET  70   4.182 -12.905   3.922
  759    HE1  MET  70           3HE      MET  70   6.447 -13.858   3.871
  760    HE2  MET  70           1HE      MET  70   7.599 -13.657   5.190
  761    HE3  MET  70           2HE      MET  70   5.990 -14.301   5.518
  762    H    ILE  71           H        ILE  71   1.936  -9.497   2.549
  763    HA   ILE  71           HA       ILE  71   2.844  -7.311   0.825
  764    HB   ILE  71           HB       ILE  71   0.481  -6.734   2.411
  765   HG12  ILE  71          2HG1      ILE  71  -0.157  -8.767   0.347
  766   HG13  ILE  71          1HG1      ILE  71   0.537  -9.376   1.847
  767   HG21  ILE  71          1HG2      ILE  71  -0.428  -6.128   0.230
  768   HG22  ILE  71          2HG2      ILE  71   1.188  -5.459   0.461
  769   HG23  ILE  71          3HG2      ILE  71   0.959  -6.878  -0.559
  770   HD11  ILE  71          3HD1      ILE  71  -1.531  -7.481   2.421
  771   HD12  ILE  71          1HD1      ILE  71  -2.127  -8.724   1.321
  772   HD13  ILE  71          2HD1      ILE  71  -1.412  -9.183   2.866
  773    H    LEU  72           H        LEU  72   4.257  -5.971   1.693
  774    HA   LEU  72           HA       LEU  72   3.961  -5.275   4.541
  775    HB2  LEU  72           2HB      LEU  72   6.679  -5.272   3.347
  776    HB3  LEU  72           1HB      LEU  72   6.178  -5.623   4.990
  777    HG   LEU  72           HG       LEU  72   5.457  -7.579   2.857
  778   HD11  LEU  72          1HD1      LEU  72   7.625  -8.708   3.155
  779   HD12  LEU  72          2HD1      LEU  72   7.781  -7.142   2.361
  780   HD13  LEU  72          3HD1      LEU  72   8.207  -7.312   4.063
  781   HD21  LEU  72          3HD2      LEU  72   6.270  -9.015   4.942
  782   HD22  LEU  72          1HD2      LEU  72   5.859  -7.525   5.788
  783   HD23  LEU  72          2HD2      LEU  72   4.639  -8.356   4.824
  784    H    CYS  73           H        CYS  73   4.900  -3.181   5.112
  785    HA   CYS  73           HA       CYS  73   4.122  -1.225   3.199
  786    HB2  CYS  73           2HB      CYS  73   4.687   0.414   4.919
  787    HB3  CYS  73           1HB      CYS  73   3.739  -0.901   5.600
  788    H    ARG  74           H        ARG  74   5.620   0.787   3.029
  789    HA   ARG  74           HA       ARG  74   7.778   0.118   1.357
  790    HB2  ARG  74           2HB      ARG  74   6.320   2.343   1.701
  791    HB3  ARG  74           1HB      ARG  74   7.724   2.800   2.655
  792    HG2  ARG  74           2HG      ARG  74   8.125   1.732  -0.099
  793    HG3  ARG  74           1HG      ARG  74   7.577   3.395   0.114
  794    HD2  ARG  74           2HD      ARG  74  10.070   2.182   1.308
  795    HD3  ARG  74           1HD      ARG  74  10.016   3.271  -0.076
  796    HE   ARG  74           HE       ARG  74   9.135   4.980   1.481
  797   HH11  ARG  74          2HH1      ARG  74  10.908   2.235   2.756
  798   HH12  ARG  74          1HH1      ARG  74  11.421   3.068   4.195
  799   HH21  ARG  74          2HH2      ARG  74   9.756   6.054   3.396
  800   HH22  ARG  74          1HH2      ARG  74  10.720   5.225   4.576
  801    H    ASN  75           H        ASN  75   7.558   0.780   4.761
  802    HA   ASN  75           HA       ASN  75  10.407   1.151   5.115
  803    HB2  ASN  75           2HB      ASN  75   8.597   2.324   6.464
  804    HB3  ASN  75           1HB      ASN  75   8.295   0.779   7.249
  805   HD21  ASN  75          1HD2      ASN  75  10.214   3.585   7.181
  806   HD22  ASN  75          2HD2      ASN  75  11.330   3.131   8.427
  807    H    ASP  76           H        ASP  76   7.975  -1.333   5.676
  808    HA   ASP  76           HA       ASP  76   9.698  -2.940   7.308
  809    HB2  ASP  76           2HB      ASP  76   6.907  -2.933   6.573
  810    HB3  ASP  76           1HB      ASP  76   7.586  -4.557   6.488
  811    H    TYR  77           H        TYR  77   8.654  -3.056   3.923
  812    HA   TYR  77           HA       TYR  77   9.426  -5.687   3.411
  813    HB2  TYR  77           2HB      TYR  77   8.144  -4.557   1.734
  814    HB3  TYR  77           1HB      TYR  77   9.386  -3.318   1.537
  815    HD1  TYR  77           1HD      TYR  77   9.028  -7.030   1.340
  816    HD2  TYR  77           2HD      TYR  77  10.844  -3.531  -0.250
  817    HE1  TYR  77           1HE      TYR  77  10.137  -8.392  -0.378
  818    HE2  TYR  77           2HE      TYR  77  11.956  -4.884  -1.973
  819    HH   TYR  77           HH       TYR  77  12.705  -7.283  -2.209
  820    H    ILE  78           H        ILE  78  11.347  -2.722   3.288
  821    HA   ILE  78           HA       ILE  78  13.677  -4.004   2.243
  822    HB   ILE  78           HB       ILE  78  13.823  -1.475   3.850
  823   HG12  ILE  78          2HG1      ILE  78  12.890  -1.616   0.974
  824   HG13  ILE  78          1HG1      ILE  78  11.815  -1.351   2.345
  825   HG21  ILE  78          1HG2      ILE  78  15.617  -2.921   2.309
  826   HG22  ILE  78          2HG2      ILE  78  15.151  -1.566   1.281
  827   HG23  ILE  78          3HG2      ILE  78  15.817  -1.268   2.886
  828   HD11  ILE  78          3HD1      ILE  78  13.676   0.489   1.014
  829   HD12  ILE  78          1HD1      ILE  78  12.149   0.806   1.838
  830   HD13  ILE  78          2HD1      ILE  78  13.628   0.590   2.774
  831    H    ARG  79           H        ARG  79  12.364  -3.456   5.404
  832    HA   ARG  79           HA       ARG  79  14.734  -4.132   6.856
  833    HB2  ARG  79           2HB      ARG  79  12.930  -2.729   7.798
  834    HB3  ARG  79           1HB      ARG  79  11.841  -4.108   7.737
  835    HG2  ARG  79           2HG      ARG  79  13.549  -5.283   9.239
  836    HG3  ARG  79           1HG      ARG  79  14.209  -3.672   9.519
  837    HD2  ARG  79           2HD      ARG  79  12.628  -4.236  11.267
  838    HD3  ARG  79           1HD      ARG  79  11.995  -2.916  10.283
  839    HE   ARG  79           HE       ARG  79  10.279  -4.279   9.581
  840   HH11  ARG  79          2HH1      ARG  79  12.689  -6.220  11.257
  841   HH12  ARG  79          1HH1      ARG  79  11.691  -7.647  11.277
  842   HH21  ARG  79          2HH2      ARG  79   8.986  -6.109   9.633
  843   HH22  ARG  79          1HH2      ARG  79   9.572  -7.579  10.359
  844    H    LEU  80           H        LEU  80  11.896  -5.861   5.706
  845    HA   LEU  80           HA       LEU  80  12.582  -8.309   7.057
  846    HB2  LEU  80           2HB      LEU  80  10.416  -7.371   5.258
  847    HB3  LEU  80           1HB      LEU  80  10.746  -9.093   5.271
  848    HG   LEU  80           HG       LEU  80  10.509  -7.913   7.944
  849   HD11  LEU  80          1HD1      LEU  80   8.722  -6.647   7.458
  850   HD12  LEU  80          2HD1      LEU  80   8.450  -7.449   5.910
  851   HD13  LEU  80          3HD1      LEU  80   7.868  -8.191   7.400
  852   HD21  LEU  80          3HD2      LEU  80   9.086 -10.225   6.645
  853   HD22  LEU  80          1HD2      LEU  80  10.686 -10.337   7.381
  854   HD23  LEU  80          2HD2      LEU  80   9.287  -9.916   8.369
  855    H    PHE  81           H        PHE  81  12.334  -7.406   3.605
  856    HA   PHE  81           HA       PHE  81  14.079  -9.702   3.003
  857    HB2  PHE  81           2HB      PHE  81  12.015  -8.288   1.298
  858    HB3  PHE  81           1HB      PHE  81  13.135  -9.486   0.666
  859    HD1  PHE  81           2HD      PHE  81  12.886 -11.835   1.212
  860    HD2  PHE  81           1HD      PHE  81  10.181  -8.920   2.728
  861    HE1  PHE  81           2HE      PHE  81  11.303 -13.622   1.817
  862    HE2  PHE  81           1HE      PHE  81   8.593 -10.701   3.334
  863    HZ   PHE  81           HZ       PHE  81   9.155 -13.054   2.880
  864    H    GLY  82           H        GLY  82  13.505  -7.353   0.560
  865    HA2  GLY  82           1HA      GLY  82  15.064  -5.316   0.556
  866    HA3  GLY  82           2HA      GLY  82  16.320  -6.535   0.743
  Start of MODEL   10
    1    H    SER 641           1H       SER 641  13.849   9.273  21.443
    2    HA   SER 641           HA       SER 641  14.157  12.069  22.023
    3    HB2  SER 641           2HB      SER 641  15.849  10.022  23.299
    4    HB3  SER 641           1HB      SER 641  14.810  11.247  24.031
    5    HG   SER 641           HG       SER 641  14.095   9.041  24.343
    6    H    LEU 642           H        LEU 642  15.047  12.267  19.690
    7    HA   LEU 642           HA       LEU 642  17.970  12.295  19.963
    8    HB2  LEU 642           2HB      LEU 642  16.399  10.881  17.972
    9    HB3  LEU 642           1HB      LEU 642  17.460  12.058  17.224
   10    HG   LEU 642           HG       LEU 642  18.928  10.574  19.195
   11   HD11  LEU 642          1HD1      LEU 642  18.845   8.378  17.995
   12   HD12  LEU 642          2HD1      LEU 642  17.396   8.769  18.919
   13   HD13  LEU 642          3HD1      LEU 642  17.400   8.957  17.166
   14   HD21  LEU 642          3HD2      LEU 642  19.164  10.539  16.194
   15   HD22  LEU 642          1HD2      LEU 642  19.770  11.847  17.210
   16   HD23  LEU 642          2HD2      LEU 642  20.431  10.220  17.379
   17    H    GLN 643           H        GLN 643  16.837  14.382  20.756
   18    HA   GLN 643           HA       GLN 643  15.671  16.207  19.010
   19    HB2  GLN 643           2HB      GLN 643  17.033  16.398  21.657
   20    HB3  GLN 643           1HB      GLN 643  16.664  17.884  20.792
   21    HG2  GLN 643           2HG      GLN 643  14.801  17.636  22.097
   22    HG3  GLN 643           1HG      GLN 643  14.281  16.862  20.603
   23   HE21  GLN 643          1HE2      GLN 643  12.727  15.984  22.247
   24   HE22  GLN 643          2HE2      GLN 643  13.165  14.498  23.022
   25    H    ASN 644           H        ASN 644  16.452  18.107  18.040
   26    HA   ASN 644           HA       ASN 644  18.989  17.730  16.745
   27    HB2  ASN 644           2HB      ASN 644  17.211  18.609  15.401
   28    HB3  ASN 644           1HB      ASN 644  16.890  19.898  16.557
   29   HD21  ASN 644          1HD2      ASN 644  19.165  18.692  14.181
   30   HD22  ASN 644          2HD2      ASN 644  19.925  20.219  13.860
   31    H    ASN 645           H        ASN 645  20.562  17.922  18.315
   32    HA   ASN 645           HA       ASN 645  20.917  20.637  19.399
   33    HB2  ASN 645           2HB      ASN 645  20.957  18.414  20.857
   34    HB3  ASN 645           1HB      ASN 645  22.624  18.353  20.292
   35   HD21  ASN 645          1HD2      ASN 645  24.099  19.767  21.095
   36   HD22  ASN 645          2HD2      ASN 645  23.759  20.883  22.371
   37    H    GLN 646           H        GLN 646  21.921  18.505  17.020
   38    HA   GLN 646           HA       GLN 646  24.358  20.070  16.529
   39    HB2  GLN 646           2HB      GLN 646  24.235  17.259  15.547
   40    HB3  GLN 646           1HB      GLN 646  25.626  18.214  16.034
   41    HG2  GLN 646           2HG      GLN 646  23.611  17.153  17.994
   42    HG3  GLN 646           1HG      GLN 646  25.040  16.248  17.496
   43   HE21  GLN 646          1HE2      GLN 646  24.567  16.926  20.122
   44   HE22  GLN 646          2HE2      GLN 646  25.757  18.086  20.637
   45    H    ASP 647           H        ASP 647  24.183  21.175  14.713
   46    HA   ASP 647           HA       ASP 647  22.132  20.732  12.804
   47    HB2  ASP 647           2HB      ASP 647  23.153  22.948  13.229
   48    HB3  ASP 647           1HB      ASP 647  24.656  22.374  12.511
   49    H    VAL 648           H        VAL 648  22.232  19.920  10.717
   50    HA   VAL 648           HA       VAL 648  24.540  18.159  10.220
   51    HB   VAL 648           HB       VAL 648  22.893  16.810   8.818
   52   HG11  VAL 648          1HG1      VAL 648  23.580  16.688  11.494
   53   HG12  VAL 648          2HG1      VAL 648  21.826  16.497  11.494
   54   HG13  VAL 648          3HG1      VAL 648  22.833  15.403  10.544
   55   HG21  VAL 648          3HG2      VAL 648  20.609  17.109   9.015
   56   HG22  VAL 648          1HG2      VAL 648  20.756  18.038  10.506
   57   HG23  VAL 648          2HG2      VAL 648  21.194  18.773   8.965
   58    H    SER 649           H        SER 649  24.684  17.534   7.821
   59    HA   SER 649           HA       SER 649  23.899  19.617   5.967
   60    HB2  SER 649           2HB      SER 649  25.984  20.533   6.849
   61    HB3  SER 649           1HB      SER 649  26.806  19.000   6.566
   62    HG   SER 649           HG       SER 649  26.815  20.943   4.933
   63    H    PHE 650           H        PHE 650  24.041  18.932   3.782
   64    HA   PHE 650           HA       PHE 650  23.725  16.139   3.403
   65    HB2  PHE 650           2HB      PHE 650  22.646  17.974   2.023
   66    HB3  PHE 650           1HB      PHE 650  24.205  18.186   1.231
   67    HD1  PHE 650           1HD      PHE 650  21.609  15.624   1.949
   68    HD2  PHE 650           2HD      PHE 650  24.762  16.896  -0.611
   69    HE1  PHE 650           1HE      PHE 650  21.057  13.814   0.378
   70    HE2  PHE 650           2HE      PHE 650  24.215  15.086  -2.189
   71    HZ   PHE 650           HZ       PHE 650  22.360  13.543  -1.696
   72    H    GLU 651           H        GLU 651  26.426  18.262   3.315
   73    HA   GLU 651           HA       GLU 651  28.156  16.710   1.700
   74    HB2  GLU 651           2HB      GLU 651  28.589  18.826   3.787
   75    HB3  GLU 651           1HB      GLU 651  29.950  17.986   3.057
   76    HG2  GLU 651           2HG      GLU 651  28.457  18.737   0.883
   77    HG3  GLU 651           1HG      GLU 651  28.260  20.094   1.991
   78    H    ASN 652           H        ASN 652  27.079  16.428   4.967
   79    HA   ASN 652           HA       ASN 652  29.182  14.558   5.704
   80    HB2  ASN 652           2HB      ASN 652  28.321  16.100   7.410
   81    HB3  ASN 652           1HB      ASN 652  26.700  15.449   7.196
   82   HD21  ASN 652          1HD2      ASN 652  29.824  14.970   8.573
   83   HD22  ASN 652          2HD2      ASN 652  29.419  13.580   9.535
   84    H    ILE 653           H        ILE 653  25.658  14.521   5.293
   85    HA   ILE 653           HA       ILE 653  25.766  11.602   5.002
   86    HB   ILE 653           HB       ILE 653  23.105  12.155   5.003
   87   HG12  ILE 653          2HG1      ILE 653  23.547  13.759   7.321
   88   HG13  ILE 653          1HG1      ILE 653  24.353  14.533   5.959
   89   HG21  ILE 653          1HG2      ILE 653  25.001  10.944   6.703
   90   HG22  ILE 653          2HG2      ILE 653  23.937  11.910   7.724
   91   HG23  ILE 653          3HG2      ILE 653  23.258  10.682   6.655
   92   HD11  ILE 653          3HD1      ILE 653  21.997  13.959   4.821
   93   HD12  ILE 653          1HD1      ILE 653  21.486  14.142   6.499
   94   HD13  ILE 653          2HD1      ILE 653  22.324  15.462   5.684
   95    H    GLN 654           H        GLN 654  26.658  11.894   2.856
   96    HA   GLN 654           HA       GLN 654  25.107  13.129   0.796
   97    HB2  GLN 654           2HB      GLN 654  27.549  11.372   0.802
   98    HB3  GLN 654           1HB      GLN 654  26.751  11.818  -0.701
   99    HG2  GLN 654           2HG      GLN 654  27.152  14.159   0.889
  100    HG3  GLN 654           1HG      GLN 654  28.671  13.273   0.747
  101   HE21  GLN 654          1HE2      GLN 654  29.709  13.199  -1.175
  102   HE22  GLN 654          2HE2      GLN 654  29.185  14.054  -2.593
  103    H    TRP 655           H        TRP 655  23.087  12.189   0.964
  104    HA   TRP 655           HA       TRP 655  22.847   9.309   0.503
  105    HB2  TRP 655           2HB      TRP 655  21.201  11.398   1.769
  106    HB3  TRP 655           1HB      TRP 655  20.295  10.232   0.813
  107    HD1  TRP 655           HD       TRP 655  22.911  10.180   3.685
  108    HE1  TRP 655           1HE      TRP 655  22.358   8.182   5.211
  109    HE3  TRP 655           3HE      TRP 655  19.010   8.226   1.038
  110    HZ2  TRP 655           2HZ      TRP 655  20.497   6.053   5.279
  111    HZ3  TRP 655           3HZ      TRP 655  17.888   6.207   1.901
  112    HH2  TRP 655           HH       TRP 655  18.619   5.144   3.977
  113    H    SER 656           H        SER 656  23.770  10.657  -1.696
  114    HA   SER 656           HA       SER 656  21.583  11.456  -3.389
  115    HB2  SER 656           2HB      SER 656  23.996  11.113  -4.868
  116    HB3  SER 656           1HB      SER 656  23.237  12.620  -4.353
  117    HG   SER 656           HG       SER 656  25.520  11.679  -3.528
  118    H    ILE 657           H        ILE 657  20.794   9.067  -2.835
  119    HA   ILE 657           HA       ILE 657  21.487   7.431  -5.184
  120    HB   ILE 657           HB       ILE 657  20.770   5.468  -3.557
  121   HG12  ILE 657          2HG1      ILE 657  22.267   6.340  -1.389
  122   HG13  ILE 657          1HG1      ILE 657  21.248   7.725  -1.770
  123   HG21  ILE 657          1HG2      ILE 657  22.916   4.795  -3.697
  124   HG22  ILE 657          2HG2      ILE 657  23.067   6.214  -4.735
  125   HG23  ILE 657          3HG2      ILE 657  23.544   6.309  -3.041
  126   HD11  ILE 657          3HD1      ILE 657  19.339   6.648  -1.179
  127   HD12  ILE 657          1HD1      ILE 657  19.958   5.061  -1.634
  128   HD13  ILE 657          2HD1      ILE 657  20.474   5.810  -0.122
  129    H    ASP 658           H        ASP 658  19.749   5.836  -5.714
  130    HA   ASP 658           HA       ASP 658  17.191   7.158  -5.680
  131    HB2  ASP 658           2HB      ASP 658  16.438   5.461  -7.191
  132    HB3  ASP 658           1HB      ASP 658  18.067   5.906  -7.675
  133    HA   PRO 659           HA       PRO 659  15.527   5.073  -2.189
  134    HB2  PRO 659           2HB      PRO 659  12.908   5.533  -2.548
  135    HB3  PRO 659           1HB      PRO 659  14.041   6.857  -2.246
  136    HG2  PRO 659           2HG      PRO 659  12.859   5.928  -4.833
  137    HG3  PRO 659           1HG      PRO 659  13.091   7.583  -4.241
  138    HD2  PRO 659           2HD      PRO 659  14.778   6.321  -6.005
  139    HD3  PRO 659           1HD      PRO 659  15.268   7.648  -4.936
  140    H    GLY 660           H        GLY 660  16.226   3.204  -4.191
  141    HA2  GLY 660           1HA      GLY 660  15.887   0.923  -4.390
  142    HA3  GLY 660           2HA      GLY 660  14.421   1.089  -3.438
  143    H    ALA 661           H        ALA 661  15.528   2.361  -6.568
  144    HA   ALA 661           HA       ALA 661  12.976   2.252  -7.775
  145    HB1  ALA 661           1HB      ALA 661  14.074   3.519  -9.228
  146    HB2  ALA 661           2HB      ALA 661  15.618   3.056  -8.509
  147    HB3  ALA 661           3HB      ALA 661  14.921   2.083  -9.803
  148    H    ASP 662           H        ASP 662  15.536  -0.089  -7.446
  149    HA   ASP 662           HA       ASP 662  14.631  -1.933  -9.406
  150    HB2  ASP 662           2HB      ASP 662  16.910  -1.990  -8.462
  151    HB3  ASP 662           1HB      ASP 662  16.243  -2.444  -6.899
  152    H    LEU 663           H        LEU 663  13.583  -1.182  -6.208
  153    HA   LEU 663           HA       LEU 663  12.350  -3.731  -5.705
  154    HB2  LEU 663           2HB      LEU 663  11.940  -1.113  -4.257
  155    HB3  LEU 663           1HB      LEU 663  11.506  -2.708  -3.674
  156    HG   LEU 663           HG       LEU 663  14.335  -1.778  -4.178
  157   HD11  LEU 663          1HD1      LEU 663  12.829  -0.824  -2.212
  158   HD12  LEU 663          2HD1      LEU 663  13.297  -2.349  -1.462
  159   HD13  LEU 663          3HD1      LEU 663  14.535  -1.208  -1.988
  160   HD21  LEU 663          3HD2      LEU 663  13.269  -4.362  -3.962
  161   HD22  LEU 663          1HD2      LEU 663  14.966  -3.891  -3.892
  162   HD23  LEU 663          2HD2      LEU 663  14.024  -4.019  -2.406
  163    H    SER 664           H        SER 664  11.565  -1.211  -7.697
  164    HA   SER 664           HA       SER 664   8.764  -1.018  -7.255
  165    HB2  SER 664           2HB      SER 664  10.526  -0.276  -9.590
  166    HB3  SER 664           1HB      SER 664   8.781  -0.015  -9.597
  167    HG   SER 664           HG       SER 664  10.247   1.758  -8.817
  168    H    GLN 665           H        GLN 665  10.707  -3.427  -8.649
  169    HA   GLN 665           HA       GLN 665   8.708  -4.558 -10.359
  170    HB2  GLN 665           2HB      GLN 665  11.439  -5.078  -9.712
  171    HB3  GLN 665           1HB      GLN 665  10.526  -6.561  -9.468
  172    HG2  GLN 665           2HG      GLN 665  10.464  -4.922 -11.990
  173    HG3  GLN 665           1HG      GLN 665  11.496  -6.329 -11.733
  174   HE21  GLN 665          1HE2      GLN 665   8.275  -5.194 -12.281
  175   HE22  GLN 665          2HE2      GLN 665   7.560  -6.745 -12.585
  176    H    TYR 666           H        TYR 666   9.395  -4.617  -6.993
  177    HA   TYR 666           HA       TYR 666   7.516  -6.827  -6.535
  178    HB2  TYR 666           2HB      TYR 666   9.237  -5.436  -4.476
  179    HB3  TYR 666           1HB      TYR 666   8.427  -6.992  -4.326
  180    HD1  TYR 666           1HD      TYR 666   9.284  -8.948  -5.623
  181    HD2  TYR 666           2HD      TYR 666  11.391  -5.257  -5.457
  182    HE1  TYR 666           1HE      TYR 666  11.319 -10.079  -6.409
  183    HE2  TYR 666           2HE      TYR 666  13.430  -6.378  -6.245
  184    HH   TYR 666           HH       TYR 666  14.399  -8.340  -6.677
  185    H    LYS 667           H        LYS 667   7.124  -3.820  -7.203
  186    HA   LYS 667           HA       LYS 667   5.873  -2.785  -4.805
  187    HB2  LYS 667           2HB      LYS 667   6.994  -1.696  -7.213
  188    HB3  LYS 667           1HB      LYS 667   5.368  -1.076  -6.987
  189    HG2  LYS 667           2HG      LYS 667   5.972  -0.322  -4.743
  190    HG3  LYS 667           1HG      LYS 667   7.615  -0.921  -4.992
  191    HD2  LYS 667           2HD      LYS 667   7.627   0.589  -7.075
  192    HD3  LYS 667           1HD      LYS 667   6.216   1.363  -6.353
  193    HE2  LYS 667           2HE      LYS 667   7.438   2.097  -4.493
  194    HE3  LYS 667           1HE      LYS 667   8.773   0.995  -4.827
  195    HZ1  LYS 667           3HZ      LYS 667   9.075   2.331  -6.947
  196    HZ2  LYS 667           1HZ      LYS 667   9.523   3.085  -5.497
  197    HZ3  LYS 667           2HZ      LYS 667   8.055   3.489  -6.246
  198    H    MET 668           H        MET 668   3.749  -2.200  -4.585
  199    HA   MET 668           HA       MET 668   1.924  -2.775  -6.807
  200    HB2  MET 668           2HB      MET 668   0.253  -3.641  -5.172
  201    HB3  MET 668           1HB      MET 668   1.668  -4.667  -5.353
  202    HG2  MET 668           2HG      MET 668   2.045  -2.778  -3.214
  203    HG3  MET 668           1HG      MET 668   0.565  -3.711  -2.987
  204    HE1  MET 668           3HE      MET 668   1.102  -6.089  -4.537
  205    HE2  MET 668           1HE      MET 668   2.808  -6.405  -4.853
  206    HE3  MET 668           2HE      MET 668   1.963  -7.302  -3.590
  207    H    ASP 669           H        ASP 669   0.878  -0.961  -7.303
  208    HA   ASP 669           HA       ASP 669   0.661   1.116  -5.249
  209    HB2  ASP 669           2HB      ASP 669   1.626   1.464  -7.679
  210    HB3  ASP 669           1HB      ASP 669  -0.080   1.601  -8.104
  211    H    VAL 670           H        VAL 670  -1.312   2.209  -4.907
  212    HA   VAL 670           HA       VAL 670  -3.482   0.308  -4.867
  213    HB   VAL 670           HB       VAL 670  -3.242   3.065  -3.655
  214   HG11  VAL 670          1HG1      VAL 670  -5.576   1.721  -4.132
  215   HG12  VAL 670          2HG1      VAL 670  -5.177   1.213  -2.491
  216   HG13  VAL 670          3HG1      VAL 670  -5.331   2.928  -2.868
  217   HG21  VAL 670          3HG2      VAL 670  -2.530   2.094  -1.698
  218   HG22  VAL 670          1HG2      VAL 670  -3.227   0.523  -2.095
  219   HG23  VAL 670          2HG2      VAL 670  -1.751   1.060  -2.895
  220    H    THR 671           H        THR 671  -4.648   0.176  -6.701
  221    HA   THR 671           HA       THR 671  -5.515   2.576  -8.094
  222    HB   THR 671           HB       THR 671  -6.707  -0.103  -8.699
  223    HG1  THR 671           1HG      THR 671  -4.002   0.628  -9.324
  224   HG21  THR 671          3HG2      THR 671  -6.070   2.421 -10.102
  225   HG22  THR 671          1HG2      THR 671  -7.443   1.328 -10.294
  226   HG23  THR 671          2HG2      THR 671  -5.893   0.941 -11.042
  227    H    VAL 672           H        VAL 672  -7.411   3.601  -7.696
  228    HA   VAL 672           HA       VAL 672  -9.157   2.418  -5.661
  229    HB   VAL 672           HB       VAL 672  -9.659   5.171  -6.662
  230   HG11  VAL 672          1HG1      VAL 672 -10.375   3.553  -4.440
  231   HG12  VAL 672          2HG1      VAL 672  -9.484   4.949  -3.840
  232   HG13  VAL 672          3HG1      VAL 672 -10.923   5.184  -4.833
  233   HG21  VAL 672          3HG2      VAL 672  -7.404   4.627  -4.741
  234   HG22  VAL 672          1HG2      VAL 672  -7.155   4.965  -6.453
  235   HG23  VAL 672          2HG2      VAL 672  -7.899   6.180  -5.411
  236    H    ILE 673           H        ILE 673 -11.264   1.930  -6.009
  237    HA   ILE 673           HA       ILE 673 -12.273   2.288  -8.755
  238    HB   ILE 673           HB       ILE 673 -12.839   0.129  -6.722
  239   HG12  ILE 673          2HG1      ILE 673 -12.297  -1.070  -9.123
  240   HG13  ILE 673          1HG1      ILE 673 -11.277   0.361  -9.208
  241   HG21  ILE 673          1HG2      ILE 673 -14.849   1.111  -8.098
  242   HG22  ILE 673          2HG2      ILE 673 -14.154   0.131  -9.391
  243   HG23  ILE 673          3HG2      ILE 673 -14.660  -0.630  -7.882
  244   HD11  ILE 673          3HD1      ILE 673  -9.876  -1.207  -8.269
  245   HD12  ILE 673          1HD1      ILE 673 -10.495  -0.362  -6.850
  246   HD13  ILE 673          2HD1      ILE 673 -11.162  -1.930  -7.304
  247    H    ASP 674           H        ASP 674 -14.156   3.344  -9.062
  248    HA   ASP 674           HA       ASP 674 -15.220   4.810  -6.798
  249    HB2  ASP 674           2HB      ASP 674 -14.722   5.724  -9.178
  250    HB3  ASP 674           1HB      ASP 674 -16.261   4.993  -9.617
  251    H    THR 675           H        THR 675 -16.256   3.106  -5.658
  252    HA   THR 675           HA       THR 675 -18.418   1.649  -6.862
  253    HB   THR 675           HB       THR 675 -18.545   1.693  -3.984
  254    HG1  THR 675           1HG      THR 675 -16.489   1.220  -3.454
  255   HG21  THR 675          3HG2      THR 675 -17.464  -0.609  -5.537
  256   HG22  THR 675          1HG2      THR 675 -19.120  -0.088  -5.850
  257   HG23  THR 675          2HG2      THR 675 -18.644  -0.584  -4.227
  258    H    LYS 676           H        LYS 676 -19.364   3.805  -7.615
  259    HA   LYS 676           HA       LYS 676 -21.032   5.057  -5.564
  260    HB2  LYS 676           2HB      LYS 676 -19.702   6.279  -7.457
  261    HB3  LYS 676           1HB      LYS 676 -21.073   5.823  -8.461
  262    HG2  LYS 676           2HG      LYS 676 -22.575   7.074  -7.133
  263    HG3  LYS 676           1HG      LYS 676 -21.361   7.330  -5.878
  264    HD2  LYS 676           2HD      LYS 676 -20.879   8.298  -8.669
  265    HD3  LYS 676           1HD      LYS 676 -21.874   9.240  -7.559
  266    HE2  LYS 676           2HE      LYS 676 -20.031  10.092  -6.666
  267    HE3  LYS 676           1HE      LYS 676 -19.566   8.478  -6.132
  268    HZ1  LYS 676           3HZ      LYS 676 -18.283   8.138  -8.039
  269    HZ2  LYS 676           1HZ      LYS 676 -17.929   9.731  -7.573
  270    HZ3  LYS 676           2HZ      LYS 676 -18.984   9.444  -8.869
  271    H    ASP 677           H        ASP 677 -21.177   2.537  -7.722
  272    HA   ASP 677           HA       ASP 677 -23.863   2.718  -8.628
  273    HB2  ASP 677           2HB      ASP 677 -21.671   0.969  -9.038
  274    HB3  ASP 677           1HB      ASP 677 -23.017  -0.014  -8.465
  275    H    GLY 678           H        GLY 678 -25.265   3.062  -7.008
  276    HA2  GLY 678           1HA      GLY 678 -26.679   1.350  -5.638
  277    HA3  GLY 678           2HA      GLY 678 -25.217   1.319  -4.659
  278    H    SER 679           H        SER 679 -24.612   4.128  -5.101
  279    HA   SER 679           HA       SER 679 -26.286   5.253  -3.049
  280    HB2  SER 679           2HB      SER 679 -24.176   6.687  -4.672
  281    HB3  SER 679           1HB      SER 679 -24.755   7.091  -3.055
  282    HG   SER 679           HG       SER 679 -23.846   5.093  -2.336
  283    H    GLN 680           H        GLN 680 -26.148   5.295  -6.491
  284    HA   GLN 680           HA       GLN 680 -27.961   7.584  -6.669
  285    HB2  GLN 680           2HB      GLN 680 -26.922   6.044  -9.031
  286    HB3  GLN 680           1HB      GLN 680 -27.433   7.723  -8.947
  287    HG2  GLN 680           2HG      GLN 680 -25.225   7.340  -7.184
  288    HG3  GLN 680           1HG      GLN 680 -24.824   6.679  -8.768
  289   HE21  GLN 680          1HE2      GLN 680 -24.639   8.040 -10.515
  290   HE22  GLN 680          2HE2      GLN 680 -24.607   9.771 -10.354
  291    H    SER 681           H        SER 681 -30.046   7.134  -6.469
  292    HA   SER 681           HA       SER 681 -31.093   4.506  -6.865
  293    HB2  SER 681           2HB      SER 681 -33.123   6.561  -6.689
  294    HB3  SER 681           1HB      SER 681 -32.723   5.290  -5.532
  295    HG   SER 681           HG       SER 681 -31.874   6.798  -4.350
  296    H    LYS 682           H        LYS 682 -30.981   7.462  -8.754
  297    HA   LYS 682           HA       LYS 682 -32.941   6.519 -10.663
  298    HB2  LYS 682           2HB      LYS 682 -31.301   8.989 -10.341
  299    HB3  LYS 682           1HB      LYS 682 -31.951   8.616 -11.931
  300    HG2  LYS 682           2HG      LYS 682 -34.077   9.057 -11.320
  301    HG3  LYS 682           1HG      LYS 682 -33.845   8.472  -9.673
  302    HD2  LYS 682           2HD      LYS 682 -32.310  10.592  -9.473
  303    HD3  LYS 682           1HD      LYS 682 -33.277  11.161 -10.834
  304    HE2  LYS 682           2HE      LYS 682 -34.918  11.716  -9.453
  305    HE3  LYS 682           1HE      LYS 682 -35.032  10.045  -8.902
  306    HZ1  LYS 682           3HZ      LYS 682 -33.203  10.562  -7.319
  307    HZ2  LYS 682           1HZ      LYS 682 -34.634  11.425  -7.025
  308    HZ3  LYS 682           2HZ      LYS 682 -33.323  12.193  -7.772
  309    H    LEU 683           H        LEU 683 -29.523   6.436 -10.255
  310    HA   LEU 683           HA       LEU 683 -29.236   5.089 -12.841
  311    HB2  LEU 683           2HB      LEU 683 -26.967   6.789 -11.966
  312    HB3  LEU 683           1HB      LEU 683 -27.512   6.399 -13.585
  313    HG   LEU 683           HG       LEU 683 -29.549   7.993 -12.601
  314   HD11  LEU 683          1HD1      LEU 683 -27.158   8.534 -11.100
  315   HD12  LEU 683          2HD1      LEU 683 -27.607   9.932 -12.076
  316   HD13  LEU 683          3HD1      LEU 683 -28.767   9.237 -10.943
  317   HD21  LEU 683          3HD2      LEU 683 -27.329   8.222 -14.523
  318   HD22  LEU 683          1HD2      LEU 683 -29.058   8.501 -14.738
  319   HD23  LEU 683          2HD2      LEU 683 -28.048   9.746 -14.002
  320    H    GLY 684           H        GLY 684 -29.352   3.224 -11.349
  321    HA2  GLY 684           1HA      GLY 684 -26.672   2.519 -10.456
  322    HA3  GLY 684           2HA      GLY 684 -27.914   2.546  -9.215
  323    H    GLY 685           H        GLY 685 -26.237   0.393 -10.588
  324    HA2  GLY 685           1HA      GLY 685 -26.775  -1.908 -10.548
  325    HA3  GLY 685           2HA      GLY 685 -28.469  -1.495 -10.771
  326    H    GLY 901           H        GLY 901 -27.089  -3.488 -12.235
  327    HA2  GLY 901           1HA      GLY 901 -27.589  -2.462 -14.914
  328    HA3  GLY 901           2HA      GLY 901 -25.961  -3.056 -14.608
  329    H    GLY 902           H        GLY 902 -29.368  -3.944 -14.636
  330    HA2  GLY 902           1HA      GLY 902 -30.192  -5.987 -15.521
  331    HA3  GLY 902           2HA      GLY 902 -28.591  -6.692 -15.313
  332    H    SER 903           H        SER 903 -28.928  -5.117 -12.581
  333    HA   SER 903           HA       SER 903 -29.700  -7.435 -11.073
  334    HB2  SER 903           2HB      SER 903 -29.398  -5.039  -9.492
  335    HB3  SER 903           1HB      SER 903 -28.384  -6.482  -9.525
  336    HG   SER 903           HG       SER 903 -26.968  -5.237 -10.445
  337    H    GLY 904           H        GLY 904 -31.359  -4.886 -12.470
  338    HA2  GLY 904           1HA      GLY 904 -33.587  -4.304 -12.376
  339    HA3  GLY 904           2HA      GLY 904 -33.818  -5.584 -11.192
  340    H    GLY 905           H        GLY 905 -34.482  -4.905  -9.286
  341    HA2  GLY 905           1HA      GLY 905 -33.864  -2.130  -8.500
  342    HA3  GLY 905           2HA      GLY 905 -35.228  -3.074  -7.914
  343    H    HIS 906           H        HIS 906 -32.409  -4.888  -8.128
  344    HA   HIS 906           HA       HIS 906 -32.112  -4.861  -5.220
  345    HB2  HIS 906           2HB      HIS 906 -31.896  -6.853  -7.282
  346    HB3  HIS 906           1HB      HIS 906 -30.369  -6.759  -6.413
  347    HD1  HIS 906           1HD      HIS 906 -31.171  -9.278  -5.661
  348    HD2  HIS 906           2HD      HIS 906 -33.247  -6.041  -4.075
  349    HE1  HIS 906           1HE      HIS 906 -32.410 -10.149  -3.630
  350    H    MET 907           H        MET 907 -30.085  -4.603  -4.206
  351    HA   MET 907           HA       MET 907 -28.281  -2.796  -5.511
  352    HB2  MET 907           2HB      MET 907 -26.974  -2.979  -3.385
  353    HB3  MET 907           1HB      MET 907 -28.648  -2.497  -3.160
  354    HG2  MET 907           2HG      MET 907 -29.128  -4.302  -1.934
  355    HG3  MET 907           1HG      MET 907 -28.237  -5.382  -3.005
  356    HE1  MET 907           3HE      MET 907 -28.502  -6.115  -0.488
  357    HE2  MET 907           1HE      MET 907 -26.865  -6.652  -0.108
  358    HE3  MET 907           2HE      MET 907 -27.625  -5.386   0.857
  359    H    GLY 908           H        GLY 908 -28.121  -4.674  -7.223
  360    HA2  GLY 908           1HA      GLY 908 -26.005  -6.570  -6.462
  361    HA3  GLY 908           2HA      GLY 908 -27.081  -6.736  -7.841
  362    H    SER 909           H        SER 909 -24.589  -4.513  -6.590
  363    HA   SER 909           HA       SER 909 -23.752  -3.753  -9.227
  364    HB2  SER 909           2HB      SER 909 -21.862  -3.346  -6.994
  365    HB3  SER 909           1HB      SER 909 -22.510  -2.180  -8.150
  366    HG   SER 909           HG       SER 909 -23.560  -1.558  -6.405
  367    H    GLY 910           H        GLY 910 -23.609  -6.076  -9.878
  368    HA2  GLY 910           1HA      GLY 910 -21.949  -7.572 -10.727
  369    HA3  GLY 910           2HA      GLY 910 -20.924  -7.159  -9.356
  370    H    GLY 911           H        GLY 911 -23.276  -7.308  -7.563
  371    HA2  GLY 911           1HA      GLY 911 -24.711  -9.585  -7.443
  372    HA3  GLY 911           2HA      GLY 911 -23.111 -10.119  -6.939
  373    H    LEU  18           H        LEU  18 -25.200 -10.345  -5.190
  374    HA   LEU  18           HA       LEU  18 -25.342  -8.075  -3.441
  375    HB2  LEU  18           2HB      LEU  18 -26.805 -10.402  -3.782
  376    HB3  LEU  18           1HB      LEU  18 -26.013 -10.639  -2.234
  377    HG   LEU  18           HG       LEU  18 -27.054  -8.008  -2.213
  378   HD11  LEU  18          1HD1      LEU  18 -28.512  -8.630  -4.051
  379   HD12  LEU  18          2HD1      LEU  18 -29.063 -10.048  -3.158
  380   HD13  LEU  18          3HD1      LEU  18 -29.440  -8.428  -2.565
  381   HD21  LEU  18          3HD2      LEU  18 -28.675  -9.268  -0.554
  382   HD22  LEU  18          1HD2      LEU  18 -27.517 -10.577  -0.793
  383   HD23  LEU  18          2HD2      LEU  18 -26.970  -9.021  -0.168
  384    H    SER  19           H        SER  19 -23.043 -10.438  -3.995
  385    HA   SER  19           HA       SER  19 -21.906 -10.378  -1.326
  386    HB2  SER  19           2HB      SER  19 -20.113 -11.486  -3.254
  387    HB3  SER  19           1HB      SER  19 -21.019 -12.328  -1.997
  388    HG   SER  19           HG       SER  19 -22.088 -13.185  -3.585
  389    H    TRP  20           H        TRP  20 -22.006  -8.425  -3.965
  390    HA   TRP  20           HA       TRP  20 -20.836  -6.659  -4.764
  391    HB2  TRP  20           2HB      TRP  20 -19.483  -6.504  -2.074
  392    HB3  TRP  20           1HB      TRP  20 -19.865  -5.187  -3.176
  393    HD1  TRP  20           HD       TRP  20 -22.926  -5.631  -3.641
  394    HE1  TRP  20           1HE      TRP  20 -24.606  -5.314  -1.713
  395    HE3  TRP  20           3HE      TRP  20 -19.739  -6.213   0.309
  396    HZ2  TRP  20           2HZ      TRP  20 -24.579  -5.322   1.112
  397    HZ3  TRP  20           3HZ      TRP  20 -20.641  -6.046   2.589
  398    HH2  TRP  20           HH       TRP  20 -23.011  -5.609   2.982
  399    H    LYS  21           H        LYS  21 -18.077  -6.288  -3.159
  400    HA   LYS  21           HA       LYS  21 -16.575  -8.058  -4.963
  401    HB2  LYS  21           2HB      LYS  21 -15.965  -5.278  -3.969
  402    HB3  LYS  21           1HB      LYS  21 -14.725  -6.316  -4.657
  403    HG2  LYS  21           2HG      LYS  21 -17.256  -5.603  -6.112
  404    HG3  LYS  21           1HG      LYS  21 -15.772  -4.658  -6.232
  405    HD2  LYS  21           2HD      LYS  21 -14.960  -6.068  -7.749
  406    HD3  LYS  21           1HD      LYS  21 -15.159  -7.424  -6.638
  407    HE2  LYS  21           2HE      LYS  21 -17.482  -7.675  -7.356
  408    HE3  LYS  21           1HE      LYS  21 -17.301  -6.303  -8.449
  409    HZ1  LYS  21           3HZ      LYS  21 -17.092  -8.552  -9.494
  410    HZ2  LYS  21           1HZ      LYS  21 -15.644  -8.763  -8.638
  411    HZ3  LYS  21           2HZ      LYS  21 -15.781  -7.516  -9.782
  412    H    ARG  22           H        ARG  22 -15.356  -9.534  -4.048
  413    HA   ARG  22           HA       ARG  22 -15.382 -10.000  -1.274
  414    HB2  ARG  22           2HB      ARG  22 -14.501 -11.337  -3.628
  415    HB3  ARG  22           1HB      ARG  22 -13.185 -11.368  -2.461
  416    HG2  ARG  22           2HG      ARG  22 -14.658 -13.338  -2.331
  417    HG3  ARG  22           1HG      ARG  22 -14.597 -12.419  -0.826
  418    HD2  ARG  22           2HD      ARG  22 -16.685 -11.222  -2.030
  419    HD3  ARG  22           1HD      ARG  22 -16.828 -12.844  -2.706
  420    HE   ARG  22           HE       ARG  22 -16.701 -12.351   0.197
  421   HH11  ARG  22          2HH1      ARG  22 -18.124 -13.877  -2.601
  422   HH12  ARG  22          1HH1      ARG  22 -19.289 -14.790  -1.687
  423   HH21  ARG  22          2HH2      ARG  22 -18.192 -13.585   1.429
  424   HH22  ARG  22          1HH2      ARG  22 -19.332 -14.616   0.609
  425    H    CYS  23           H        CYS  23 -13.874  -9.718   0.312
  426    HA   CYS  23           HA       CYS  23 -11.611  -7.985  -0.369
  427    HB2  CYS  23           2HB      CYS  23 -12.041  -6.767   1.473
  428    HB3  CYS  23           1HB      CYS  23 -13.618  -7.533   1.426
  429    H    ALA  24           H        ALA  24  -9.544  -8.463   0.600
  430    HA   ALA  24           HA       ALA  24  -9.233 -11.353   0.405
  431    HB1  ALA  24           1HB      ALA  24  -7.298  -9.088   0.044
  432    HB2  ALA  24           2HB      ALA  24  -6.826 -10.786  -0.009
  433    HB3  ALA  24           3HB      ALA  24  -7.972 -10.155  -1.189
  434    H    GLY  25           H        GLY  25  -7.961  -8.736   2.478
  435    HA2  GLY  25           1HA      GLY  25  -6.311 -10.443   4.026
  436    HA3  GLY  25           2HA      GLY  25  -6.811  -8.816   4.462
  437    H    CYS  26           H        CYS  26  -9.213  -8.711   5.149
  438    HA   CYS  26           HA       CYS  26  -9.623 -10.297   7.414
  439    HB2  CYS  26           2HB      CYS  26 -12.015  -9.136   6.098
  440    HB3  CYS  26           1HB      CYS  26 -11.480  -9.011   7.770
  441    H    GLY  27           H        GLY  27 -11.062 -10.486   4.176
  442    HA2  GLY  27           1HA      GLY  27 -11.387 -12.574   3.076
  443    HA3  GLY  27           2HA      GLY  27 -11.501 -13.353   4.648
  444    H    GLY  28           H        GLY  28 -13.174 -10.512   3.313
  445    HA2  GLY  28           1HA      GLY  28 -15.692 -12.032   3.496
  446    HA3  GLY  28           2HA      GLY  28 -15.559 -10.473   4.300
  447    H    LYS  29           H        LYS  29 -16.275  -8.820   3.217
  448    HA   LYS  29           HA       LYS  29 -15.699  -8.541   0.398
  449    HB2  LYS  29           2HB      LYS  29 -18.174  -7.660   0.165
  450    HB3  LYS  29           1HB      LYS  29 -17.803  -9.360  -0.073
  451    HG2  LYS  29           2HG      LYS  29 -18.320  -9.292   2.596
  452    HG3  LYS  29           1HG      LYS  29 -19.413  -8.045   1.990
  453    HD2  LYS  29           2HD      LYS  29 -19.910  -9.918   0.170
  454    HD3  LYS  29           1HD      LYS  29 -19.391 -10.973   1.486
  455    HE2  LYS  29           2HE      LYS  29 -21.491  -8.839   1.812
  456    HE3  LYS  29           1HE      LYS  29 -21.867 -10.503   1.361
  457    HZ1  LYS  29           3HZ      LYS  29 -21.907 -10.945   3.522
  458    HZ2  LYS  29           1HZ      LYS  29 -21.276  -9.422   3.929
  459    HZ3  LYS  29           2HZ      LYS  29 -20.230 -10.708   3.558
  460    H    ILE  30           H        ILE  30 -15.622  -6.364  -0.230
  461    HA   ILE  30           HA       ILE  30 -14.835  -4.632   1.853
  462    HB   ILE  30           HB       ILE  30 -15.439  -4.000  -1.040
  463   HG12  ILE  30          2HG1      ILE  30 -12.667  -3.891  -0.258
  464   HG13  ILE  30          1HG1      ILE  30 -13.352  -5.454   0.175
  465   HG21  ILE  30          1HG2      ILE  30 -13.704  -2.321   0.727
  466   HG22  ILE  30          2HG2      ILE  30 -14.528  -1.889  -0.774
  467   HG23  ILE  30          3HG2      ILE  30 -15.452  -2.084   0.716
  468   HD11  ILE  30          3HD1      ILE  30 -13.897  -5.960  -2.035
  469   HD12  ILE  30          1HD1      ILE  30 -13.699  -4.286  -2.556
  470   HD13  ILE  30          2HD1      ILE  30 -12.287  -5.242  -2.112
  471    H    ALA  31           H        ALA  31 -16.189  -3.878   3.282
  472    HA   ALA  31           HA       ALA  31 -18.707  -2.698   2.340
  473    HB1  ALA  31           1HB      ALA  31 -19.095  -3.136   5.023
  474    HB2  ALA  31           2HB      ALA  31 -19.685  -4.161   3.714
  475    HB3  ALA  31           3HB      ALA  31 -18.166  -4.551   4.521
  476    H    ASP  32           H        ASP  32 -15.866  -1.705   2.862
  477    HA   ASP  32           HA       ASP  32 -16.228   0.390   4.800
  478    HB2  ASP  32           2HB      ASP  32 -14.136  -0.416   2.852
  479    HB3  ASP  32           1HB      ASP  32 -14.217   1.302   3.221
  480    H    ARG  33           H        ARG  33 -15.494   0.699   1.365
  481    HA   ARG  33           HA       ARG  33 -17.982   1.490   0.456
  482    HB2  ARG  33           2HB      ARG  33 -17.352   3.550   1.908
  483    HB3  ARG  33           1HB      ARG  33 -16.230   3.927   0.604
  484    HG2  ARG  33           2HG      ARG  33 -18.283   3.647  -0.932
  485    HG3  ARG  33           1HG      ARG  33 -19.216   3.839   0.551
  486    HD2  ARG  33           2HD      ARG  33 -17.695   5.933   0.888
  487    HD3  ARG  33           1HD      ARG  33 -17.452   5.794  -0.852
  488    HE   ARG  33           HE       ARG  33 -19.758   6.210  -1.191
  489   HH11  ARG  33          2HH1      ARG  33 -18.779   6.438   2.166
  490   HH12  ARG  33          1HH1      ARG  33 -20.183   7.340   2.653
  491   HH21  ARG  33          2HH2      ARG  33 -21.614   7.394  -0.554
  492   HH22  ARG  33          1HH2      ARG  33 -21.800   7.884   1.105
  493    H    PHE  34           H        PHE  34 -14.691   2.761  -0.039
  494    HA   PHE  34           HA       PHE  34 -14.917   2.039  -2.866
  495    HB2  PHE  34           2HB      PHE  34 -13.328   3.999  -1.307
  496    HB3  PHE  34           1HB      PHE  34 -12.530   3.290  -2.707
  497    HD1  PHE  34           1HD      PHE  34 -16.155   3.834  -2.566
  498    HD2  PHE  34           2HD      PHE  34 -12.415   5.333  -3.935
  499    HE1  PHE  34           1HE      PHE  34 -17.330   5.409  -4.041
  500    HE2  PHE  34           2HE      PHE  34 -13.585   6.911  -5.411
  501    HZ   PHE  34           HZ       PHE  34 -16.043   6.948  -5.470
  502    H    LEU  35           H        LEU  35 -13.669   0.521  -3.826
  503    HA   LEU  35           HA       LEU  35 -12.017  -1.105  -2.038
  504    HB2  LEU  35           2HB      LEU  35 -12.032  -2.499  -4.358
  505    HB3  LEU  35           1HB      LEU  35 -13.186  -2.725  -3.062
  506    HG   LEU  35           HG       LEU  35 -13.905  -0.684  -5.076
  507   HD11  LEU  35          1HD1      LEU  35 -12.841  -2.896  -6.142
  508   HD12  LEU  35          2HD1      LEU  35 -14.487  -3.469  -5.872
  509   HD13  LEU  35          3HD1      LEU  35 -14.203  -2.039  -6.864
  510   HD21  LEU  35          3HD2      LEU  35 -15.530  -2.980  -4.023
  511   HD22  LEU  35          1HD2      LEU  35 -15.275  -1.511  -3.080
  512   HD23  LEU  35          2HD2      LEU  35 -16.088  -1.426  -4.642
  513    H    LEU  36           H        LEU  36  -9.910  -1.625  -2.533
  514    HA   LEU  36           HA       LEU  36  -8.657   0.107  -4.556
  515    HB2  LEU  36           2HB      LEU  36  -6.770  -0.589  -2.559
  516    HB3  LEU  36           1HB      LEU  36  -7.361   1.000  -3.000
  517    HG   LEU  36           HG       LEU  36  -9.148  -0.528  -1.234
  518   HD11  LEU  36          1HD1      LEU  36  -7.501   0.395   0.664
  519   HD12  LEU  36          2HD1      LEU  36  -7.435  -1.257   0.048
  520   HD13  LEU  36          3HD1      LEU  36  -6.314  -0.040  -0.565
  521   HD21  LEU  36          3HD2      LEU  36  -8.249   2.252  -1.696
  522   HD22  LEU  36          1HD2      LEU  36  -9.866   1.616  -1.397
  523   HD23  LEU  36          2HD2      LEU  36  -8.743   1.838  -0.054
  524    H    TYR  37           H        TYR  37  -6.375  -0.693  -5.065
  525    HA   TYR  37           HA       TYR  37  -6.469  -3.610  -5.453
  526    HB2  TYR  37           2HB      TYR  37  -6.277  -1.437  -7.359
  527    HB3  TYR  37           1HB      TYR  37  -4.897  -2.517  -7.493
  528    HD1  TYR  37           1HD      TYR  37  -5.775  -5.138  -7.189
  529    HD2  TYR  37           2HD      TYR  37  -7.916  -1.878  -8.877
  530    HE1  TYR  37           1HE      TYR  37  -7.137  -6.715  -8.488
  531    HE2  TYR  37           2HE      TYR  37  -9.285  -3.439 -10.179
  532    HH   TYR  37           HH       TYR  37  -8.718  -6.955 -10.008
  533    H    ALA  38           H        ALA  38  -4.526  -4.727  -5.378
  534    HA   ALA  38           HA       ALA  38  -2.077  -3.235  -4.808
  535    HB1  ALA  38           1HB      ALA  38  -3.345  -5.272  -3.018
  536    HB2  ALA  38           2HB      ALA  38  -1.592  -5.086  -3.049
  537    HB3  ALA  38           3HB      ALA  38  -2.616  -3.721  -2.607
  538    H    MET  39           H        MET  39  -2.451  -6.675  -4.336
  539    HA   MET  39           HA       MET  39  -0.634  -7.296  -6.454
  540    HB2  MET  39           2HB      MET  39  -2.414  -9.089  -4.793
  541    HB3  MET  39           1HB      MET  39  -1.175  -9.663  -5.898
  542    HG2  MET  39           2HG      MET  39  -0.003  -9.757  -3.966
  543    HG3  MET  39           1HG      MET  39   0.347  -8.086  -4.411
  544    HE1  MET  39           3HE      MET  39  -1.565 -10.183  -1.287
  545    HE2  MET  39           1HE      MET  39   0.068 -10.169  -1.953
  546    HE3  MET  39           2HE      MET  39  -0.321  -9.178  -0.547
  547    H    ASP  40           H        ASP  40  -3.750  -8.887  -6.017
  548    HA   ASP  40           HA       ASP  40  -4.722  -7.908  -8.584
  549    HB2  ASP  40           2HB      ASP  40  -4.997 -10.018  -9.596
  550    HB3  ASP  40           1HB      ASP  40  -3.372 -10.067  -8.922
  551    H    SER  41           H        SER  41  -5.262  -8.385  -5.452
  552    HA   SER  41           HA       SER  41  -7.996  -9.374  -5.691
  553    HB2  SER  41           2HB      SER  41  -7.097  -8.655  -3.016
  554    HB3  SER  41           1HB      SER  41  -7.676 -10.208  -3.627
  555    HG   SER  41           HG       SER  41  -5.662 -10.789  -4.146
  556    H    TYR  42           H        TYR  42  -9.622  -8.248  -4.274
  557    HA   TYR  42           HA       TYR  42  -9.411  -5.350  -4.636
  558    HB2  TYR  42           2HB      TYR  42 -11.805  -7.029  -3.843
  559    HB3  TYR  42           1HB      TYR  42 -11.822  -5.307  -4.202
  560    HD1  TYR  42           2HD      TYR  42 -11.010  -4.639  -6.603
  561    HD2  TYR  42           1HD      TYR  42 -12.296  -8.549  -5.517
  562    HE1  TYR  42           2HE      TYR  42 -11.476  -5.136  -8.964
  563    HE2  TYR  42           1HE      TYR  42 -12.767  -9.057  -7.876
  564    HH   TYR  42           HH       TYR  42 -12.272  -8.355 -10.050
  565    H    TRP  43           H        TRP  43  -9.055  -4.048  -2.938
  566    HA   TRP  43           HA       TRP  43  -9.229  -5.251  -0.248
  567    HB2  TRP  43           2HB      TRP  43  -7.214  -3.158  -1.084
  568    HB3  TRP  43           1HB      TRP  43  -7.238  -4.089   0.408
  569    HD1  TRP  43           HD       TRP  43  -6.616  -4.603  -3.375
  570    HE1  TRP  43           1HE      TRP  43  -5.035  -6.607  -3.658
  571    HE3  TRP  43           3HE      TRP  43  -6.262  -6.069   1.513
  572    HZ2  TRP  43           2HZ      TRP  43  -3.793  -8.541  -2.039
  573    HZ3  TRP  43           3HZ      TRP  43  -4.844  -8.007   2.056
  574    HH2  TRP  43           HH       TRP  43  -3.635  -9.217   0.313
  575    H    HIS  44           H        HIS  44  -8.995  -3.378   1.424
  576    HA   HIS  44           HA       HIS  44 -10.250  -0.890   0.664
  577    HB2  HIS  44           2HB      HIS  44 -11.996  -1.069   2.480
  578    HB3  HIS  44           1HB      HIS  44 -12.268  -2.150   1.117
  579    HD1  HIS  44           1HD      HIS  44 -12.688  -2.270   4.588
  580    HD2  HIS  44           2HD      HIS  44 -10.712  -4.731   1.876
  581    HE1  HIS  44           1HE      HIS  44 -12.379  -4.534   5.734
  582    H    SER  45           H        SER  45 -10.646   0.240   3.091
  583    HA   SER  45           HA       SER  45  -8.071   0.954   3.823
  584    HB2  SER  45           2HB      SER  45  -9.877   1.454   5.995
  585    HB3  SER  45           1HB      SER  45  -9.209   2.593   4.825
  586    HG   SER  45           HG       SER  45 -11.596   1.061   4.640
  587    H    ARG  46           H        ARG  46 -10.154  -1.523   5.195
  588    HA   ARG  46           HA       ARG  46  -8.355  -1.913   7.456
  589    HB2  ARG  46           2HB      ARG  46 -11.114  -2.263   7.022
  590    HB3  ARG  46           1HB      ARG  46 -10.454  -3.873   7.280
  591    HG2  ARG  46           2HG      ARG  46  -9.519  -1.821   9.159
  592    HG3  ARG  46           1HG      ARG  46 -11.237  -2.216   9.257
  593    HD2  ARG  46           2HD      ARG  46 -10.577  -4.632   9.362
  594    HD3  ARG  46           1HD      ARG  46  -8.902  -4.103   9.513
  595    HE   ARG  46           HE       ARG  46  -9.645  -2.916  11.577
  596   HH11  ARG  46          2HH1      ARG  46 -11.451  -5.670  10.367
  597   HH12  ARG  46          1HH1      ARG  46 -12.074  -6.105  11.932
  598   HH21  ARG  46          2HH2      ARG  46 -10.486  -3.467  13.619
  599   HH22  ARG  46          1HH2      ARG  46 -11.553  -4.832  13.779
  600    H    CYS  47           H        CYS  47  -8.420  -2.995   4.318
  601    HA   CYS  47           HA       CYS  47  -7.479  -5.687   5.018
  602    HB2  CYS  47           2HB      CYS  47  -8.998  -4.661   2.844
  603    HB3  CYS  47           1HB      CYS  47  -7.476  -5.265   2.196
  604    H    LEU  48           H        LEU  48  -6.563  -3.033   2.831
  605    HA   LEU  48           HA       LEU  48  -3.938  -4.077   2.440
  606    HB2  LEU  48           2HB      LEU  48  -5.516  -1.821   1.454
  607    HB3  LEU  48           1HB      LEU  48  -3.816  -1.447   1.648
  608    HG   LEU  48           HG       LEU  48  -5.099  -3.437  -0.189
  609   HD11  LEU  48          1HD1      LEU  48  -3.506  -2.336  -1.782
  610   HD12  LEU  48          2HD1      LEU  48  -4.764  -1.283  -1.131
  611   HD13  LEU  48          3HD1      LEU  48  -3.122  -1.192  -0.496
  612   HD21  LEU  48          3HD2      LEU  48  -3.307  -4.783  -0.325
  613   HD22  LEU  48          1HD2      LEU  48  -2.167  -3.458  -0.076
  614   HD23  LEU  48          2HD2      LEU  48  -2.969  -4.202   1.308
  615    H    LYS  49           H        LYS  49  -3.152  -4.274   4.548
  616    HA   LYS  49           HA       LYS  49  -1.875  -1.821   5.463
  617    HB2  LYS  49           2HB      LYS  49  -2.317  -3.011   7.868
  618    HB3  LYS  49           1HB      LYS  49  -3.296  -1.705   7.220
  619    HG2  LYS  49           2HG      LYS  49  -4.997  -3.083   7.646
  620    HG3  LYS  49           1HG      LYS  49  -4.530  -3.855   6.130
  621    HD2  LYS  49           2HD      LYS  49  -3.415  -5.591   7.222
  622    HD3  LYS  49           1HD      LYS  49  -3.300  -4.689   8.734
  623    HE2  LYS  49           2HE      LYS  49  -5.030  -6.008   9.332
  624    HE3  LYS  49           1HE      LYS  49  -5.972  -4.798   8.462
  625    HZ1  LYS  49           3HZ      LYS  49  -6.732  -6.686   7.483
  626    HZ2  LYS  49           1HZ      LYS  49  -5.275  -7.533   7.686
  627    HZ3  LYS  49           2HZ      LYS  49  -5.420  -6.373   6.455
  628    H    CYS  50           H        CYS  50   0.159  -2.138   6.256
  629    HA   CYS  50           HA       CYS  50   1.642  -4.352   5.496
  630    HB2  CYS  50           2HB      CYS  50   2.716  -2.259   6.005
  631    HB3  CYS  50           1HB      CYS  50   2.116  -2.292   7.658
  632    H    SER  51           H        SER  51   2.045  -6.301   6.389
  633    HA   SER  51           HA       SER  51   0.297  -7.188   8.454
  634    HB2  SER  51           2HB      SER  51   2.639  -8.806   7.528
  635    HB3  SER  51           1HB      SER  51   1.004  -9.334   7.928
  636    HG   SER  51           HG       SER  51   0.817  -7.637   5.899
  637    H    SER  52           H        SER  52   3.326  -5.684   8.509
  638    HA   SER  52           HA       SER  52   4.150  -7.031  10.966
  639    HB2  SER  52           2HB      SER  52   5.954  -4.964  10.031
  640    HB3  SER  52           1HB      SER  52   6.248  -6.688  10.270
  641    HG   SER  52           HG       SER  52   5.131  -5.412   7.984
  642    H    CYS  53           H        CYS  53   3.673  -3.657   9.803
  643    HA   CYS  53           HA       CYS  53   3.551  -2.892  12.644
  644    HB2  CYS  53           2HB      CYS  53   4.293  -0.675  12.045
  645    HB3  CYS  53           1HB      CYS  53   5.410  -1.849  11.366
  646    H    GLN  54           H        GLN  54   1.649  -3.509  10.091
  647    HA   GLN  54           HA       GLN  54  -0.508  -3.177   9.563
  648    HB2  GLN  54           2HB      GLN  54  -0.465  -2.495  12.467
  649    HB3  GLN  54           1HB      GLN  54  -1.929  -2.182  11.544
  650    HG2  GLN  54           2HG      GLN  54  -1.038  -4.787  10.887
  651    HG3  GLN  54           1HG      GLN  54  -1.003  -4.630  12.641
  652   HE21  GLN  54          1HE2      GLN  54  -3.240  -2.846  10.634
  653   HE22  GLN  54          2HE2      GLN  54  -4.661  -3.684  11.149
  654    H    ALA  55           H        ALA  55   1.338  -1.137   8.848
  655    HA   ALA  55           HA       ALA  55   0.136   1.418   9.100
  656    HB1  ALA  55           1HB      ALA  55   1.818   0.470   6.787
  657    HB2  ALA  55           2HB      ALA  55   1.618   2.118   7.378
  658    HB3  ALA  55           3HB      ALA  55   2.498   0.933   8.346
  659    H    GLN  56           H        GLN  56  -1.631   2.218   8.138
  660    HA   GLN  56           HA       GLN  56  -3.214   0.371   6.581
  661    HB2  GLN  56           2HB      GLN  56  -3.717   3.005   7.911
  662    HB3  GLN  56           1HB      GLN  56  -4.850   2.416   6.703
  663    HG2  GLN  56           2HG      GLN  56  -4.865   0.246   8.085
  664    HG3  GLN  56           1HG      GLN  56  -4.153   1.231   9.358
  665   HE21  GLN  56          1HE2      GLN  56  -6.963   0.758   7.341
  666   HE22  GLN  56          2HE2      GLN  56  -8.068   1.643   8.345
  667    H    LEU  57           H        LEU  57  -1.851   0.330   4.716
  668    HA   LEU  57           HA       LEU  57  -1.464   2.607   3.060
  669    HB2  LEU  57           2HB      LEU  57  -1.530  -0.197   2.006
  670    HB3  LEU  57           1HB      LEU  57  -0.522   1.143   1.498
  671    HG   LEU  57           HG       LEU  57   0.005   0.433   4.256
  672   HD11  LEU  57          1HD1      LEU  57   1.087  -1.729   3.790
  673   HD12  LEU  57          2HD1      LEU  57  -0.668  -1.796   3.617
  674   HD13  LEU  57          3HD1      LEU  57   0.356  -1.726   2.184
  675   HD21  LEU  57          3HD2      LEU  57   1.761   0.357   1.809
  676   HD22  LEU  57          1HD2      LEU  57   1.449   1.793   2.787
  677   HD23  LEU  57          2HD2      LEU  57   2.288   0.410   3.494
  678    H    GLY  58           H        GLY  58  -4.187   0.764   3.745
  679    HA2  GLY  58           1HA      GLY  58  -5.574   0.994   1.278
  680    HA3  GLY  58           2HA      GLY  58  -6.301   0.704   2.853
  681    H    ASP  59           H        ASP  59  -5.029   3.201   3.920
  682    HA   ASP  59           HA       ASP  59  -6.954   5.078   2.787
  683    HB2  ASP  59           2HB      ASP  59  -7.151   4.808   5.189
  684    HB3  ASP  59           1HB      ASP  59  -5.435   5.150   5.389
  685    H    ILE  60           H        ILE  60  -3.658   4.605   3.476
  686    HA   ILE  60           HA       ILE  60  -2.920   7.025   1.985
  687    HB   ILE  60           HB       ILE  60  -0.901   5.315   3.393
  688   HG12  ILE  60          2HG1      ILE  60  -2.084   7.588   4.903
  689   HG13  ILE  60          1HG1      ILE  60  -3.024   6.102   4.834
  690   HG21  ILE  60          1HG2      ILE  60  -0.591   8.161   3.640
  691   HG22  ILE  60          2HG2      ILE  60   0.470   6.983   2.868
  692   HG23  ILE  60          3HG2      ILE  60  -0.850   7.718   1.953
  693   HD11  ILE  60          3HD1      ILE  60  -0.314   6.548   6.016
  694   HD12  ILE  60          1HD1      ILE  60  -1.772   5.931   6.790
  695   HD13  ILE  60          2HD1      ILE  60  -0.901   4.931   5.627
  696    H    GLY  61           H        GLY  61  -3.213   6.311  -0.104
  697    HA2  GLY  61           1HA      GLY  61  -2.529   3.652  -0.904
  698    HA3  GLY  61           2HA      GLY  61  -3.100   4.940  -1.948
  699    H    THR  62           H        THR  62  -0.200   4.088  -0.073
  700    HA   THR  62           HA       THR  62   1.448   5.107  -2.276
  701    HB   THR  62           HB       THR  62   2.718   4.078   0.208
  702    HG1  THR  62           1HG      THR  62   0.714   5.907   0.236
  703   HG21  THR  62          3HG2      THR  62   3.822   6.466  -0.229
  704   HG22  THR  62          1HG2      THR  62   3.188   6.178  -1.848
  705   HG23  THR  62          2HG2      THR  62   4.319   5.032  -1.128
  706    H    SER  63           H        SER  63   3.051   3.804  -3.237
  707    HA   SER  63           HA       SER  63   2.296   1.160  -3.756
  708    HB2  SER  63           2HB      SER  63   5.126   1.830  -4.241
  709    HB3  SER  63           1HB      SER  63   3.893   1.251  -5.360
  710    HG   SER  63           HG       SER  63   3.110   3.317  -5.590
  711    H    SER  64           H        SER  64   2.338  -0.431  -2.341
  712    HA   SER  64           HA       SER  64   4.363  -0.575  -0.262
  713    HB2  SER  64           2HB      SER  64   2.524  -2.838  -0.480
  714    HB3  SER  64           1HB      SER  64   2.816  -1.753   0.882
  715    HG   SER  64           HG       SER  64   1.527  -0.191  -0.449
  716    H    TYR  65           H        TYR  65   4.937  -3.164   0.093
  717    HA   TYR  65           HA       TYR  65   6.061  -4.018  -2.495
  718    HB2  TYR  65           2HB      TYR  65   7.478  -3.852   0.169
  719    HB3  TYR  65           1HB      TYR  65   8.122  -4.699  -1.235
  720    HD1  TYR  65           1HD      TYR  65   8.560  -3.351  -3.346
  721    HD2  TYR  65           2HD      TYR  65   7.788  -1.540   0.427
  722    HE1  TYR  65           1HE      TYR  65   9.564  -1.260  -4.150
  723    HE2  TYR  65           2HE      TYR  65   8.793   0.558  -0.371
  724    HH   TYR  65           HH       TYR  65   9.926   1.551  -2.020
  725    H    THR  66           H        THR  66   6.314  -6.188  -2.826
  726    HA   THR  66           HA       THR  66   5.487  -8.015  -0.688
  727    HB   THR  66           HB       THR  66   3.657  -7.500  -2.486
  728    HG1  THR  66           1HG      THR  66   3.594  -9.179  -0.884
  729   HG21  THR  66          3HG2      THR  66   5.706  -8.841  -4.079
  730   HG22  THR  66          1HG2      THR  66   4.287  -7.929  -4.597
  731   HG23  THR  66          2HG2      THR  66   4.132  -9.632  -4.171
  732    H    LYS  67           H        LYS  67   5.977 -10.363  -1.451
  733    HA   LYS  67           HA       LYS  67   8.050 -10.694  -3.378
  734    HB2  LYS  67           2HB      LYS  67   8.910  -9.933  -0.823
  735    HB3  LYS  67           1HB      LYS  67   9.189 -11.670  -0.905
  736    HG2  LYS  67           2HG      LYS  67  10.387 -11.284  -3.068
  737    HG3  LYS  67           1HG      LYS  67  10.253  -9.553  -2.759
  738    HD2  LYS  67           2HD      LYS  67  11.688  -9.639  -0.940
  739    HD3  LYS  67           1HD      LYS  67  11.433 -11.368  -0.696
  740    HE2  LYS  67           2HE      LYS  67  12.916 -11.961  -2.321
  741    HE3  LYS  67           1HE      LYS  67  12.645 -10.492  -3.258
  742    HZ1  LYS  67           3HZ      LYS  67  14.744 -10.179  -2.420
  743    HZ2  LYS  67           1HZ      LYS  67  14.405 -10.916  -0.934
  744    HZ3  LYS  67           2HZ      LYS  67  13.817  -9.359  -1.268
  745    H    SER  68           H        SER  68   6.898 -12.174  -0.355
  746    HA   SER  68           HA       SER  68   6.426 -14.648  -1.874
  747    HB2  SER  68           2HB      SER  68   6.950 -14.558   1.091
  748    HB3  SER  68           1HB      SER  68   7.110 -15.925  -0.014
  749    HG   SER  68           HG       SER  68   8.874 -14.792  -0.997
  750    H    GLY  69           H        GLY  69   4.407 -12.873  -1.953
  751    HA2  GLY  69           1HA      GLY  69   2.121 -12.853  -1.661
  752    HA3  GLY  69           2HA      GLY  69   2.284 -14.325  -0.715
  753    H    MET  70           H        MET  70   3.982 -11.390   0.078
  754    HA   MET  70           HA       MET  70   2.146 -10.939   2.328
  755    HB2  MET  70           2HB      MET  70   5.091 -11.399   2.363
  756    HB3  MET  70           1HB      MET  70   4.435 -10.219   3.489
  757    HG2  MET  70           2HG      MET  70   3.900 -11.857   4.866
  758    HG3  MET  70           1HG      MET  70   2.796 -12.504   3.653
  759    HE1  MET  70           3HE      MET  70   6.029 -14.299   5.653
  760    HE2  MET  70           1HE      MET  70   7.019 -13.273   4.614
  761    HE3  MET  70           2HE      MET  70   5.735 -12.561   5.591
  762    H    ILE  71           H        ILE  71   1.523  -8.868   2.538
  763    HA   ILE  71           HA       ILE  71   2.839  -6.864   0.843
  764    HB   ILE  71           HB       ILE  71   0.664  -5.596   1.981
  765   HG12  ILE  71          2HG1      ILE  71  -1.186  -7.301   1.303
  766   HG13  ILE  71          1HG1      ILE  71   0.059  -8.512   1.590
  767   HG21  ILE  71          1HG2      ILE  71   0.118  -6.951  -0.560
  768   HG22  ILE  71          2HG2      ILE  71   0.127  -5.233  -0.162
  769   HG23  ILE  71          3HG2      ILE  71   1.643  -6.070  -0.500
  770   HD11  ILE  71          3HD1      ILE  71  -1.218  -6.632   3.534
  771   HD12  ILE  71          1HD1      ILE  71  -1.097  -8.389   3.599
  772   HD13  ILE  71          2HD1      ILE  71   0.336  -7.396   3.879
  773    H    LEU  72           H        LEU  72   4.385  -5.732   1.802
  774    HA   LEU  72           HA       LEU  72   3.995  -4.938   4.617
  775    HB2  LEU  72           2HB      LEU  72   6.576  -5.631   3.210
  776    HB3  LEU  72           1HB      LEU  72   6.481  -4.937   4.814
  777    HG   LEU  72           HG       LEU  72   6.763  -7.127   5.367
  778   HD11  LEU  72          1HD1      LEU  72   4.527  -8.245   5.755
  779   HD12  LEU  72          2HD1      LEU  72   4.775  -6.662   6.493
  780   HD13  LEU  72          3HD1      LEU  72   3.809  -6.808   5.025
  781   HD21  LEU  72          3HD2      LEU  72   5.559  -8.967   3.971
  782   HD22  LEU  72          1HD2      LEU  72   5.486  -7.707   2.742
  783   HD23  LEU  72          2HD2      LEU  72   7.046  -8.228   3.377
  784    H    CYS  73           H        CYS  73   5.159  -2.935   5.204
  785    HA   CYS  73           HA       CYS  73   4.714  -0.894   3.254
  786    HB2  CYS  73           2HB      CYS  73   5.436   0.647   5.008
  787    HB3  CYS  73           1HB      CYS  73   4.290  -0.524   5.650
  788    H    ARG  74           H        ARG  74   6.621   0.904   3.342
  789    HA   ARG  74           HA       ARG  74   8.612  -0.116   1.637
  790    HB2  ARG  74           2HB      ARG  74   8.728   2.481   3.180
  791    HB3  ARG  74           1HB      ARG  74   9.603   2.087   1.710
  792    HG2  ARG  74           2HG      ARG  74   7.329   1.840   0.602
  793    HG3  ARG  74           1HG      ARG  74   6.669   2.616   2.043
  794    HD2  ARG  74           2HD      ARG  74   8.402   3.739  -0.102
  795    HD3  ARG  74           1HD      ARG  74   6.992   4.439   0.687
  796    HE   ARG  74           HE       ARG  74   9.466   4.139   2.238
  797   HH11  ARG  74          2HH1      ARG  74   7.225   6.259   0.563
  798   HH12  ARG  74          1HH1      ARG  74   7.792   7.687   1.361
  799   HH21  ARG  74          2HH2      ARG  74  10.213   6.006   3.269
  800   HH22  ARG  74          1HH2      ARG  74   9.511   7.553   2.898
  801    H    ASN  75           H        ASN  75   8.579   0.586   5.073
  802    HA   ASN  75           HA       ASN  75  11.414   0.198   5.387
  803    HB2  ASN  75           2HB      ASN  75   9.699   0.049   7.787
  804    HB3  ASN  75           1HB      ASN  75  11.149   1.000   7.498
  805   HD21  ASN  75          1HD2      ASN  75   7.682   0.824   6.874
  806   HD22  ASN  75          2HD2      ASN  75   7.459   2.532   6.676
  807    H    ASP  76           H        ASP  76   8.476  -1.634   6.118
  808    HA   ASP  76           HA       ASP  76   9.868  -3.593   7.664
  809    HB2  ASP  76           2HB      ASP  76   7.082  -3.097   6.864
  810    HB3  ASP  76           1HB      ASP  76   7.499  -4.794   7.100
  811    H    TYR  77           H        TYR  77   9.107  -3.273   4.302
  812    HA   TYR  77           HA       TYR  77   9.324  -5.971   3.559
  813    HB2  TYR  77           2HB      TYR  77   8.507  -4.456   1.915
  814    HB3  TYR  77           1HB      TYR  77   9.929  -3.426   2.053
  815    HD1  TYR  77           2HD      TYR  77   9.326  -7.071   1.433
  816    HD2  TYR  77           1HD      TYR  77  11.277  -3.498   0.189
  817    HE1  TYR  77           2HE      TYR  77  10.401  -8.302  -0.407
  818    HE2  TYR  77           1HE      TYR  77  12.362  -4.722  -1.644
  819    HH   TYR  77           HH       TYR  77  13.016  -7.318  -1.967
  820    H    ILE  78           H        ILE  78  11.774  -3.454   3.974
  821    HA   ILE  78           HA       ILE  78  13.952  -5.089   3.138
  822    HB   ILE  78           HB       ILE  78  14.404  -2.811   5.011
  823   HG12  ILE  78          2HG1      ILE  78  13.796  -2.297   2.108
  824   HG13  ILE  78          1HG1      ILE  78  12.525  -2.232   3.325
  825   HG21  ILE  78          1HG2      ILE  78  16.366  -2.498   3.779
  826   HG22  ILE  78          2HG2      ILE  78  16.177  -4.250   3.856
  827   HG23  ILE  78          3HG2      ILE  78  15.739  -3.379   2.387
  828   HD11  ILE  78          3HD1      ILE  78  13.133  -0.191   3.936
  829   HD12  ILE  78          1HD1      ILE  78  14.817  -0.678   4.129
  830   HD13  ILE  78          2HD1      ILE  78  14.220  -0.173   2.548
  831    H    ARG  79           H        ARG  79  12.372  -4.433   6.182
  832    HA   ARG  79           HA       ARG  79  14.332  -5.655   7.845
  833    HB2  ARG  79           2HB      ARG  79  12.442  -4.009   8.490
  834    HB3  ARG  79           1HB      ARG  79  11.411  -5.433   8.540
  835    HG2  ARG  79           2HG      ARG  79  12.802  -6.428  10.248
  836    HG3  ARG  79           1HG      ARG  79  13.934  -5.078  10.147
  837    HD2  ARG  79           2HD      ARG  79  11.640  -3.743  10.614
  838    HD3  ARG  79           1HD      ARG  79  11.293  -5.253  11.456
  839    HE   ARG  79           HE       ARG  79  13.204  -3.228  12.204
  840   HH11  ARG  79          2HH1      ARG  79  12.256  -6.578  12.556
  841   HH12  ARG  79          1HH1      ARG  79  13.135  -6.806  14.041
  842   HH21  ARG  79          2HH2      ARG  79  14.330  -3.500  14.186
  843   HH22  ARG  79          1HH2      ARG  79  14.288  -5.048  14.984
  844    H    LEU  80           H        LEU  80  11.447  -6.784   6.184
  845    HA   LEU  80           HA       LEU  80  11.529  -9.380   7.422
  846    HB2  LEU  80           2HB      LEU  80   9.793  -7.975   5.488
  847    HB3  LEU  80           1HB      LEU  80   9.887  -9.713   5.296
  848    HG   LEU  80           HG       LEU  80   8.700  -8.125   7.519
  849   HD11  LEU  80          1HD1      LEU  80   7.655 -10.759   6.812
  850   HD12  LEU  80          2HD1      LEU  80   6.828  -9.209   6.955
  851   HD13  LEU  80          3HD1      LEU  80   7.687  -9.615   5.469
  852   HD21  LEU  80          3HD2      LEU  80   9.036 -10.927   8.202
  853   HD22  LEU  80          1HD2      LEU  80  10.572 -10.065   8.117
  854   HD23  LEU  80          2HD2      LEU  80   9.295  -9.484   9.185
  855    H    PHE  81           H        PHE  81  12.077  -8.168   4.108
  856    HA   PHE  81           HA       PHE  81  13.684 -10.585   3.604
  857    HB2  PHE  81           2HB      PHE  81  11.720  -9.230   1.749
  858    HB3  PHE  81           1HB      PHE  81  12.889 -10.429   1.213
  859    HD1  PHE  81           1HD      PHE  81   9.918  -9.877   3.319
  860    HD2  PHE  81           2HD      PHE  81  12.522 -12.739   1.548
  861    HE1  PHE  81           1HE      PHE  81   8.324 -11.669   3.880
  862    HE2  PHE  81           2HE      PHE  81  10.938 -14.535   2.109
  863    HZ   PHE  81           HZ       PHE  81   8.834 -14.000   3.276
  864    H    GLY  82           H        GLY  82  12.972  -7.662   1.718
  865    HA2  GLY  82           1HA      GLY  82  14.439  -5.974   1.051
  866    HA3  GLY  82           2HA      GLY  82  15.754  -6.833   1.847
  Start of MODEL   11
    1    H    SER 641           1H       SER 641  30.602  24.338  -8.703
    2    HA   SER 641           HA       SER 641  29.272  24.571 -10.960
    3    HB2  SER 641           2HB      SER 641  30.983  22.133 -10.660
    4    HB3  SER 641           1HB      SER 641  31.026  23.394 -11.895
    5    HG   SER 641           HG       SER 641  32.415  24.455 -10.734
    6    H    LEU 642           H        LEU 642  28.758  22.601 -12.558
    7    HA   LEU 642           HA       LEU 642  26.760  20.929 -11.168
    8    HB2  LEU 642           2HB      LEU 642  26.539  22.342 -13.818
    9    HB3  LEU 642           1HB      LEU 642  25.401  21.125 -13.271
   10    HG   LEU 642           HG       LEU 642  25.601  23.037 -11.198
   11   HD11  LEU 642          1HD1      LEU 642  26.555  24.573 -12.840
   12   HD12  LEU 642          2HD1      LEU 642  25.163  24.314 -13.893
   13   HD13  LEU 642          3HD1      LEU 642  24.949  25.089 -12.322
   14   HD21  LEU 642          3HD2      LEU 642  23.205  23.502 -12.403
   15   HD22  LEU 642          1HD2      LEU 642  23.598  21.890 -13.001
   16   HD23  LEU 642          2HD2      LEU 642  23.527  22.193 -11.266
   17    H    GLN 643           H        GLN 643  29.526  20.914 -13.031
   18    HA   GLN 643           HA       GLN 643  28.904  18.356 -14.311
   19    HB2  GLN 643           2HB      GLN 643  30.470  20.525 -15.098
   20    HB3  GLN 643           1HB      GLN 643  31.638  19.294 -14.641
   21    HG2  GLN 643           2HG      GLN 643  29.374  18.531 -16.412
   22    HG3  GLN 643           1HG      GLN 643  30.714  19.455 -17.085
   23   HE21  GLN 643          1HE2      GLN 643  29.590  16.489 -16.948
   24   HE22  GLN 643          2HE2      GLN 643  31.058  15.572 -16.889
   25    H    ASN 644           H        ASN 644  29.317  18.853 -11.368
   26    HA   ASN 644           HA       ASN 644  31.411  16.829 -10.945
   27    HB2  ASN 644           2HB      ASN 644  31.690  19.439 -10.179
   28    HB3  ASN 644           1HB      ASN 644  30.976  18.732  -8.736
   29   HD21  ASN 644          1HD2      ASN 644  33.488  19.783  -8.675
   30   HD22  ASN 644          2HD2      ASN 644  34.654  18.515  -8.488
   31    H    ASN 645           H        ASN 645  29.703  15.288 -10.950
   32    HA   ASN 645           HA       ASN 645  28.527  14.906  -8.349
   33    HB2  ASN 645           2HB      ASN 645  26.949  16.459  -9.671
   34    HB3  ASN 645           1HB      ASN 645  26.579  15.037 -10.641
   35   HD21  ASN 645          1HD2      ASN 645  24.444  15.006  -9.975
   36   HD22  ASN 645          2HD2      ASN 645  23.986  14.511  -8.377
   37    H    GLN 646           H        GLN 646  29.014  12.868  -7.997
   38    HA   GLN 646           HA       GLN 646  28.896  10.944 -10.214
   39    HB2  GLN 646           2HB      GLN 646  30.179  10.723  -7.484
   40    HB3  GLN 646           1HB      GLN 646  30.176   9.449  -8.693
   41    HG2  GLN 646           2HG      GLN 646  31.580  12.101  -8.789
   42    HG3  GLN 646           1HG      GLN 646  32.285  10.487  -8.811
   43   HE21  GLN 646          1HE2      GLN 646  32.478  12.805 -10.656
   44   HE22  GLN 646          2HE2      GLN 646  32.071  12.166 -12.215
   45    H    ASP 647           H        ASP 647  26.458  11.567  -9.606
   46    HA   ASP 647           HA       ASP 647  25.464   9.713  -7.560
   47    HB2  ASP 647           2HB      ASP 647  24.739  12.153  -7.615
   48    HB3  ASP 647           1HB      ASP 647  23.856  11.762  -9.087
   49    H    VAL 648           H        VAL 648  23.492   8.483  -8.106
   50    HA   VAL 648           HA       VAL 648  23.757   7.282 -10.751
   51    HB   VAL 648           HB       VAL 648  21.825   5.790  -9.726
   52   HG11  VAL 648          1HG1      VAL 648  23.657   4.414  -8.584
   53   HG12  VAL 648          2HG1      VAL 648  23.843   4.767 -10.303
   54   HG13  VAL 648          3HG1      VAL 648  24.757   5.689  -9.110
   55   HG21  VAL 648          3HG2      VAL 648  22.268   7.537  -7.595
   56   HG22  VAL 648          1HG2      VAL 648  21.340   6.037  -7.569
   57   HG23  VAL 648          2HG2      VAL 648  23.046   6.026  -7.123
   58    H    SER 649           H        SER 649  22.920   9.711 -11.185
   59    HA   SER 649           HA       SER 649  20.092  10.072 -11.040
   60    HB2  SER 649           2HB      SER 649  21.364  11.765 -12.998
   61    HB3  SER 649           1HB      SER 649  20.671  12.203 -11.435
   62    HG   SER 649           HG       SER 649  23.214  12.197 -12.091
   63    H    PHE 650           H        PHE 650  19.940   7.792 -12.132
   64    HA   PHE 650           HA       PHE 650  19.183   8.330 -14.892
   65    HB2  PHE 650           2HB      PHE 650  21.446   6.701 -14.141
   66    HB3  PHE 650           1HB      PHE 650  20.241   5.733 -14.983
   67    HD1  PHE 650           1HD      PHE 650  19.226   6.949 -17.126
   68    HD2  PHE 650           2HD      PHE 650  23.041   7.738 -15.417
   69    HE1  PHE 650           1HE      PHE 650  19.994   7.862 -19.277
   70    HE2  PHE 650           2HE      PHE 650  23.820   8.650 -17.566
   71    HZ   PHE 650           HZ       PHE 650  22.295   8.713 -19.496
   72    H    GLU 651           H        GLU 651  17.123   8.321 -13.882
   73    HA   GLU 651           HA       GLU 651  16.129   5.832 -12.749
   74    HB2  GLU 651           2HB      GLU 651  13.946   7.483 -13.065
   75    HB3  GLU 651           1HB      GLU 651  14.935   7.369 -11.618
   76    HG2  GLU 651           2HG      GLU 651  14.645   9.675 -12.183
   77    HG3  GLU 651           1HG      GLU 651  16.327   9.229 -12.458
   78    H    ASN 652           H        ASN 652  16.565   7.168 -15.747
   79    HA   ASN 652           HA       ASN 652  14.199   6.315 -17.082
   80    HB2  ASN 652           2HB      ASN 652  16.199   8.026 -17.726
   81    HB3  ASN 652           1HB      ASN 652  16.680   6.615 -18.663
   82   HD21  ASN 652          1HD2      ASN 652  15.706   6.244 -20.534
   83   HD22  ASN 652          2HD2      ASN 652  14.316   7.088 -21.127
   84    H    ILE 653           H        ILE 653  17.194   4.776 -16.239
   85    HA   ILE 653           HA       ILE 653  16.654   2.576 -18.093
   86    HB   ILE 653           HB       ILE 653  18.944   1.754 -17.138
   87   HG12  ILE 653          2HG1      ILE 653  19.819   4.516 -16.932
   88   HG13  ILE 653          1HG1      ILE 653  18.659   4.111 -15.668
   89   HG21  ILE 653          1HG2      ILE 653  19.351   2.191 -19.273
   90   HG22  ILE 653          2HG2      ILE 653  18.163   3.494 -19.294
   91   HG23  ILE 653          3HG2      ILE 653  19.821   3.820 -18.789
   92   HD11  ILE 653          3HD1      ILE 653  21.048   3.772 -15.053
   93   HD12  ILE 653          1HD1      ILE 653  20.037   2.338 -14.878
   94   HD13  ILE 653          2HD1      ILE 653  21.121   2.486 -16.263
   95    H    GLN 654           H        GLN 654  14.785   2.051 -16.707
   96    HA   GLN 654           HA       GLN 654  15.507   0.608 -14.262
   97    HB2  GLN 654           2HB      GLN 654  13.045   1.866 -15.301
   98    HB3  GLN 654           1HB      GLN 654  12.809   0.371 -14.407
   99    HG2  GLN 654           2HG      GLN 654  13.887   1.306 -12.482
  100    HG3  GLN 654           1HG      GLN 654  14.329   2.747 -13.392
  101   HE21  GLN 654          1HE2      GLN 654  12.708   4.225 -13.983
  102   HE22  GLN 654          2HE2      GLN 654  11.198   4.286 -13.140
  103    H    TRP 655           H        TRP 655  16.576  -0.655 -16.264
  104    HA   TRP 655           HA       TRP 655  14.776  -2.603 -17.416
  105    HB2  TRP 655           2HB      TRP 655  16.867  -3.519 -18.466
  106    HB3  TRP 655           1HB      TRP 655  16.519  -1.844 -18.872
  107    HD1  TRP 655           HD       TRP 655  18.015   0.010 -17.312
  108    HE1  TRP 655           1HE      TRP 655  20.501  -0.141 -16.666
  109    HE3  TRP 655           3HE      TRP 655  18.734  -5.000 -18.011
  110    HZ2  TRP 655           2HZ      TRP 655  22.504  -2.122 -16.480
  111    HZ3  TRP 655           3HZ      TRP 655  20.963  -5.945 -17.580
  112    HH2  TRP 655           HH       TRP 655  22.810  -4.532 -16.830
  113    H    SER 656           H        SER 656  16.787  -4.759 -17.356
  114    HA   SER 656           HA       SER 656  15.900  -5.977 -14.921
  115    HB2  SER 656           2HB      SER 656  17.932  -7.139 -16.807
  116    HB3  SER 656           1HB      SER 656  16.733  -7.981 -15.823
  117    HG   SER 656           HG       SER 656  15.111  -6.967 -17.149
  118    H    ILE 657           H        ILE 657  17.078  -4.146 -13.728
  119    HA   ILE 657           HA       ILE 657  19.918  -4.574 -13.341
  120    HB   ILE 657           HB       ILE 657  19.505  -2.877 -11.426
  121   HG12  ILE 657          2HG1      ILE 657  17.234  -1.725 -12.802
  122   HG13  ILE 657          1HG1      ILE 657  16.843  -3.330 -12.197
  123   HG21  ILE 657          1HG2      ILE 657  19.244  -2.254 -14.351
  124   HG22  ILE 657          2HG2      ILE 657  19.381  -0.995 -13.123
  125   HG23  ILE 657          3HG2      ILE 657  20.681  -2.169 -13.331
  126   HD11  ILE 657          3HD1      ILE 657  16.289  -2.136 -10.367
  127   HD12  ILE 657          1HD1      ILE 657  18.007  -2.343 -10.015
  128   HD13  ILE 657          2HD1      ILE 657  17.429  -0.840 -10.733
  129    H    ASP 658           H        ASP 658  20.166  -4.199 -10.598
  130    HA   ASP 658           HA       ASP 658  19.568  -6.838  -9.636
  131    HB2  ASP 658           2HB      ASP 658  21.683  -5.712  -9.044
  132    HB3  ASP 658           1HB      ASP 658  20.778  -4.477  -8.176
  133    HA   PRO 659           HA       PRO 659  15.556  -5.712  -8.083
  134    HB2  PRO 659           2HB      PRO 659  15.691  -8.275  -6.646
  135    HB3  PRO 659           1HB      PRO 659  14.570  -7.753  -7.906
  136    HG2  PRO 659           2HG      PRO 659  16.457  -9.598  -8.389
  137    HG3  PRO 659           1HG      PRO 659  15.977  -8.413  -9.618
  138    HD2  PRO 659           2HD      PRO 659  18.379  -8.411  -7.824
  139    HD3  PRO 659           1HD      PRO 659  18.267  -8.027  -9.556
  140    H    GLY 660           H        GLY 660  18.353  -6.138  -6.223
  141    HA2  GLY 660           1HA      GLY 660  16.967  -5.481  -3.719
  142    HA3  GLY 660           2HA      GLY 660  18.651  -5.969  -3.867
  143    H    ALA 661           H        ALA 661  19.046  -4.151  -6.163
  144    HA   ALA 661           HA       ALA 661  19.860  -1.823  -4.766
  145    HB1  ALA 661           1HB      ALA 661  20.043  -2.848  -7.482
  146    HB2  ALA 661           2HB      ALA 661  19.805  -1.101  -7.430
  147    HB3  ALA 661           3HB      ALA 661  21.166  -1.830  -6.578
  148    H    ASP 662           H        ASP 662  17.173  -2.514  -6.965
  149    HA   ASP 662           HA       ASP 662  15.658  -0.406  -5.625
  150    HB2  ASP 662           2HB      ASP 662  16.577   0.406  -7.895
  151    HB3  ASP 662           1HB      ASP 662  15.427  -0.721  -8.612
  152    H    LEU 663           H        LEU 663  13.538  -0.889  -5.327
  153    HA   LEU 663           HA       LEU 663  12.845  -3.670  -5.940
  154    HB2  LEU 663           2HB      LEU 663  11.233  -2.125  -4.000
  155    HB3  LEU 663           1HB      LEU 663  11.772  -3.794  -3.940
  156    HG   LEU 663           HG       LEU 663  13.828  -1.667  -3.608
  157   HD11  LEU 663          1HD1      LEU 663  11.900  -0.959  -2.208
  158   HD12  LEU 663          2HD1      LEU 663  12.006  -2.503  -1.363
  159   HD13  LEU 663          3HD1      LEU 663  13.348  -1.363  -1.287
  160   HD21  LEU 663          3HD2      LEU 663  13.427  -4.509  -2.937
  161   HD22  LEU 663          1HD2      LEU 663  14.897  -3.641  -3.383
  162   HD23  LEU 663          2HD2      LEU 663  14.286  -3.548  -1.731
  163    H    SER 664           H        SER 664  12.539  -1.827  -7.991
  164    HA   SER 664           HA       SER 664  10.077  -0.523  -8.165
  165    HB2  SER 664           2HB      SER 664  10.866  -1.426 -10.754
  166    HB3  SER 664           1HB      SER 664  11.070   0.178 -10.043
  167    HG   SER 664           HG       SER 664  13.079  -0.317  -9.415
  168    H    GLN 665           H        GLN 665  10.955  -3.854  -8.807
  169    HA   GLN 665           HA       GLN 665   8.392  -4.439 -10.020
  170    HB2  GLN 665           2HB      GLN 665  10.975  -5.637 -10.016
  171    HB3  GLN 665           1HB      GLN 665   9.824  -6.822  -9.414
  172    HG2  GLN 665           2HG      GLN 665  10.324  -6.624 -11.966
  173    HG3  GLN 665           1HG      GLN 665   8.690  -6.936 -11.390
  174   HE21  GLN 665          1HE2      GLN 665   7.108  -5.498 -11.801
  175   HE22  GLN 665          2HE2      GLN 665   7.337  -4.034 -12.701
  176    H    TYR 666           H        TYR 666   9.490  -4.141  -6.903
  177    HA   TYR 666           HA       TYR 666   7.893  -6.343  -5.852
  178    HB2  TYR 666           2HB      TYR 666   9.925  -4.504  -4.615
  179    HB3  TYR 666           1HB      TYR 666   8.891  -5.540  -3.633
  180    HD1  TYR 666           1HD      TYR 666   8.861  -8.081  -4.437
  181    HD2  TYR 666           2HD      TYR 666  11.997  -5.316  -5.216
  182    HE1  TYR 666           1HE      TYR 666  10.419  -9.951  -4.761
  183    HE2  TYR 666           2HE      TYR 666  13.568  -7.180  -5.538
  184    HH   TYR 666           HH       TYR 666  12.727 -10.199  -6.155
  185    H    LYS 667           H        LYS 667   7.775  -2.894  -6.213
  186    HA   LYS 667           HA       LYS 667   5.784  -2.529  -4.174
  187    HB2  LYS 667           2HB      LYS 667   5.474  -0.277  -5.476
  188    HB3  LYS 667           1HB      LYS 667   6.886  -0.538  -4.471
  189    HG2  LYS 667           2HG      LYS 667   7.549  -1.459  -7.046
  190    HG3  LYS 667           1HG      LYS 667   6.728   0.088  -7.251
  191    HD2  LYS 667           2HD      LYS 667   8.709  -0.004  -5.074
  192    HD3  LYS 667           1HD      LYS 667   9.369  -0.183  -6.700
  193    HE2  LYS 667           2HE      LYS 667   7.841   1.884  -7.216
  194    HE3  LYS 667           1HE      LYS 667   7.933   2.128  -5.472
  195    HZ1  LYS 667           3HZ      LYS 667  10.482   1.833  -5.922
  196    HZ2  LYS 667           1HZ      LYS 667   9.726   3.329  -6.183
  197    HZ3  LYS 667           2HZ      LYS 667  10.058   2.307  -7.491
  198    H    MET 668           H        MET 668   3.709  -2.905  -4.325
  199    HA   MET 668           HA       MET 668   2.637  -3.882  -6.818
  200    HB2  MET 668           2HB      MET 668   0.591  -4.327  -5.479
  201    HB3  MET 668           1HB      MET 668   2.037  -5.074  -4.822
  202    HG2  MET 668           2HG      MET 668   1.845  -2.577  -3.582
  203    HG3  MET 668           1HG      MET 668   0.215  -3.246  -3.586
  204    HE1  MET 668           3HE      MET 668   0.204  -5.867  -3.565
  205    HE2  MET 668           1HE      MET 668   1.378  -6.871  -2.716
  206    HE3  MET 668           2HE      MET 668   0.015  -6.177  -1.839
  207    H    ASP 669           H        ASP 669   0.959  -3.017  -7.988
  208    HA   ASP 669           HA       ASP 669   0.808  -0.136  -7.916
  209    HB2  ASP 669           2HB      ASP 669   0.885  -1.756  -9.981
  210    HB3  ASP 669           1HB      ASP 669  -0.855  -1.838  -9.733
  211    H    VAL 670           H        VAL 670  -0.454   0.720  -6.396
  212    HA   VAL 670           HA       VAL 670  -2.876  -0.617  -5.555
  213    HB   VAL 670           HB       VAL 670  -1.977   2.104  -4.629
  214   HG11  VAL 670          1HG1      VAL 670  -3.031   0.533  -2.552
  215   HG12  VAL 670          2HG1      VAL 670  -3.778   1.923  -3.344
  216   HG13  VAL 670          3HG1      VAL 670  -4.089   0.294  -3.943
  217   HG21  VAL 670          3HG2      VAL 670  -0.973   0.607  -2.702
  218   HG22  VAL 670          1HG2      VAL 670  -0.832  -0.570  -4.007
  219   HG23  VAL 670          2HG2      VAL 670  -0.034   0.997  -4.143
  220    H    THR 671           H        THR 671  -4.309  -0.492  -7.238
  221    HA   THR 671           HA       THR 671  -4.991   2.099  -8.376
  222    HB   THR 671           HB       THR 671  -6.587  -0.348  -9.013
  223    HG1  THR 671           1HG      THR 671  -4.333  -0.179 -10.552
  224   HG21  THR 671          3HG2      THR 671  -6.402   2.204 -10.034
  225   HG22  THR 671          1HG2      THR 671  -7.110   0.815 -10.857
  226   HG23  THR 671          2HG2      THR 671  -5.431   1.257 -11.161
  227    H    VAL 672           H        VAL 672  -6.278   3.358  -7.173
  228    HA   VAL 672           HA       VAL 672  -8.239   2.233  -5.377
  229    HB   VAL 672           HB       VAL 672  -8.256   5.141  -6.075
  230   HG11  VAL 672          1HG1      VAL 672  -8.558   3.592  -3.507
  231   HG12  VAL 672          2HG1      VAL 672  -8.687   5.345  -3.658
  232   HG13  VAL 672          3HG1      VAL 672  -9.856   4.299  -4.468
  233   HG21  VAL 672          3HG2      VAL 672  -6.266   4.150  -4.081
  234   HG22  VAL 672          1HG2      VAL 672  -5.837   4.212  -5.790
  235   HG23  VAL 672          2HG2      VAL 672  -6.320   5.686  -4.947
  236    H    ILE 673           H        ILE 673 -10.264   1.722  -5.906
  237    HA   ILE 673           HA       ILE 673 -11.176   2.367  -8.595
  238    HB   ILE 673           HB       ILE 673 -12.259   0.455  -6.526
  239   HG12  ILE 673          2HG1      ILE 673 -11.673  -0.884  -8.901
  240   HG13  ILE 673          1HG1      ILE 673 -10.346   0.260  -8.710
  241   HG21  ILE 673          1HG2      ILE 673 -13.415  -0.035  -9.055
  242   HG22  ILE 673          2HG2      ILE 673 -14.216   0.491  -7.573
  243   HG23  ILE 673          3HG2      ILE 673 -13.611   1.686  -8.719
  244   HD11  ILE 673          3HD1      ILE 673  -9.682  -1.748  -7.662
  245   HD12  ILE 673          1HD1      ILE 673 -10.078  -0.611  -6.373
  246   HD13  ILE 673          2HD1      ILE 673 -11.217  -1.887  -6.803
  247    H    ASP 674           H        ASP 674 -12.684   3.803  -9.047
  248    HA   ASP 674           HA       ASP 674 -13.880   5.381  -6.952
  249    HB2  ASP 674           2HB      ASP 674 -13.149   6.592  -8.873
  250    HB3  ASP 674           1HB      ASP 674 -13.972   5.490  -9.969
  251    H    THR 675           H        THR 675 -15.601   4.624  -5.913
  252    HA   THR 675           HA       THR 675 -17.288   2.590  -7.001
  253    HB   THR 675           HB       THR 675 -18.263   3.946  -4.597
  254    HG1  THR 675           1HG      THR 675 -16.365   2.971  -3.414
  255   HG21  THR 675          3HG2      THR 675 -19.141   1.855  -4.728
  256   HG22  THR 675          1HG2      THR 675 -17.673   1.439  -3.843
  257   HG23  THR 675          2HG2      THR 675 -17.748   1.203  -5.589
  258    H    LYS 676           H        LYS 676 -17.735   4.301  -8.851
  259    HA   LYS 676           HA       LYS 676 -19.895   6.113  -8.323
  260    HB2  LYS 676           2HB      LYS 676 -18.105   5.949 -10.333
  261    HB3  LYS 676           1HB      LYS 676 -19.462   5.127 -11.090
  262    HG2  LYS 676           2HG      LYS 676 -19.778   7.322 -11.732
  263    HG3  LYS 676           1HG      LYS 676 -20.833   7.181 -10.324
  264    HD2  LYS 676           2HD      LYS 676 -19.760   8.891  -9.390
  265    HD3  LYS 676           1HD      LYS 676 -18.292   7.913  -9.356
  266    HE2  LYS 676           2HE      LYS 676 -17.446   8.865 -11.264
  267    HE3  LYS 676           1HE      LYS 676 -19.040   9.270 -11.898
  268    HZ1  LYS 676           3HZ      LYS 676 -19.074  11.227 -10.809
  269    HZ2  LYS 676           1HZ      LYS 676 -17.385  11.060 -10.837
  270    HZ3  LYS 676           2HZ      LYS 676 -18.257  10.630  -9.448
  271    H    ASP 677           H        ASP 677 -19.589   2.846  -9.613
  272    HA   ASP 677           HA       ASP 677 -22.374   2.586 -10.170
  273    HB2  ASP 677           2HB      ASP 677 -20.550   1.291 -11.363
  274    HB3  ASP 677           1HB      ASP 677 -20.394   0.326  -9.895
  275    H    GLY 678           H        GLY 678 -23.874   2.159  -8.840
  276    HA2  GLY 678           1HA      GLY 678 -24.738   0.806  -6.977
  277    HA3  GLY 678           2HA      GLY 678 -23.208   1.117  -6.160
  278    H    SER 679           H        SER 679 -23.033   3.840  -7.039
  279    HA   SER 679           HA       SER 679 -24.996   5.044  -5.236
  280    HB2  SER 679           2HB      SER 679 -22.663   6.557  -6.335
  281    HB3  SER 679           1HB      SER 679 -23.421   6.665  -4.748
  282    HG   SER 679           HG       SER 679 -21.276   5.246  -5.464
  283    H    GLN 680           H        GLN 680 -23.554   5.461  -8.455
  284    HA   GLN 680           HA       GLN 680 -25.742   7.325  -9.115
  285    HB2  GLN 680           2HB      GLN 680 -22.984   7.755  -9.200
  286    HB3  GLN 680           1HB      GLN 680 -23.446   7.500 -10.877
  287    HG2  GLN 680           2HG      GLN 680 -25.005   9.302 -10.796
  288    HG3  GLN 680           1HG      GLN 680 -24.801   9.469  -9.053
  289   HE21  GLN 680          1HE2      GLN 680 -22.746   9.373 -11.950
  290   HE22  GLN 680          2HE2      GLN 680 -21.769  10.732 -11.512
  291    H    SER 681           H        SER 681 -25.956   4.492  -9.380
  292    HA   SER 681           HA       SER 681 -25.561   3.847 -12.158
  293    HB2  SER 681           2HB      SER 681 -27.205   2.265 -10.188
  294    HB3  SER 681           1HB      SER 681 -26.356   1.685 -11.622
  295    HG   SER 681           HG       SER 681 -24.598   1.495 -10.494
  296    H    LYS 682           H        LYS 682 -26.857   5.857 -12.705
  297    HA   LYS 682           HA       LYS 682 -29.736   5.312 -12.780
  298    HB2  LYS 682           2HB      LYS 682 -28.181   7.678 -12.518
  299    HB3  LYS 682           1HB      LYS 682 -29.051   7.787 -14.043
  300    HG2  LYS 682           2HG      LYS 682 -31.149   7.556 -12.953
  301    HG3  LYS 682           1HG      LYS 682 -30.377   7.132 -11.425
  302    HD2  LYS 682           2HD      LYS 682 -31.001   9.380 -11.179
  303    HD3  LYS 682           1HD      LYS 682 -29.275   9.431 -11.541
  304    HE2  LYS 682           2HE      LYS 682 -30.644   9.478 -14.010
  305    HE3  LYS 682           1HE      LYS 682 -31.447  10.639 -12.954
  306    HZ1  LYS 682           3HZ      LYS 682 -29.808  11.945 -13.789
  307    HZ2  LYS 682           1HZ      LYS 682 -28.717  10.662 -14.009
  308    HZ3  LYS 682           2HZ      LYS 682 -28.962  11.308 -12.464
  309    H    LEU 683           H        LEU 683 -27.041   4.729 -14.559
  310    HA   LEU 683           HA       LEU 683 -28.077   5.331 -17.177
  311    HB2  LEU 683           2HB      LEU 683 -25.962   3.782 -17.715
  312    HB3  LEU 683           1HB      LEU 683 -25.825   5.489 -17.342
  313    HG   LEU 683           HG       LEU 683 -25.749   3.981 -14.902
  314   HD11  LEU 683          1HD1      LEU 683 -24.780   2.094 -15.649
  315   HD12  LEU 683          2HD1      LEU 683 -24.285   2.827 -17.175
  316   HD13  LEU 683          3HD1      LEU 683 -23.328   3.093 -15.717
  317   HD21  LEU 683          3HD2      LEU 683 -24.796   6.301 -15.714
  318   HD22  LEU 683          1HD2      LEU 683 -24.013   5.385 -14.427
  319   HD23  LEU 683          2HD2      LEU 683 -23.369   5.327 -16.067
  320    H    GLY 684           H        GLY 684 -29.813   4.133 -17.742
  321    HA2  GLY 684           1HA      GLY 684 -30.052   1.344 -17.088
  322    HA3  GLY 684           2HA      GLY 684 -31.125   2.272 -18.128
  323    H    GLY 685           H        GLY 685 -29.122   3.217 -19.909
  324    HA2  GLY 685           1HA      GLY 685 -28.036   2.631 -21.834
  325    HA3  GLY 685           2HA      GLY 685 -27.514   1.182 -20.989
  326    H    GLY 901           H        GLY 901 -27.990  -0.562 -22.106
  327    HA2  GLY 901           1HA      GLY 901 -30.319  -0.557 -23.882
  328    HA3  GLY 901           2HA      GLY 901 -29.018  -1.740 -23.874
  329    H    GLY 902           H        GLY 902 -30.988  -0.592 -21.166
  330    HA2  GLY 902           1HA      GLY 902 -32.830  -2.663 -21.048
  331    HA3  GLY 902           2HA      GLY 902 -31.409  -3.214 -20.172
  332    H    SER 903           H        SER 903 -32.548  -3.270 -18.223
  333    HA   SER 903           HA       SER 903 -33.335  -0.645 -17.142
  334    HB2  SER 903           2HB      SER 903 -34.148  -2.941 -15.551
  335    HB3  SER 903           1HB      SER 903 -35.129  -1.638 -16.223
  336    HG   SER 903           HG       SER 903 -35.022  -2.773 -18.256
  337    H    GLY 904           H        GLY 904 -31.248  -3.393 -16.740
  338    HA2  GLY 904           1HA      GLY 904 -29.238  -2.278 -15.357
  339    HA3  GLY 904           2HA      GLY 904 -30.395  -2.624 -14.080
  340    H    GLY 905           H        GLY 905 -27.777  -3.750 -14.331
  341    HA2  GLY 905           1HA      GLY 905 -28.116  -6.443 -15.367
  342    HA3  GLY 905           2HA      GLY 905 -26.658  -5.774 -14.649
  343    H    HIS 906           H        HIS 906 -29.991  -6.540 -13.687
  344    HA   HIS 906           HA       HIS 906 -28.899  -7.834 -11.285
  345    HB2  HIS 906           2HB      HIS 906 -31.142  -7.001 -10.202
  346    HB3  HIS 906           1HB      HIS 906 -29.747  -5.933 -10.277
  347    HD1  HIS 906           1HD      HIS 906 -32.686  -6.635 -12.650
  348    HD2  HIS 906           2HD      HIS 906 -30.519  -3.485 -11.017
  349    HE1  HIS 906           1HE      HIS 906 -33.708  -4.513 -13.572
  350    H    MET 907           H        MET 907 -29.234  -9.924 -11.670
  351    HA   MET 907           HA       MET 907 -31.496 -10.952 -13.061
  352    HB2  MET 907           2HB      MET 907 -30.717 -13.140 -12.403
  353    HB3  MET 907           1HB      MET 907 -29.334 -12.165 -12.872
  354    HG2  MET 907           2HG      MET 907 -28.395 -12.819 -10.972
  355    HG3  MET 907           1HG      MET 907 -29.523 -11.740 -10.152
  356    HE1  MET 907           3HE      MET 907 -28.550 -15.687 -10.439
  357    HE2  MET 907           1HE      MET 907 -27.871 -14.362  -9.495
  358    HE3  MET 907           2HE      MET 907 -28.877 -15.579  -8.709
  359    H    GLY 908           H        GLY 908 -30.853 -10.103  -9.782
  360    HA2  GLY 908           1HA      GLY 908 -33.569 -10.161  -9.019
  361    HA3  GLY 908           2HA      GLY 908 -32.752 -11.590  -8.393
  362    H    SER 909           H        SER 909 -30.368 -10.825  -7.614
  363    HA   SER 909           HA       SER 909 -30.856  -9.028  -5.414
  364    HB2  SER 909           2HB      SER 909 -28.130 -10.078  -6.010
  365    HB3  SER 909           1HB      SER 909 -28.973  -9.947  -4.465
  366    HG   SER 909           HG       SER 909 -30.131 -11.767  -4.930
  367    H    GLY 910           H        GLY 910 -31.127  -7.009  -6.368
  368    HA2  GLY 910           1HA      GLY 910 -28.782  -5.912  -7.776
  369    HA3  GLY 910           2HA      GLY 910 -30.420  -5.281  -7.904
  370    H    GLY 911           H        GLY 911 -27.931  -3.913  -7.178
  371    HA2  GLY 911           1HA      GLY 911 -27.832  -1.975  -5.789
  372    HA3  GLY 911           2HA      GLY 911 -28.890  -2.782  -4.637
  373    H    LEU  18           H        LEU  18 -27.787  -5.086  -4.081
  374    HA   LEU  18           HA       LEU  18 -25.177  -4.417  -2.952
  375    HB2  LEU  18           2HB      LEU  18 -26.377  -7.032  -2.376
  376    HB3  LEU  18           1HB      LEU  18 -25.621  -5.889  -1.284
  377    HG   LEU  18           HG       LEU  18 -28.015  -4.666  -2.017
  378   HD11  LEU  18          1HD1      LEU  18 -28.428  -7.613  -1.532
  379   HD12  LEU  18          2HD1      LEU  18 -29.700  -6.394  -1.447
  380   HD13  LEU  18          3HD1      LEU  18 -28.872  -6.700  -2.974
  381   HD21  LEU  18          3HD2      LEU  18 -27.510  -4.321   0.152
  382   HD22  LEU  18          1HD2      LEU  18 -28.587  -5.695   0.396
  383   HD23  LEU  18          2HD2      LEU  18 -26.840  -5.938   0.366
  384    H    SER  19           H        SER  19 -23.963  -4.598  -4.831
  385    HA   SER  19           HA       SER  19 -23.995  -7.033  -6.384
  386    HB2  SER  19           2HB      SER  19 -21.875  -4.934  -6.643
  387    HB3  SER  19           1HB      SER  19 -22.655  -5.892  -7.904
  388    HG   SER  19           HG       SER  19 -23.229  -3.519  -7.559
  389    H    TRP  20           H        TRP  20 -22.004  -5.400  -4.042
  390    HA   TRP  20           HA       TRP  20 -20.611  -6.205  -2.453
  391    HB2  TRP  20           2HB      TRP  20 -21.317  -8.870  -3.667
  392    HB3  TRP  20           1HB      TRP  20 -20.216  -8.694  -2.302
  393    HD1  TRP  20           HD       TRP  20 -23.585  -9.661  -2.770
  394    HE1  TRP  20           1HE      TRP  20 -25.097  -9.044  -0.781
  395    HE3  TRP  20           3HE      TRP  20 -20.540  -6.263  -0.512
  396    HZ2  TRP  20           2HZ      TRP  20 -24.992  -7.330   1.477
  397    HZ3  TRP  20           3HZ      TRP  20 -21.307  -5.172   1.563
  398    HH2  TRP  20           HH       TRP  20 -23.488  -5.695   2.533
  399    H    LYS  21           H        LYS  21 -18.512  -6.035  -2.335
  400    HA   LYS  21           HA       LYS  21 -16.877  -7.106  -4.538
  401    HB2  LYS  21           2HB      LYS  21 -16.787  -4.561  -3.089
  402    HB3  LYS  21           1HB      LYS  21 -15.234  -5.385  -3.127
  403    HG2  LYS  21           2HG      LYS  21 -15.442  -3.845  -4.991
  404    HG3  LYS  21           1HG      LYS  21 -15.350  -5.511  -5.562
  405    HD2  LYS  21           2HD      LYS  21 -18.057  -5.104  -5.258
  406    HD3  LYS  21           1HD      LYS  21 -17.486  -3.546  -5.856
  407    HE2  LYS  21           2HE      LYS  21 -17.166  -4.357  -7.909
  408    HE3  LYS  21           1HE      LYS  21 -16.275  -5.745  -7.293
  409    HZ1  LYS  21           3HZ      LYS  21 -18.751  -6.447  -6.646
  410    HZ2  LYS  21           1HZ      LYS  21 -18.033  -6.849  -8.129
  411    HZ3  LYS  21           2HZ      LYS  21 -19.079  -5.517  -8.025
  412    H    ARG  22           H        ARG  22 -15.244  -8.506  -4.006
  413    HA   ARG  22           HA       ARG  22 -15.645  -9.770  -1.432
  414    HB2  ARG  22           2HB      ARG  22 -15.711 -11.224  -3.332
  415    HB3  ARG  22           1HB      ARG  22 -14.176 -10.612  -3.932
  416    HG2  ARG  22           2HG      ARG  22 -13.766 -12.751  -3.008
  417    HG3  ARG  22           1HG      ARG  22 -13.098 -11.566  -1.884
  418    HD2  ARG  22           2HD      ARG  22 -14.334 -12.422  -0.254
  419    HD3  ARG  22           1HD      ARG  22 -15.795 -12.012  -1.151
  420    HE   ARG  22           HE       ARG  22 -14.502 -14.611  -0.978
  421   HH11  ARG  22          2HH1      ARG  22 -16.942 -12.619  -2.505
  422   HH12  ARG  22          1HH1      ARG  22 -17.832 -13.968  -3.144
  423   HH21  ARG  22          2HH2      ARG  22 -15.677 -16.391  -1.790
  424   HH22  ARG  22          1HH2      ARG  22 -17.126 -16.110  -2.712
  425    H    CYS  23           H        CYS  23 -14.334  -9.604   0.232
  426    HA   CYS  23           HA       CYS  23 -11.906  -8.117   0.170
  427    HB2  CYS  23           2HB      CYS  23 -13.264  -9.789   2.273
  428    HB3  CYS  23           1HB      CYS  23 -11.673  -9.096   2.523
  429    H    ALA  24           H        ALA  24  -9.813  -8.872   0.634
  430    HA   ALA  24           HA       ALA  24  -9.390 -11.772   0.365
  431    HB1  ALA  24           1HB      ALA  24  -7.170 -10.993  -0.795
  432    HB2  ALA  24           2HB      ALA  24  -8.665 -11.149  -1.715
  433    HB3  ALA  24           3HB      ALA  24  -8.126  -9.560  -1.172
  434    H    GLY  25           H        GLY  25  -8.986  -9.046   2.233
  435    HA2  GLY  25           1HA      GLY  25  -6.502 -10.092   3.436
  436    HA3  GLY  25           2HA      GLY  25  -6.967  -8.401   3.444
  437    H    CYS  26           H        CYS  26  -9.668  -8.679   4.233
  438    HA   CYS  26           HA       CYS  26  -9.179  -9.498   6.992
  439    HB2  CYS  26           2HB      CYS  26 -10.581  -7.814   7.764
  440    HB3  CYS  26           1HB      CYS  26  -9.743  -7.071   6.419
  441    H    GLY  27           H        GLY  27 -12.462  -9.059   5.863
  442    HA2  GLY  27           1HA      GLY  27 -12.995 -11.754   6.864
  443    HA3  GLY  27           2HA      GLY  27 -14.189 -10.500   6.574
  444    H    GLY  28           H        GLY  28 -14.491  -9.938   4.192
  445    HA2  GLY  28           1HA      GLY  28 -13.982 -11.689   2.122
  446    HA3  GLY  28           2HA      GLY  28 -15.372 -12.356   2.965
  447    H    LYS  29           H        LYS  29 -16.368  -9.679   3.708
  448    HA   LYS  29           HA       LYS  29 -17.288  -8.816   1.047
  449    HB2  LYS  29           2HB      LYS  29 -18.729  -9.138   3.649
  450    HB3  LYS  29           1HB      LYS  29 -19.281  -7.919   2.510
  451    HG2  LYS  29           2HG      LYS  29 -19.148  -9.955   0.828
  452    HG3  LYS  29           1HG      LYS  29 -19.377 -10.874   2.317
  453    HD2  LYS  29           2HD      LYS  29 -21.155  -8.582   2.116
  454    HD3  LYS  29           1HD      LYS  29 -21.367  -9.728   0.791
  455    HE2  LYS  29           2HE      LYS  29 -22.678 -10.857   2.205
  456    HE3  LYS  29           1HE      LYS  29 -21.177 -11.373   2.969
  457    HZ1  LYS  29           3HZ      LYS  29 -21.814 -10.351   4.807
  458    HZ2  LYS  29           1HZ      LYS  29 -23.237  -9.811   4.059
  459    HZ3  LYS  29           2HZ      LYS  29 -21.833  -8.863   3.999
  460    H    ILE  30           H        ILE  30 -16.395  -6.923   0.509
  461    HA   ILE  30           HA       ILE  30 -15.334  -5.113   2.437
  462    HB   ILE  30           HB       ILE  30 -15.815  -4.842  -0.535
  463   HG12  ILE  30          2HG1      ILE  30 -13.147  -4.709   0.792
  464   HG13  ILE  30          1HG1      ILE  30 -13.933  -6.279   0.667
  465   HG21  ILE  30          1HG2      ILE  30 -14.586  -2.838   1.357
  466   HG22  ILE  30          2HG2      ILE  30 -14.446  -2.768  -0.399
  467   HG23  ILE  30          3HG2      ILE  30 -16.027  -2.622   0.364
  468   HD11  ILE  30          3HD1      ILE  30 -12.475  -6.036  -1.178
  469   HD12  ILE  30          1HD1      ILE  30 -14.125  -5.890  -1.789
  470   HD13  ILE  30          2HD1      ILE  30 -13.131  -4.447  -1.572
  471    H    ALA  31           H        ALA  31 -16.636  -4.075   3.770
  472    HA   ALA  31           HA       ALA  31 -19.171  -2.998   2.770
  473    HB1  ALA  31           1HB      ALA  31 -19.171  -4.436   4.815
  474    HB2  ALA  31           2HB      ALA  31 -18.248  -3.175   5.633
  475    HB3  ALA  31           3HB      ALA  31 -19.876  -2.836   5.049
  476    H    ASP  32           H        ASP  32 -16.345  -1.958   2.440
  477    HA   ASP  32           HA       ASP  32 -16.468   0.597   3.829
  478    HB2  ASP  32           2HB      ASP  32 -14.359  -0.976   3.147
  479    HB3  ASP  32           1HB      ASP  32 -14.362   0.165   1.806
  480    H    ARG  33           H        ARG  33 -15.589   2.456   2.234
  481    HA   ARG  33           HA       ARG  33 -17.730   2.728   0.279
  482    HB2  ARG  33           2HB      ARG  33 -16.898   4.490   2.055
  483    HB3  ARG  33           1HB      ARG  33 -15.721   4.876   0.805
  484    HG2  ARG  33           2HG      ARG  33 -18.367   4.702  -0.313
  485    HG3  ARG  33           1HG      ARG  33 -18.320   5.841   1.037
  486    HD2  ARG  33           2HD      ARG  33 -16.344   6.914  -0.011
  487    HD3  ARG  33           1HD      ARG  33 -16.544   5.842  -1.396
  488    HE   ARG  33           HE       ARG  33 -18.982   7.080  -1.081
  489   HH11  ARG  33          2HH1      ARG  33 -15.675   8.155  -1.545
  490   HH12  ARG  33          1HH1      ARG  33 -16.126   9.545  -2.491
  491   HH21  ARG  33          2HH2      ARG  33 -19.573   8.925  -2.282
  492   HH22  ARG  33          1HH2      ARG  33 -18.347   9.992  -2.895
  493    H    PHE  34           H        PHE  34 -14.233   3.485   0.276
  494    HA   PHE  34           HA       PHE  34 -14.248   3.017  -2.616
  495    HB2  PHE  34           2HB      PHE  34 -12.812   4.857  -0.863
  496    HB3  PHE  34           1HB      PHE  34 -11.748   4.026  -1.998
  497    HD1  PHE  34           2HD      PHE  34 -15.244   5.252  -2.290
  498    HD2  PHE  34           1HD      PHE  34 -11.256   5.459  -3.738
  499    HE1  PHE  34           2HE      PHE  34 -15.992   6.749  -4.082
  500    HE2  PHE  34           1HE      PHE  34 -11.989   6.962  -5.547
  501    HZ   PHE  34           HZ       PHE  34 -14.358   7.605  -5.724
  502    H    LEU  35           H        LEU  35 -13.221   1.384  -3.518
  503    HA   LEU  35           HA       LEU  35 -11.795  -0.464  -1.752
  504    HB2  LEU  35           2HB      LEU  35 -12.085  -1.864  -4.039
  505    HB3  LEU  35           1HB      LEU  35 -13.257  -1.869  -2.736
  506    HG   LEU  35           HG       LEU  35 -13.603   0.223  -4.809
  507   HD11  LEU  35          1HD1      LEU  35 -14.939  -2.119  -5.704
  508   HD12  LEU  35          2HD1      LEU  35 -13.759  -1.123  -6.557
  509   HD13  LEU  35          3HD1      LEU  35 -13.218  -2.472  -5.559
  510   HD21  LEU  35          3HD2      LEU  35 -15.938  -0.240  -4.423
  511   HD22  LEU  35          1HD2      LEU  35 -15.534  -1.666  -3.467
  512   HD23  LEU  35          2HD2      LEU  35 -15.120  -0.060  -2.871
  513    H    LEU  36           H        LEU  36  -9.807  -1.379  -2.411
  514    HA   LEU  36           HA       LEU  36  -8.355   0.242  -4.395
  515    HB2  LEU  36           2HB      LEU  36  -7.340  -0.821  -1.758
  516    HB3  LEU  36           1HB      LEU  36  -6.354  -0.007  -2.959
  517    HG   LEU  36           HG       LEU  36  -8.393   1.797  -2.519
  518   HD11  LEU  36          1HD1      LEU  36  -7.520   0.929   0.208
  519   HD12  LEU  36          2HD1      LEU  36  -8.867   1.966  -0.257
  520   HD13  LEU  36          3HD1      LEU  36  -8.955   0.227  -0.538
  521   HD21  LEU  36          3HD2      LEU  36  -6.442   2.688  -0.870
  522   HD22  LEU  36          1HD2      LEU  36  -5.553   1.508  -1.836
  523   HD23  LEU  36          2HD2      LEU  36  -6.406   2.833  -2.629
  524    H    TYR  37           H        TYR  37  -6.584  -0.791  -5.415
  525    HA   TYR  37           HA       TYR  37  -6.940  -3.695  -5.697
  526    HB2  TYR  37           2HB      TYR  37  -6.659  -1.548  -7.573
  527    HB3  TYR  37           1HB      TYR  37  -5.282  -2.630  -7.747
  528    HD1  TYR  37           1HD      TYR  37  -7.030  -5.114  -6.835
  529    HD2  TYR  37           2HD      TYR  37  -7.458  -2.085  -9.787
  530    HE1  TYR  37           1HE      TYR  37  -8.406  -6.637  -8.186
  531    HE2  TYR  37           2HE      TYR  37  -8.835  -3.585 -11.141
  532    HH   TYR  37           HH       TYR  37  -9.080  -6.945 -10.489
  533    H    ALA  38           H        ALA  38  -5.138  -5.046  -5.741
  534    HA   ALA  38           HA       ALA  38  -2.478  -4.003  -5.508
  535    HB1  ALA  38           1HB      ALA  38  -2.786  -3.730  -3.237
  536    HB2  ALA  38           2HB      ALA  38  -3.873  -5.113  -3.110
  537    HB3  ALA  38           3HB      ALA  38  -2.141  -5.369  -3.315
  538    H    MET  39           H        MET  39  -3.310  -7.003  -3.961
  539    HA   MET  39           HA       MET  39  -1.772  -8.457  -5.927
  540    HB2  MET  39           2HB      MET  39  -2.421  -8.768  -3.180
  541    HB3  MET  39           1HB      MET  39  -3.013 -10.191  -4.023
  542    HG2  MET  39           2HG      MET  39  -0.975 -11.021  -4.160
  543    HG3  MET  39           1HG      MET  39  -0.382  -9.559  -4.942
  544    HE1  MET  39           3HE      MET  39  -2.014  -8.833  -1.623
  545    HE2  MET  39           1HE      MET  39  -1.662 -10.521  -1.250
  546    HE3  MET  39           2HE      MET  39  -0.814  -9.232  -0.393
  547    H    ASP  40           H        ASP  40  -3.782  -7.601  -7.357
  548    HA   ASP  40           HA       ASP  40  -5.460  -8.165  -8.768
  549    HB2  ASP  40           2HB      ASP  40  -3.746 -10.205  -8.869
  550    HB3  ASP  40           1HB      ASP  40  -5.147 -11.077  -8.254
  551    H    SER  41           H        SER  41  -6.022  -8.011  -5.827
  552    HA   SER  41           HA       SER  41  -8.700  -9.187  -5.986
  553    HB2  SER  41           2HB      SER  41  -6.667  -9.470  -3.815
  554    HB3  SER  41           1HB      SER  41  -8.360  -9.319  -3.345
  555    HG   SER  41           HG       SER  41  -7.032 -11.426  -4.494
  556    H    TYR  42           H        TYR  42 -10.134  -8.109  -4.235
  557    HA   TYR  42           HA       TYR  42  -9.700  -5.221  -4.469
  558    HB2  TYR  42           2HB      TYR  42 -12.156  -6.845  -3.779
  559    HB3  TYR  42           1HB      TYR  42 -12.106  -5.087  -3.761
  560    HD1  TYR  42           1HD      TYR  42 -11.464  -7.975  -6.043
  561    HD2  TYR  42           2HD      TYR  42 -12.700  -3.923  -5.664
  562    HE1  TYR  42           1HE      TYR  42 -12.077  -7.946  -8.420
  563    HE2  TYR  42           2HE      TYR  42 -13.314  -3.884  -8.043
  564    HH   TYR  42           HH       TYR  42 -12.755  -6.712 -10.124
  565    H    TRP  43           H        TRP  43  -9.251  -3.985  -2.740
  566    HA   TRP  43           HA       TRP  43  -9.555  -5.180  -0.070
  567    HB2  TRP  43           2HB      TRP  43  -7.196  -3.433  -0.669
  568    HB3  TRP  43           1HB      TRP  43  -7.400  -4.617   0.613
  569    HD1  TRP  43           HD       TRP  43  -6.852  -4.540  -3.226
  570    HE1  TRP  43           1HE      TRP  43  -5.497  -6.621  -3.870
  571    HE3  TRP  43           3HE      TRP  43  -6.581  -6.794   1.353
  572    HZ2  TRP  43           2HZ      TRP  43  -4.435  -8.911  -2.616
  573    HZ3  TRP  43           3HZ      TRP  43  -5.370  -8.924   1.543
  574    HH2  TRP  43           HH       TRP  43  -4.318  -9.959  -0.404
  575    H    HIS  44           H        HIS  44  -9.294  -3.546   1.658
  576    HA   HIS  44           HA       HIS  44  -9.747  -0.759   0.889
  577    HB2  HIS  44           2HB      HIS  44 -11.369  -0.591   2.907
  578    HB3  HIS  44           1HB      HIS  44 -11.996  -1.281   1.418
  579    HD1  HIS  44           1HD      HIS  44 -13.013  -1.861   4.505
  580    HD2  HIS  44           2HD      HIS  44 -10.776  -4.315   2.003
  581    HE1  HIS  44           1HE      HIS  44 -13.357  -4.278   5.300
  582    H    SER  45           H        SER  45  -9.939   0.193   3.588
  583    HA   SER  45           HA       SER  45  -7.239   0.336   4.260
  584    HB2  SER  45           2HB      SER  45  -9.413   0.749   6.291
  585    HB3  SER  45           1HB      SER  45  -7.897   1.631   6.094
  586    HG   SER  45           HG       SER  45  -8.839   2.922   4.737
  587    H    ARG  46           H        ARG  46  -9.816  -1.649   5.727
  588    HA   ARG  46           HA       ARG  46  -8.037  -2.782   7.672
  589    HB2  ARG  46           2HB      ARG  46 -10.902  -2.999   6.992
  590    HB3  ARG  46           1HB      ARG  46 -10.190  -4.427   7.729
  591    HG2  ARG  46           2HG      ARG  46  -9.321  -2.170   9.201
  592    HG3  ARG  46           1HG      ARG  46 -11.068  -2.043   8.972
  593    HD2  ARG  46           2HD      ARG  46 -10.997  -4.589   9.644
  594    HD3  ARG  46           1HD      ARG  46  -9.477  -4.119  10.402
  595    HE   ARG  46           HE       ARG  46 -10.866  -2.370  11.588
  596   HH11  ARG  46          2HH1      ARG  46 -12.249  -5.391  10.465
  597   HH12  ARG  46          1HH1      ARG  46 -13.460  -5.440  11.716
  598   HH21  ARG  46          2HH2      ARG  46 -12.476  -2.437  13.225
  599   HH22  ARG  46          1HH2      ARG  46 -13.584  -3.774  13.276
  600    H    CYS  47           H        CYS  47  -8.544  -3.445   4.413
  601    HA   CYS  47           HA       CYS  47  -7.825  -6.268   4.710
  602    HB2  CYS  47           2HB      CYS  47  -9.417  -4.783   2.816
  603    HB3  CYS  47           1HB      CYS  47  -8.149  -5.672   1.983
  604    H    LEU  48           H        LEU  48  -6.851  -3.390   2.846
  605    HA   LEU  48           HA       LEU  48  -4.333  -4.599   2.104
  606    HB2  LEU  48           2HB      LEU  48  -5.931  -2.378   1.234
  607    HB3  LEU  48           1HB      LEU  48  -4.308  -1.818   1.579
  608    HG   LEU  48           HG       LEU  48  -5.272  -3.644  -0.560
  609   HD11  LEU  48          1HD1      LEU  48  -4.639  -1.893  -1.748
  610   HD12  LEU  48          2HD1      LEU  48  -3.987  -1.108  -0.310
  611   HD13  LEU  48          3HD1      LEU  48  -2.971  -2.193  -1.257
  612   HD21  LEU  48          3HD2      LEU  48  -3.563  -5.072  -0.548
  613   HD22  LEU  48          1HD2      LEU  48  -2.393  -3.783  -0.257
  614   HD23  LEU  48          2HD2      LEU  48  -3.240  -4.528   1.098
  615    H    LYS  49           H        LYS  49  -3.631  -4.939   4.318
  616    HA   LYS  49           HA       LYS  49  -2.375  -2.514   5.416
  617    HB2  LYS  49           2HB      LYS  49  -2.596  -4.196   7.586
  618    HB3  LYS  49           1HB      LYS  49  -3.628  -2.814   7.263
  619    HG2  LYS  49           2HG      LYS  49  -5.201  -4.421   7.604
  620    HG3  LYS  49           1HG      LYS  49  -4.989  -4.582   5.859
  621    HD2  LYS  49           2HD      LYS  49  -3.874  -6.578   6.040
  622    HD3  LYS  49           1HD      LYS  49  -3.237  -6.199   7.642
  623    HE2  LYS  49           2HE      LYS  49  -4.959  -7.187   8.660
  624    HE3  LYS  49           1HE      LYS  49  -6.130  -6.361   7.633
  625    HZ1  LYS  49           3HZ      LYS  49  -5.408  -9.042   7.562
  626    HZ2  LYS  49           1HZ      LYS  49  -4.799  -8.353   6.135
  627    HZ3  LYS  49           2HZ      LYS  49  -6.443  -8.223   6.505
  628    H    CYS  50           H        CYS  50  -0.352  -2.811   6.418
  629    HA   CYS  50           HA       CYS  50   1.378  -4.719   5.329
  630    HB2  CYS  50           2HB      CYS  50   2.066  -2.550   6.370
  631    HB3  CYS  50           1HB      CYS  50   1.684  -3.225   7.948
  632    H    SER  51           H        SER  51   1.723  -6.800   5.825
  633    HA   SER  51           HA       SER  51   0.143  -8.019   7.907
  634    HB2  SER  51           2HB      SER  51   2.255  -9.535   6.437
  635    HB3  SER  51           1HB      SER  51   0.620 -10.029   6.880
  636    HG   SER  51           HG       SER  51   0.386  -7.993   5.219
  637    H    SER  52           H        SER  52   3.028  -6.425   7.859
  638    HA   SER  52           HA       SER  52   4.319  -8.143   9.835
  639    HB2  SER  52           2HB      SER  52   5.870  -5.821   9.151
  640    HB3  SER  52           1HB      SER  52   6.214  -7.525   8.837
  641    HG   SER  52           HG       SER  52   4.710  -5.730   7.223
  642    H    CYS  53           H        CYS  53   3.454  -4.659   9.470
  643    HA   CYS  53           HA       CYS  53   3.551  -4.522  12.413
  644    HB2  CYS  53           2HB      CYS  53   4.062  -2.170  12.267
  645    HB3  CYS  53           1HB      CYS  53   5.206  -3.067  11.280
  646    H    GLN  54           H        GLN  54   1.470  -4.694   9.897
  647    HA   GLN  54           HA       GLN  54  -0.755  -4.462   9.675
  648    HB2  GLN  54           2HB      GLN  54  -0.484  -4.154  12.641
  649    HB3  GLN  54           1HB      GLN  54  -2.045  -3.925  11.864
  650    HG2  GLN  54           2HG      GLN  54  -0.888  -6.314  10.860
  651    HG3  GLN  54           1HG      GLN  54  -0.788  -6.338  12.619
  652   HE21  GLN  54          1HE2      GLN  54  -3.287  -4.695  10.772
  653   HE22  GLN  54          2HE2      GLN  54  -4.584  -5.711  11.297
  654    H    ALA  55           H        ALA  55   0.845  -2.298   9.005
  655    HA   ALA  55           HA       ALA  55  -0.606   0.082   9.810
  656    HB1  ALA  55           1HB      ALA  55   0.981   1.313   8.606
  657    HB2  ALA  55           2HB      ALA  55   1.904  -0.043   9.251
  658    HB3  ALA  55           3HB      ALA  55   1.383  -0.052   7.566
  659    H    GLN  56           H        GLN  56  -2.424   0.718   8.855
  660    HA   GLN  56           HA       GLN  56  -3.574  -0.639   6.666
  661    HB2  GLN  56           2HB      GLN  56  -4.223   1.858   8.184
  662    HB3  GLN  56           1HB      GLN  56  -5.095   1.500   6.698
  663    HG2  GLN  56           2HG      GLN  56  -6.106  -0.366   7.579
  664    HG3  GLN  56           1HG      GLN  56  -4.863  -0.591   8.805
  665   HE21  GLN  56          1HE2      GLN  56  -6.769   2.286   7.973
  666   HE22  GLN  56          2HE2      GLN  56  -7.497   2.452   9.539
  667    H    LEU  57           H        LEU  57  -2.322  -0.626   4.868
  668    HA   LEU  57           HA       LEU  57  -1.104   1.787   3.878
  669    HB2  LEU  57           2HB      LEU  57  -1.314  -0.986   2.706
  670    HB3  LEU  57           1HB      LEU  57  -0.398   0.323   1.984
  671    HG   LEU  57           HG       LEU  57   0.185  -0.564   4.789
  672   HD11  LEU  57          1HD1      LEU  57   0.767  -2.583   4.057
  673   HD12  LEU  57          2HD1      LEU  57   0.568  -2.115   2.366
  674   HD13  LEU  57          3HD1      LEU  57   2.085  -1.783   3.201
  675   HD21  LEU  57          3HD2      LEU  57   1.150   1.464   3.184
  676   HD22  LEU  57          1HD2      LEU  57   1.924   0.821   4.634
  677   HD23  LEU  57          2HD2      LEU  57   2.376   0.202   3.045
  678    H    GLY  58           H        GLY  58  -4.074   0.123   3.446
  679    HA2  GLY  58           1HA      GLY  58  -4.699   1.116   0.845
  680    HA3  GLY  58           2HA      GLY  58  -5.834   0.411   1.987
  681    H    ASP  59           H        ASP  59  -4.328   2.813   3.636
  682    HA   ASP  59           HA       ASP  59  -6.559   4.628   3.122
  683    HB2  ASP  59           2HB      ASP  59  -4.786   4.117   5.463
  684    HB3  ASP  59           1HB      ASP  59  -5.455   5.734   5.276
  685    H    ILE  60           H        ILE  60  -3.666   4.228   1.930
  686    HA   ILE  60           HA       ILE  60  -3.369   7.037   1.264
  687    HB   ILE  60           HB       ILE  60  -0.713   6.209   1.654
  688   HG12  ILE  60          2HG1      ILE  60  -1.385   6.141   4.395
  689   HG13  ILE  60          1HG1      ILE  60  -2.429   4.960   3.611
  690   HG21  ILE  60          1HG2      ILE  60  -0.722   8.365   2.157
  691   HG22  ILE  60          2HG2      ILE  60  -2.470   8.348   2.395
  692   HG23  ILE  60          3HG2      ILE  60  -1.395   7.957   3.736
  693   HD11  ILE  60          3HD1      ILE  60  -0.722   3.561   3.828
  694   HD12  ILE  60          1HD1      ILE  60   0.021   4.446   2.494
  695   HD13  ILE  60          2HD1      ILE  60   0.416   4.866   4.162
  696    H    GLY  61           H        GLY  61  -2.668   7.309  -0.781
  697    HA2  GLY  61           1HA      GLY  61  -2.370   4.999  -2.466
  698    HA3  GLY  61           2HA      GLY  61  -2.264   6.678  -2.972
  699    H    THR  62           H        THR  62  -0.380   4.761  -0.647
  700    HA   THR  62           HA       THR  62   2.071   5.698  -1.958
  701    HB   THR  62           HB       THR  62   2.155   4.183   0.606
  702    HG1  THR  62           1HG      THR  62   1.178   6.854   0.315
  703   HG21  THR  62          3HG2      THR  62   4.125   5.210  -0.710
  704   HG22  THR  62          1HG2      THR  62   4.052   5.475   1.032
  705   HG23  THR  62          2HG2      THR  62   3.548   6.752  -0.076
  706    H    SER  63           H        SER  63   3.763   4.218  -2.435
  707    HA   SER  63           HA       SER  63   2.840   1.809  -3.608
  708    HB2  SER  63           2HB      SER  63   5.617   1.670  -3.543
  709    HB3  SER  63           1HB      SER  63   4.641   2.368  -4.836
  710    HG   SER  63           HG       SER  63   5.782   4.092  -4.329
  711    H    SER  64           H        SER  64   2.136   0.256  -2.209
  712    HA   SER  64           HA       SER  64   3.681  -0.534   0.087
  713    HB2  SER  64           2HB      SER  64   1.741  -2.493  -0.840
  714    HB3  SER  64           1HB      SER  64   1.768  -1.579   0.668
  715    HG   SER  64           HG       SER  64   0.859   0.193  -0.521
  716    H    TYR  65           H        TYR  65   4.689  -2.662   0.302
  717    HA   TYR  65           HA       TYR  65   5.761  -3.561  -2.295
  718    HB2  TYR  65           2HB      TYR  65   7.123  -3.330   0.392
  719    HB3  TYR  65           1HB      TYR  65   7.813  -4.214  -0.966
  720    HD1  TYR  65           2HD      TYR  65   6.957  -0.901   0.341
  721    HD2  TYR  65           1HD      TYR  65   8.695  -3.042  -2.897
  722    HE1  TYR  65           2HE      TYR  65   7.908   1.191  -0.522
  723    HE2  TYR  65           1HE      TYR  65   9.648  -0.951  -3.773
  724    HH   TYR  65           HH       TYR  65  10.007   1.777  -2.055
  725    H    THR  66           H        THR  66   6.448  -5.798  -2.408
  726    HA   THR  66           HA       THR  66   5.380  -7.593  -0.396
  727    HB   THR  66           HB       THR  66   3.492  -7.116  -2.001
  728    HG1  THR  66           1HG      THR  66   3.412  -9.018  -0.833
  729   HG21  THR  66          3HG2      THR  66   3.946  -8.785  -4.106
  730   HG22  THR  66          1HG2      THR  66   5.524  -8.025  -3.905
  731   HG23  THR  66          2HG2      THR  66   4.093  -7.027  -4.163
  732    H    LYS  67           H        LYS  67   5.816  -9.924  -1.097
  733    HA   LYS  67           HA       LYS  67   7.826 -10.446  -3.024
  734    HB2  LYS  67           2HB      LYS  67   9.044  -9.296  -1.019
  735    HB3  LYS  67           1HB      LYS  67   8.835 -10.851  -0.224
  736    HG2  LYS  67           2HG      LYS  67  10.153 -11.965  -1.853
  737    HG3  LYS  67           1HG      LYS  67  10.146 -10.557  -2.916
  738    HD2  LYS  67           2HD      LYS  67  11.455  -9.306  -1.280
  739    HD3  LYS  67           1HD      LYS  67  11.443 -10.700  -0.197
  740    HE2  LYS  67           2HE      LYS  67  13.218 -11.548  -1.219
  741    HE3  LYS  67           1HE      LYS  67  12.366 -11.537  -2.761
  742    HZ1  LYS  67           3HZ      LYS  67  13.364  -9.630  -3.403
  743    HZ2  LYS  67           1HZ      LYS  67  14.572 -10.162  -2.340
  744    HZ3  LYS  67           2HZ      LYS  67  13.457  -8.991  -1.836
  745    H    SER  68           H        SER  68   7.105 -11.700   0.228
  746    HA   SER  68           HA       SER  68   6.804 -14.374  -0.861
  747    HB2  SER  68           2HB      SER  68   6.268 -14.462   1.873
  748    HB3  SER  68           1HB      SER  68   7.824 -14.791   1.105
  749    HG   SER  68           HG       SER  68   8.390 -13.177   2.366
  750    H    GLY  69           H        GLY  69   4.782 -12.436  -1.575
  751    HA2  GLY  69           1HA      GLY  69   2.505 -12.571  -1.936
  752    HA3  GLY  69           2HA      GLY  69   2.468 -13.994  -0.911
  753    H    MET  70           H        MET  70   3.979 -11.605   0.792
  754    HA   MET  70           HA       MET  70   1.503 -10.953   2.229
  755    HB2  MET  70           2HB      MET  70   4.325 -10.461   3.199
  756    HB3  MET  70           1HB      MET  70   2.846 -10.484   4.146
  757    HG2  MET  70           2HG      MET  70   2.640 -12.919   3.621
  758    HG3  MET  70           1HG      MET  70   4.243 -12.831   2.891
  759    HE1  MET  70           3HE      MET  70   6.286 -13.205   4.004
  760    HE2  MET  70           1HE      MET  70   6.344 -11.538   4.578
  761    HE3  MET  70           2HE      MET  70   6.674 -12.863   5.691
  762    H    ILE  71           H        ILE  71   1.061  -8.804   2.857
  763    HA   ILE  71           HA       ILE  71   2.172  -6.791   1.057
  764    HB   ILE  71           HB       ILE  71   0.137  -6.064   3.106
  765   HG12  ILE  71          2HG1      ILE  71  -1.497  -6.847   1.088
  766   HG13  ILE  71          1HG1      ILE  71  -0.280  -8.119   1.025
  767   HG21  ILE  71          1HG2      ILE  71  -0.549  -5.195   0.529
  768   HG22  ILE  71          2HG2      ILE  71   0.130  -4.248   1.850
  769   HG23  ILE  71          3HG2      ILE  71   1.199  -5.011   0.674
  770   HD11  ILE  71          3HD1      ILE  71  -1.972  -8.905   2.449
  771   HD12  ILE  71          1HD1      ILE  71  -0.651  -8.405   3.509
  772   HD13  ILE  71          2HD1      ILE  71  -2.068  -7.370   3.313
  773    H    LEU  72           H        LEU  72   3.730  -5.437   1.706
  774    HA   LEU  72           HA       LEU  72   4.127  -5.092   4.600
  775    HB2  LEU  72           2HB      LEU  72   6.032  -6.090   2.549
  776    HB3  LEU  72           1HB      LEU  72   6.669  -5.017   3.783
  777    HG   LEU  72           HG       LEU  72   5.452  -6.684   5.418
  778   HD11  LEU  72          1HD1      LEU  72   4.507  -7.931   3.392
  779   HD12  LEU  72          2HD1      LEU  72   6.130  -8.603   3.223
  780   HD13  LEU  72          3HD1      LEU  72   5.212  -8.882   4.704
  781   HD21  LEU  72          3HD2      LEU  72   7.700  -8.184   4.783
  782   HD22  LEU  72          1HD2      LEU  72   8.099  -6.546   4.262
  783   HD23  LEU  72          2HD2      LEU  72   7.614  -6.845   5.931
  784    H    CYS  73           H        CYS  73   4.820  -3.090   5.263
  785    HA   CYS  73           HA       CYS  73   4.434  -0.931   3.444
  786    HB2  CYS  73           2HB      CYS  73   4.929   0.518   5.334
  787    HB3  CYS  73           1HB      CYS  73   3.842  -0.768   5.836
  788    H    ARG  74           H        ARG  74   6.139   0.892   3.426
  789    HA   ARG  74           HA       ARG  74   8.297  -0.019   1.899
  790    HB2  ARG  74           2HB      ARG  74   8.145   2.632   3.336
  791    HB3  ARG  74           1HB      ARG  74   9.089   2.256   1.902
  792    HG2  ARG  74           2HG      ARG  74   7.177   2.142   0.541
  793    HG3  ARG  74           1HG      ARG  74   6.092   2.072   1.932
  794    HD2  ARG  74           2HD      ARG  74   5.938   4.275   1.065
  795    HD3  ARG  74           1HD      ARG  74   6.903   4.380   2.537
  796    HE   ARG  74           HE       ARG  74   8.010   4.448  -0.203
  797   HH11  ARG  74          2HH1      ARG  74   8.181   5.293   3.205
  798   HH12  ARG  74          1HH1      ARG  74   9.553   6.340   2.996
  799   HH21  ARG  74          2HH2      ARG  74   9.834   5.827  -0.454
  800   HH22  ARG  74          1HH2      ARG  74  10.504   6.628   0.945
  801    H    ASN  75           H        ASN  75   8.156   1.055   5.268
  802    HA   ASN  75           HA       ASN  75  10.935   0.836   5.768
  803    HB2  ASN  75           2HB      ASN  75   9.363   2.181   7.152
  804    HB3  ASN  75           1HB      ASN  75   8.658   0.685   7.756
  805   HD21  ASN  75          1HD2      ASN  75  11.443   2.756   7.776
  806   HD22  ASN  75          2HD2      ASN  75  12.195   2.066   9.178
  807    H    ASP  76           H        ASP  76   8.216  -1.359   6.193
  808    HA   ASP  76           HA       ASP  76   9.640  -3.230   7.781
  809    HB2  ASP  76           2HB      ASP  76   6.964  -2.917   6.802
  810    HB3  ASP  76           1HB      ASP  76   7.507  -4.573   6.538
  811    H    TYR  77           H        TYR  77   8.801  -3.134   4.337
  812    HA   TYR  77           HA       TYR  77   9.612  -5.735   3.737
  813    HB2  TYR  77           2HB      TYR  77   8.324  -4.510   2.123
  814    HB3  TYR  77           1HB      TYR  77   9.583  -3.284   1.975
  815    HD1  TYR  77           1HD      TYR  77   9.594  -7.030   1.887
  816    HD2  TYR  77           2HD      TYR  77  10.613  -3.398  -0.084
  817    HE1  TYR  77           1HE      TYR  77  10.678  -8.313   0.089
  818    HE2  TYR  77           2HE      TYR  77  11.690  -4.670  -1.889
  819    HH   TYR  77           HH       TYR  77  12.840  -7.193  -1.900
  820    H    ILE  78           H        ILE  78  11.499  -2.727   3.710
  821    HA   ILE  78           HA       ILE  78  13.844  -4.039   2.705
  822    HB   ILE  78           HB       ILE  78  13.819  -1.379   4.123
  823   HG12  ILE  78          2HG1      ILE  78  13.344  -1.821   1.168
  824   HG13  ILE  78          1HG1      ILE  78  12.045  -1.537   2.322
  825   HG21  ILE  78          1HG2      ILE  78  15.635  -2.753   2.174
  826   HG22  ILE  78          2HG2      ILE  78  15.636  -0.997   2.334
  827   HG23  ILE  78          3HG2      ILE  78  16.025  -2.008   3.724
  828   HD11  ILE  78          3HD1      ILE  78  13.638   0.558   2.874
  829   HD12  ILE  78          1HD1      ILE  78  13.983   0.337   1.160
  830   HD13  ILE  78          2HD1      ILE  78  12.324   0.596   1.696
  831    H    ARG  79           H        ARG  79  12.551  -3.271   5.850
  832    HA   ARG  79           HA       ARG  79  14.930  -3.857   7.322
  833    HB2  ARG  79           2HB      ARG  79  13.006  -2.428   8.117
  834    HB3  ARG  79           1HB      ARG  79  12.087  -3.909   8.335
  835    HG2  ARG  79           2HG      ARG  79  14.137  -4.616   9.796
  836    HG3  ARG  79           1HG      ARG  79  14.410  -2.875   9.883
  837    HD2  ARG  79           2HD      ARG  79  13.001  -3.924  11.725
  838    HD3  ARG  79           1HD      ARG  79  12.349  -2.491  10.933
  839    HE   ARG  79           HE       ARG  79  10.728  -3.825   9.884
  840   HH11  ARG  79          2HH1      ARG  79  12.821  -5.708  11.978
  841   HH12  ARG  79          1HH1      ARG  79  11.780  -7.105  11.955
  842   HH21  ARG  79          2HH2      ARG  79   9.354  -5.656   9.884
  843   HH22  ARG  79          1HH2      ARG  79   9.825  -7.067  10.799
  844    H    LEU  80           H        LEU  80  12.349  -5.726   5.990
  845    HA   LEU  80           HA       LEU  80  13.046  -8.067   7.584
  846    HB2  LEU  80           2HB      LEU  80  10.670  -7.109   6.454
  847    HB3  LEU  80           1HB      LEU  80  11.079  -8.538   5.520
  848    HG   LEU  80           HG       LEU  80  11.275  -8.866   8.445
  849   HD11  LEU  80          1HD1      LEU  80   8.637  -8.340   7.091
  850   HD12  LEU  80          2HD1      LEU  80   8.804  -9.149   8.648
  851   HD13  LEU  80          3HD1      LEU  80   9.336  -7.478   8.462
  852   HD21  LEU  80          3HD2      LEU  80  10.264 -10.422   6.094
  853   HD22  LEU  80          1HD2      LEU  80  11.574 -10.811   7.208
  854   HD23  LEU  80          2HD2      LEU  80   9.897 -10.923   7.744
  855    H    PHE  81           H        PHE  81  12.557  -7.370   4.109
  856    HA   PHE  81           HA       PHE  81  14.329  -9.649   3.522
  857    HB2  PHE  81           2HB      PHE  81  12.240  -8.369   1.748
  858    HB3  PHE  81           1HB      PHE  81  13.218  -9.772   1.342
  859    HD1  PHE  81           2HD      PHE  81  12.832 -11.923   2.479
  860    HD2  PHE  81           1HD      PHE  81  10.312  -8.555   3.124
  861    HE1  PHE  81           2HE      PHE  81  11.111 -13.400   3.428
  862    HE2  PHE  81           1HE      PHE  81   8.584 -10.030   4.072
  863    HZ   PHE  81           HZ       PHE  81   8.986 -12.454   4.228
  864    H    GLY  82           H        GLY  82  13.343  -7.098   1.322
  865    HA2  GLY  82           1HA      GLY  82  14.783  -5.271   0.651
  866    HA3  GLY  82           2HA      GLY  82  16.163  -6.274   1.091
  Start of MODEL   12
    1    H    SER 641           1H       SER 641  20.441 -16.800 -15.487
    2    HA   SER 641           HA       SER 641  17.793 -18.082 -15.676
    3    HB2  SER 641           2HB      SER 641  19.667 -20.058 -15.562
    4    HB3  SER 641           1HB      SER 641  19.060 -19.364 -17.064
    5    HG   SER 641           HG       SER 641  20.859 -18.125 -17.246
    6    H    LEU 642           H        LEU 642  20.743 -17.751 -13.751
    7    HA   LEU 642           HA       LEU 642  21.270 -18.219 -11.609
    8    HB2  LEU 642           2HB      LEU 642  18.498 -17.297 -11.521
    9    HB3  LEU 642           1HB      LEU 642  18.934 -18.307 -10.155
   10    HG   LEU 642           HG       LEU 642  20.212 -15.709 -10.992
   11   HD11  LEU 642          1HD1      LEU 642  18.074 -16.258  -9.330
   12   HD12  LEU 642          2HD1      LEU 642  19.433 -16.059  -8.226
   13   HD13  LEU 642          3HD1      LEU 642  19.025 -14.773  -9.361
   14   HD21  LEU 642          3HD2      LEU 642  21.127 -17.723  -8.947
   15   HD22  LEU 642          1HD2      LEU 642  22.015 -17.154 -10.359
   16   HD23  LEU 642          2HD2      LEU 642  21.697 -16.055  -9.018
   17    H    GLN 643           H        GLN 643  20.722 -20.384 -13.404
   18    HA   GLN 643           HA       GLN 643  19.748 -22.474 -11.586
   19    HB2  GLN 643           2HB      GLN 643  19.999 -22.233 -14.548
   20    HB3  GLN 643           1HB      GLN 643  20.168 -23.835 -13.840
   21    HG2  GLN 643           2HG      GLN 643  17.982 -24.020 -13.489
   22    HG3  GLN 643           1HG      GLN 643  17.873 -22.403 -12.793
   23   HE21  GLN 643          1HE2      GLN 643  17.133 -24.352 -15.423
   24   HE22  GLN 643          2HE2      GLN 643  16.600 -23.112 -16.511
   25    H    ASN 644           H        ASN 644  22.483 -20.931 -12.538
   26    HA   ASN 644           HA       ASN 644  24.193 -23.191 -11.729
   27    HB2  ASN 644           2HB      ASN 644  24.503 -22.086 -14.061
   28    HB3  ASN 644           1HB      ASN 644  25.165 -20.724 -13.166
   29   HD21  ASN 644          1HD2      ASN 644  27.159 -20.984 -14.125
   30   HD22  ASN 644          2HD2      ASN 644  28.239 -22.267 -13.690
   31    H    ASN 645           H        ASN 645  26.058 -22.517 -10.333
   32    HA   ASN 645           HA       ASN 645  25.338 -20.136  -8.749
   33    HB2  ASN 645           2HB      ASN 645  25.378 -22.735  -7.837
   34    HB3  ASN 645           1HB      ASN 645  26.957 -22.130  -7.340
   35   HD21  ASN 645          1HD2      ASN 645  23.497 -21.469  -7.210
   36   HD22  ASN 645          2HD2      ASN 645  23.543 -20.577  -5.723
   37    H    GLN 646           H        GLN 646  27.018 -20.111 -11.011
   38    HA   GLN 646           HA       GLN 646  29.595 -19.435  -9.750
   39    HB2  GLN 646           2HB      GLN 646  28.949 -20.813 -12.278
   40    HB3  GLN 646           1HB      GLN 646  30.195 -19.578 -12.403
   41    HG2  GLN 646           2HG      GLN 646  31.494 -21.369 -11.913
   42    HG3  GLN 646           1HG      GLN 646  31.146 -20.814 -10.277
   43   HE21  GLN 646          1HE2      GLN 646  30.138 -23.088 -12.769
   44   HE22  GLN 646          2HE2      GLN 646  29.519 -24.285 -11.676
   45    H    ASP 647           H        ASP 647  26.903 -18.378 -11.604
   46    HA   ASP 647           HA       ASP 647  28.167 -15.953 -12.538
   47    HB2  ASP 647           2HB      ASP 647  25.744 -15.417 -13.244
   48    HB3  ASP 647           1HB      ASP 647  26.558 -16.749 -14.051
   49    H    VAL 648           H        VAL 648  26.853 -16.982  -9.663
   50    HA   VAL 648           HA       VAL 648  25.739 -14.455  -8.821
   51    HB   VAL 648           HB       VAL 648  26.461 -16.413  -6.730
   52   HG11  VAL 648          1HG1      VAL 648  23.774 -15.234  -7.379
   53   HG12  VAL 648          2HG1      VAL 648  24.370 -15.822  -5.828
   54   HG13  VAL 648          3HG1      VAL 648  25.018 -14.332  -6.514
   55   HG21  VAL 648          3HG2      VAL 648  24.062 -17.390  -7.918
   56   HG22  VAL 648          1HG2      VAL 648  25.339 -17.400  -9.135
   57   HG23  VAL 648          2HG2      VAL 648  25.569 -18.249  -7.605
   58    H    SER 649           H        SER 649  27.348 -12.929  -8.937
   59    HA   SER 649           HA       SER 649  29.585 -13.288  -7.063
   60    HB2  SER 649           2HB      SER 649  30.014 -11.425  -9.303
   61    HB3  SER 649           1HB      SER 649  31.105 -12.631  -8.618
   62    HG   SER 649           HG       SER 649  29.130 -13.934  -9.795
   63    H    PHE 650           H        PHE 650  30.311 -11.379  -6.000
   64    HA   PHE 650           HA       PHE 650  30.101  -9.403  -4.907
   65    HB2  PHE 650           2HB      PHE 650  29.362  -8.830  -7.597
   66    HB3  PHE 650           1HB      PHE 650  28.282  -7.932  -6.538
   67    HD1  PHE 650           2HD      PHE 650  31.924  -8.752  -6.703
   68    HD2  PHE 650           1HD      PHE 650  28.935  -5.798  -6.023
   69    HE1  PHE 650           2HE      PHE 650  33.681  -7.068  -6.352
   70    HE2  PHE 650           1HE      PHE 650  30.690  -4.104  -5.667
   71    HZ   PHE 650           HZ       PHE 650  33.066  -4.742  -5.834
   72    H    GLU 651           H        GLU 651  28.233 -11.557  -4.434
   73    HA   GLU 651           HA       GLU 651  25.643 -10.388  -3.995
   74    HB2  GLU 651           2HB      GLU 651  24.934 -12.534  -3.454
   75    HB3  GLU 651           1HB      GLU 651  26.247 -12.852  -4.575
   76    HG2  GLU 651           2HG      GLU 651  26.583 -12.887  -1.589
   77    HG3  GLU 651           1HG      GLU 651  26.164 -14.309  -2.539
   78    H    ASN 652           H        ASN 652  28.575 -10.565  -2.282
   79    HA   ASN 652           HA       ASN 652  27.580 -10.672   0.370
   80    HB2  ASN 652           2HB      ASN 652  29.995 -11.060  -0.508
   81    HB3  ASN 652           1HB      ASN 652  30.158  -9.314  -0.355
   82   HD21  ASN 652          1HD2      ASN 652  29.326 -12.241   1.422
   83   HD22  ASN 652          2HD2      ASN 652  29.848 -11.654   2.974
   84    H    ILE 653           H        ILE 653  28.406  -8.021  -1.803
   85    HA   ILE 653           HA       ILE 653  27.430  -6.110   0.204
   86    HB   ILE 653           HB       ILE 653  28.771  -5.263  -2.339
   87   HG12  ILE 653          2HG1      ILE 653  30.637  -5.431  -0.133
   88   HG13  ILE 653          1HG1      ILE 653  29.989  -7.021  -0.521
   89   HG21  ILE 653          1HG2      ILE 653  28.882  -4.097   0.436
   90   HG22  ILE 653          2HG2      ILE 653  29.404  -3.343  -1.069
   91   HG23  ILE 653          3HG2      ILE 653  27.690  -3.639  -0.780
   92   HD11  ILE 653          3HD1      ILE 653  31.857  -6.900  -1.858
   93   HD12  ILE 653          1HD1      ILE 653  30.580  -6.387  -2.962
   94   HD13  ILE 653          2HD1      ILE 653  31.627  -5.187  -2.205
   95    H    GLN 654           H        GLN 654  25.248  -6.096  -0.059
   96    HA   GLN 654           HA       GLN 654  24.070  -6.190  -2.703
   97    HB2  GLN 654           2HB      GLN 654  22.958  -6.103   0.091
   98    HB3  GLN 654           1HB      GLN 654  21.915  -5.899  -1.311
   99    HG2  GLN 654           2HG      GLN 654  23.410  -8.159  -1.898
  100    HG3  GLN 654           1HG      GLN 654  23.046  -8.303  -0.178
  101   HE21  GLN 654          1HE2      GLN 654  20.541  -6.750  -0.512
  102   HE22  GLN 654          2HE2      GLN 654  19.411  -7.851  -1.224
  103    H    TRP 655           H        TRP 655  25.550  -4.019  -2.806
  104    HA   TRP 655           HA       TRP 655  23.845  -1.739  -2.128
  105    HB2  TRP 655           2HB      TRP 655  25.742  -0.334  -2.377
  106    HB3  TRP 655           1HB      TRP 655  26.293  -1.745  -1.486
  107    HD1  TRP 655           HD       TRP 655  27.397  -3.721  -3.341
  108    HE1  TRP 655           1HE      TRP 655  29.185  -3.238  -5.124
  109    HE3  TRP 655           3HE      TRP 655  26.763   1.334  -3.777
  110    HZ2  TRP 655           2HZ      TRP 655  30.202  -1.007  -6.526
  111    HZ3  TRP 655           3HZ      TRP 655  28.185   2.569  -5.359
  112    HH2  TRP 655           HH       TRP 655  29.871   1.418  -6.706
  113    H    SER 656           H        SER 656  22.786  -0.603  -3.610
  114    HA   SER 656           HA       SER 656  22.860  -1.558  -6.351
  115    HB2  SER 656           2HB      SER 656  21.084   0.701  -5.639
  116    HB3  SER 656           1HB      SER 656  20.725  -0.782  -6.524
  117    HG   SER 656           HG       SER 656  20.821  -0.358  -3.727
  118    H    ILE 657           H        ILE 657  24.274  -0.696  -7.706
  119    HA   ILE 657           HA       ILE 657  25.601   1.770  -7.207
  120    HB   ILE 657           HB       ILE 657  25.631   0.465  -9.901
  121   HG12  ILE 657          2HG1      ILE 657  27.697  -0.724  -8.448
  122   HG13  ILE 657          1HG1      ILE 657  26.295  -0.833  -7.388
  123   HG21  ILE 657          1HG2      ILE 657  26.956   2.399  -9.789
  124   HG22  ILE 657          2HG2      ILE 657  27.605   1.965  -8.207
  125   HG23  ILE 657          3HG2      ILE 657  28.087   1.055  -9.638
  126   HD11  ILE 657          3HD1      ILE 657  25.043  -1.904  -9.217
  127   HD12  ILE 657          1HD1      ILE 657  26.500  -1.858 -10.208
  128   HD13  ILE 657          2HD1      ILE 657  26.469  -2.819  -8.729
  129    H    ASP 658           H        ASP 658  22.700   0.940  -8.642
  130    HA   ASP 658           HA       ASP 658  22.348   2.942 -10.577
  131    HB2  ASP 658           2HB      ASP 658  20.088   1.978  -8.846
  132    HB3  ASP 658           1HB      ASP 658  20.071   2.378 -10.558
  133    HA   PRO 659           HA       PRO 659  22.151   6.501  -7.972
  134    HB2  PRO 659           2HB      PRO 659  21.327   8.312  -9.771
  135    HB3  PRO 659           1HB      PRO 659  22.928   7.571  -9.870
  136    HG2  PRO 659           2HG      PRO 659  20.441   6.917 -11.397
  137    HG3  PRO 659           1HG      PRO 659  22.111   7.040 -11.980
  138    HD2  PRO 659           2HD      PRO 659  20.860   4.673 -11.390
  139    HD3  PRO 659           1HD      PRO 659  22.617   4.906 -11.330
  140    H    GLY 660           H        GLY 660  20.079   4.996  -7.227
  141    HA2  GLY 660           1HA      GLY 660  18.138   5.429  -6.005
  142    HA3  GLY 660           2HA      GLY 660  18.002   6.983  -6.813
  143    H    ALA 661           H        ALA 661  17.889   3.524  -7.656
  144    HA   ALA 661           HA       ALA 661  15.842   4.059  -9.659
  145    HB1  ALA 661           1HB      ALA 661  16.006   1.467  -9.853
  146    HB2  ALA 661           2HB      ALA 661  17.322   2.468 -10.463
  147    HB3  ALA 661           3HB      ALA 661  17.474   1.668  -8.897
  148    H    ASP 662           H        ASP 662  16.133   3.143  -6.405
  149    HA   ASP 662           HA       ASP 662  14.653   2.663  -4.764
  150    HB2  ASP 662           2HB      ASP 662  13.248   4.319  -6.563
  151    HB3  ASP 662           1HB      ASP 662  12.138   3.025  -6.121
  152    H    LEU 663           H        LEU 663  11.904   1.619  -5.275
  153    HA   LEU 663           HA       LEU 663  12.713  -1.126  -5.982
  154    HB2  LEU 663           2HB      LEU 663  11.327  -0.022  -3.687
  155    HB3  LEU 663           1HB      LEU 663  10.356  -1.249  -4.476
  156    HG   LEU 663           HG       LEU 663  12.230  -2.847  -4.254
  157   HD11  LEU 663          1HD1      LEU 663  13.838  -1.795  -2.293
  158   HD12  LEU 663          2HD1      LEU 663  14.269  -1.959  -3.996
  159   HD13  LEU 663          3HD1      LEU 663  13.623  -0.431  -3.391
  160   HD21  LEU 663          3HD2      LEU 663  12.144  -2.895  -1.680
  161   HD22  LEU 663          1HD2      LEU 663  11.057  -1.516  -1.843
  162   HD23  LEU 663          2HD2      LEU 663  10.636  -3.062  -2.579
  163    H    SER 664           H        SER 664  12.127   0.074  -8.141
  164    HA   SER 664           HA       SER 664   9.514   0.800  -8.760
  165    HB2  SER 664           2HB      SER 664  10.744  -0.182 -11.113
  166    HB3  SER 664           1HB      SER 664  10.623   1.492 -10.568
  167    HG   SER 664           HG       SER 664  12.635   1.431  -9.886
  168    H    GLN 665           H        GLN 665  11.136  -2.338  -9.106
  169    HA   GLN 665           HA       GLN 665   8.930  -3.503 -10.537
  170    HB2  GLN 665           2HB      GLN 665  11.266  -4.908  -9.237
  171    HB3  GLN 665           1HB      GLN 665  10.205  -5.558 -10.479
  172    HG2  GLN 665           2HG      GLN 665  11.961  -4.960 -11.778
  173    HG3  GLN 665           1HG      GLN 665  11.066  -3.441 -11.808
  174   HE21  GLN 665          1HE2      GLN 665  13.612  -3.237 -12.411
  175   HE22  GLN 665          2HE2      GLN 665  14.545  -2.575 -11.108
  176    H    TYR 666           H        TYR 666   9.804  -3.170  -7.219
  177    HA   TYR 666           HA       TYR 666   8.049  -5.346  -6.383
  178    HB2  TYR 666           2HB      TYR 666   9.940  -3.534  -4.879
  179    HB3  TYR 666           1HB      TYR 666   8.835  -4.636  -4.063
  180    HD1  TYR 666           1HD      TYR 666   8.940  -7.092  -5.451
  181    HD2  TYR 666           2HD      TYR 666  12.097  -4.318  -4.805
  182    HE1  TYR 666           1HE      TYR 666  10.574  -8.915  -5.668
  183    HE2  TYR 666           2HE      TYR 666  13.743  -6.132  -5.020
  184    HH   TYR 666           HH       TYR 666  13.136  -9.033  -6.355
  185    H    LYS 667           H        LYS 667   7.708  -2.196  -7.233
  186    HA   LYS 667           HA       LYS 667   6.082  -1.113  -5.203
  187    HB2  LYS 667           2HB      LYS 667   6.679  -0.489  -8.025
  188    HB3  LYS 667           1HB      LYS 667   5.188   0.172  -7.385
  189    HG2  LYS 667           2HG      LYS 667   6.429   1.264  -5.596
  190    HG3  LYS 667           1HG      LYS 667   7.937   0.603  -6.239
  191    HD2  LYS 667           2HD      LYS 667   7.804   2.814  -7.063
  192    HD3  LYS 667           1HD      LYS 667   7.355   1.772  -8.414
  193    HE2  LYS 667           2HE      LYS 667   5.608   3.179  -8.596
  194    HE3  LYS 667           1HE      LYS 667   4.933   2.200  -7.297
  195    HZ1  LYS 667           3HZ      LYS 667   6.545   4.141  -6.119
  196    HZ2  LYS 667           1HZ      LYS 667   4.855   4.007  -6.053
  197    HZ3  LYS 667           2HZ      LYS 667   5.585   4.936  -7.271
  198    H    MET 668           H        MET 668   4.126  -1.694  -4.610
  199    HA   MET 668           HA       MET 668   2.396  -3.092  -6.511
  200    HB2  MET 668           2HB      MET 668   2.867  -3.844  -4.084
  201    HB3  MET 668           1HB      MET 668   1.758  -2.561  -3.618
  202    HG2  MET 668           2HG      MET 668  -0.065  -3.656  -4.403
  203    HG3  MET 668           1HG      MET 668   0.835  -4.464  -5.687
  204    HE1  MET 668           3HE      MET 668   1.155  -5.368  -1.289
  205    HE2  MET 668           1HE      MET 668   2.725  -5.477  -2.085
  206    HE3  MET 668           2HE      MET 668   1.782  -3.990  -2.193
  207    H    ASP 669           H        ASP 669   1.914  -1.306  -7.806
  208    HA   ASP 669           HA       ASP 669   0.910   1.147  -6.791
  209    HB2  ASP 669           2HB      ASP 669   1.941   0.719  -9.097
  210    HB3  ASP 669           1HB      ASP 669   0.368   0.072  -9.557
  211    H    VAL 670           H        VAL 670  -0.966   1.413  -5.816
  212    HA   VAL 670           HA       VAL 670  -2.984  -0.638  -5.998
  213    HB   VAL 670           HB       VAL 670  -3.103   1.902  -4.383
  214   HG11  VAL 670          1HG1      VAL 670  -4.709   0.783  -3.047
  215   HG12  VAL 670          2HG1      VAL 670  -5.191   0.541  -4.727
  216   HG13  VAL 670          3HG1      VAL 670  -4.394  -0.760  -3.842
  217   HG21  VAL 670          3HG2      VAL 670  -2.385  -0.445  -2.867
  218   HG22  VAL 670          1HG2      VAL 670  -1.194  -0.120  -4.125
  219   HG23  VAL 670          2HG2      VAL 670  -1.589   1.129  -2.944
  220    H    THR 671           H        THR 671  -4.435  -0.589  -7.561
  221    HA   THR 671           HA       THR 671  -5.383   1.924  -8.667
  222    HB   THR 671           HB       THR 671  -6.717  -0.627  -9.407
  223    HG1  THR 671           1HG      THR 671  -4.021  -0.044 -10.179
  224   HG21  THR 671          3HG2      THR 671  -6.875   0.346 -11.506
  225   HG22  THR 671          1HG2      THR 671  -5.453   1.361 -11.258
  226   HG23  THR 671          2HG2      THR 671  -6.964   1.743 -10.433
  227    H    VAL 672           H        VAL 672  -7.009   3.000  -7.774
  228    HA   VAL 672           HA       VAL 672  -8.746   1.616  -5.867
  229    HB   VAL 672           HB       VAL 672  -9.090   4.526  -6.292
  230   HG11  VAL 672          1HG1      VAL 672  -9.829   2.655  -4.398
  231   HG12  VAL 672          2HG1      VAL 672  -8.518   3.541  -3.617
  232   HG13  VAL 672          3HG1      VAL 672  -9.933   4.406  -4.224
  233   HG21  VAL 672          3HG2      VAL 672  -7.108   5.097  -4.962
  234   HG22  VAL 672          1HG2      VAL 672  -6.597   3.410  -5.012
  235   HG23  VAL 672          2HG2      VAL 672  -6.666   4.355  -6.498
  236    H    ILE 673           H        ILE 673 -10.695   0.969  -6.415
  237    HA   ILE 673           HA       ILE 673 -11.736   1.671  -9.028
  238    HB   ILE 673           HB       ILE 673 -12.619  -0.331  -6.951
  239   HG12  ILE 673          2HG1      ILE 673 -12.174  -1.555  -9.427
  240   HG13  ILE 673          1HG1      ILE 673 -10.877  -0.371  -9.275
  241   HG21  ILE 673          1HG2      ILE 673 -14.488   0.829  -8.352
  242   HG22  ILE 673          2HG2      ILE 673 -13.881  -0.196  -9.654
  243   HG23  ILE 673          3HG2      ILE 673 -14.483  -0.925  -8.166
  244   HD11  ILE 673          3HD1      ILE 673 -11.527  -2.288  -7.066
  245   HD12  ILE 673          1HD1      ILE 673 -10.448  -2.718  -8.393
  246   HD13  ILE 673          2HD1      ILE 673 -10.047  -1.368  -7.332
  247    H    ASP 674           H        ASP 674 -13.264   3.091  -9.427
  248    HA   ASP 674           HA       ASP 674 -14.500   4.628  -7.357
  249    HB2  ASP 674           2HB      ASP 674 -13.968   5.676  -9.472
  250    HB3  ASP 674           1HB      ASP 674 -14.966   4.517 -10.344
  251    H    THR 675           H        THR 675 -16.105   3.873  -6.143
  252    HA   THR 675           HA       THR 675 -17.865   1.814  -7.207
  253    HB   THR 675           HB       THR 675 -18.541   2.422  -4.526
  254    HG1  THR 675           1HG      THR 675 -16.372   2.033  -3.625
  255   HG21  THR 675          3HG2      THR 675 -18.434   0.190  -4.377
  256   HG22  THR 675          1HG2      THR 675 -16.747   0.157  -4.890
  257   HG23  THR 675          2HG2      THR 675 -18.033   0.207  -6.095
  258    H    LYS 676           H        LYS 676 -19.084   3.238  -8.608
  259    HA   LYS 676           HA       LYS 676 -20.750   5.287  -7.541
  260    HB2  LYS 676           2HB      LYS 676 -21.950   5.156  -9.671
  261    HB3  LYS 676           1HB      LYS 676 -20.212   5.174  -9.932
  262    HG2  LYS 676           2HG      LYS 676 -21.080   2.464  -9.737
  263    HG3  LYS 676           1HG      LYS 676 -22.111   3.318 -10.886
  264    HD2  LYS 676           2HD      LYS 676 -20.136   4.093 -12.093
  265    HD3  LYS 676           1HD      LYS 676 -19.094   3.262 -10.936
  266    HE2  LYS 676           2HE      LYS 676 -19.510   1.222 -11.828
  267    HE3  LYS 676           1HE      LYS 676 -21.178   1.622 -12.232
  268    HZ1  LYS 676           3HZ      LYS 676 -19.941   3.184 -13.954
  269    HZ2  LYS 676           1HZ      LYS 676 -20.308   1.562 -14.306
  270    HZ3  LYS 676           2HZ      LYS 676 -18.746   1.989 -13.806
  271    H    ASP 677           H        ASP 677 -20.869   1.874  -7.644
  272    HA   ASP 677           HA       ASP 677 -23.634   1.443  -7.302
  273    HB2  ASP 677           2HB      ASP 677 -21.567  -0.395  -6.130
  274    HB3  ASP 677           1HB      ASP 677 -23.098  -0.794  -6.899
  275    H    GLY 678           H        GLY 678 -24.661   2.451  -5.724
  276    HA2  GLY 678           1HA      GLY 678 -25.032   1.780  -3.244
  277    HA3  GLY 678           2HA      GLY 678 -23.461   2.548  -3.050
  278    H    SER 679           H        SER 679 -23.707   4.682  -4.785
  279    HA   SER 679           HA       SER 679 -25.369   6.424  -3.214
  280    HB2  SER 679           2HB      SER 679 -24.114   7.467  -5.688
  281    HB3  SER 679           1HB      SER 679 -24.080   8.110  -4.043
  282    HG   SER 679           HG       SER 679 -22.653   6.221  -3.596
  283    H    GLN 680           H        GLN 680 -25.334   5.213  -6.538
  284    HA   GLN 680           HA       GLN 680 -27.943   6.438  -7.026
  285    HB2  GLN 680           2HB      GLN 680 -25.971   5.012  -8.816
  286    HB3  GLN 680           1HB      GLN 680 -27.588   5.447  -9.351
  287    HG2  GLN 680           2HG      GLN 680 -26.611   7.325 -10.055
  288    HG3  GLN 680           1HG      GLN 680 -26.714   7.815  -8.364
  289   HE21  GLN 680          1HE2      GLN 680 -24.766   8.103 -10.775
  290   HE22  GLN 680          2HE2      GLN 680 -23.217   7.881 -10.025
  291    H    SER 681           H        SER 681 -29.590   5.299  -6.231
  292    HA   SER 681           HA       SER 681 -29.476   2.467  -5.831
  293    HB2  SER 681           2HB      SER 681 -32.039   4.011  -5.708
  294    HB3  SER 681           1HB      SER 681 -31.458   2.723  -4.653
  295    HG   SER 681           HG       SER 681 -30.577   4.171  -3.417
  296    H    LYS 682           H        LYS 682 -30.697   4.605  -8.294
  297    HA   LYS 682           HA       LYS 682 -32.318   2.577  -9.574
  298    HB2  LYS 682           2HB      LYS 682 -32.410   5.271  -9.627
  299    HB3  LYS 682           1HB      LYS 682 -31.472   4.987 -11.086
  300    HG2  LYS 682           2HG      LYS 682 -33.239   3.592 -11.985
  301    HG3  LYS 682           1HG      LYS 682 -34.171   3.786 -10.500
  302    HD2  LYS 682           2HD      LYS 682 -34.319   6.190 -10.900
  303    HD3  LYS 682           1HD      LYS 682 -33.364   6.008 -12.373
  304    HE2  LYS 682           2HE      LYS 682 -35.321   5.797 -13.428
  305    HE3  LYS 682           1HE      LYS 682 -35.378   4.181 -12.726
  306    HZ1  LYS 682           3HZ      LYS 682 -36.334   5.873 -10.770
  307    HZ2  LYS 682           1HZ      LYS 682 -37.239   4.804 -11.730
  308    HZ3  LYS 682           2HZ      LYS 682 -37.048   6.420 -12.210
  309    H    LEU 683           H        LEU 683 -29.068   3.648  -9.636
  310    HA   LEU 683           HA       LEU 683 -27.202   3.007 -10.731
  311    HB2  LEU 683           2HB      LEU 683 -28.758   0.697 -10.640
  312    HB3  LEU 683           1HB      LEU 683 -28.257   0.816 -12.315
  313    HG   LEU 683           HG       LEU 683 -26.756  -0.566 -10.887
  314   HD11  LEU 683          1HD1      LEU 683 -25.907   1.732 -12.535
  315   HD12  LEU 683          2HD1      LEU 683 -24.654   0.958 -11.564
  316   HD13  LEU 683          3HD1      LEU 683 -25.581   0.010 -12.730
  317   HD21  LEU 683          3HD2      LEU 683 -26.628   0.405  -8.805
  318   HD22  LEU 683          1HD2      LEU 683 -25.108   0.931  -9.528
  319   HD23  LEU 683          2HD2      LEU 683 -26.478   2.038  -9.456
  320    H    GLY 684           H        GLY 684 -29.433   1.867 -13.245
  321    HA2  GLY 684           1HA      GLY 684 -28.436   4.061 -14.956
  322    HA3  GLY 684           2HA      GLY 684 -28.599   2.413 -15.548
  323    H    GLY 685           H        GLY 685 -29.887   3.954 -17.120
  324    HA2  GLY 685           1HA      GLY 685 -32.465   4.819 -16.309
  325    HA3  GLY 685           2HA      GLY 685 -31.931   4.564 -17.965
  326    H    GLY 901           H        GLY 901 -34.324   3.768 -16.087
  327    HA2  GLY 901           1HA      GLY 901 -34.312   0.899 -16.177
  328    HA3  GLY 901           2HA      GLY 901 -35.660   1.925 -15.711
  329    H    GLY 902           H        GLY 902 -33.871   0.697 -18.500
  330    HA2  GLY 902           1HA      GLY 902 -35.887   1.410 -20.397
  331    HA3  GLY 902           2HA      GLY 902 -34.544   0.308 -20.672
  332    H    SER 903           H        SER 903 -35.305  -1.350 -18.363
  333    HA   SER 903           HA       SER 903 -37.791  -2.545 -19.398
  334    HB2  SER 903           2HB      SER 903 -36.080  -4.562 -18.274
  335    HB3  SER 903           1HB      SER 903 -36.713  -4.445 -19.916
  336    HG   SER 903           HG       SER 903 -34.900  -2.758 -20.079
  337    H    GLY 904           H        GLY 904 -35.563  -2.244 -16.659
  338    HA2  GLY 904           1HA      GLY 904 -37.820  -2.133 -14.840
  339    HA3  GLY 904           2HA      GLY 904 -36.770  -3.528 -14.632
  340    H    GLY 905           H        GLY 905 -35.793  -3.079 -12.725
  341    HA2  GLY 905           1HA      GLY 905 -33.535  -1.538 -12.580
  342    HA3  GLY 905           2HA      GLY 905 -34.824  -0.453 -12.075
  343    H    HIS 906           H        HIS 906 -32.953  -0.899 -10.239
  344    HA   HIS 906           HA       HIS 906 -33.897  -3.078  -8.533
  345    HB2  HIS 906           2HB      HIS 906 -31.346  -1.752  -8.903
  346    HB3  HIS 906           1HB      HIS 906 -31.815  -1.772  -7.205
  347    HD1  HIS 906           1HD      HIS 906 -31.783  -4.056  -5.997
  348    HD2  HIS 906           2HD      HIS 906 -30.943  -4.270 -10.066
  349    HE1  HIS 906           1HE      HIS 906 -31.003  -6.421  -6.441
  350    H    MET 907           H        MET 907 -34.667  -2.749  -6.462
  351    HA   MET 907           HA       MET 907 -35.859  -0.102  -6.085
  352    HB2  MET 907           2HB      MET 907 -36.654  -2.847  -5.485
  353    HB3  MET 907           1HB      MET 907 -36.898  -1.758  -4.125
  354    HG2  MET 907           2HG      MET 907 -37.831  -0.442  -6.441
  355    HG3  MET 907           1HG      MET 907 -38.480  -2.080  -6.463
  356    HE1  MET 907           3HE      MET 907 -41.200  -1.395  -5.946
  357    HE2  MET 907           1HE      MET 907 -40.313  -2.826  -5.421
  358    HE3  MET 907           2HE      MET 907 -41.366  -1.978  -4.290
  359    H    GLY 908           H        GLY 908 -33.858   0.855  -5.357
  360    HA2  GLY 908           1HA      GLY 908 -32.922   1.910  -3.501
  361    HA3  GLY 908           2HA      GLY 908 -33.696   0.724  -2.460
  362    H    SER 909           H        SER 909 -32.747  -1.448  -2.421
  363    HA   SER 909           HA       SER 909 -29.862  -1.248  -2.288
  364    HB2  SER 909           2HB      SER 909 -30.985  -3.882  -1.738
  365    HB3  SER 909           1HB      SER 909 -30.062  -2.814  -0.680
  366    HG   SER 909           HG       SER 909 -31.987  -1.678  -0.238
  367    H    GLY 910           H        GLY 910 -28.431  -2.218  -3.632
  368    HA2  GLY 910           1HA      GLY 910 -29.516  -3.955  -5.755
  369    HA3  GLY 910           2HA      GLY 910 -28.406  -2.644  -6.126
  370    H    GLY 911           H        GLY 911 -28.407  -5.082  -3.532
  371    HA2  GLY 911           1HA      GLY 911 -26.826  -7.031  -4.094
  372    HA3  GLY 911           2HA      GLY 911 -25.644  -5.746  -4.312
  373    H    LEU  18           H        LEU  18 -26.445  -8.043  -2.235
  374    HA   LEU  18           HA       LEU  18 -25.819  -6.393   0.125
  375    HB2  LEU  18           2HB      LEU  18 -27.724  -8.594  -0.297
  376    HB3  LEU  18           1HB      LEU  18 -26.778  -8.714   1.174
  377    HG   LEU  18           HG       LEU  18 -28.415  -6.294   0.423
  378   HD11  LEU  18          1HD1      LEU  18 -29.626  -7.412   2.595
  379   HD12  LEU  18          2HD1      LEU  18 -30.170  -7.593   0.928
  380   HD13  LEU  18          3HD1      LEU  18 -29.161  -8.838   1.668
  381   HD21  LEU  18          3HD2      LEU  18 -27.760  -6.786   3.219
  382   HD22  LEU  18          1HD2      LEU  18 -26.342  -6.520   2.204
  383   HD23  LEU  18          2HD2      LEU  18 -27.625  -5.312   2.265
  384    H    SER  19           H        SER  19 -24.631  -8.730  -1.965
  385    HA   SER  19           HA       SER  19 -22.943 -10.028   0.005
  386    HB2  SER  19           2HB      SER  19 -22.126 -10.725  -2.607
  387    HB3  SER  19           1HB      SER  19 -23.091 -11.691  -1.490
  388    HG   SER  19           HG       SER  19 -23.872 -10.752  -3.786
  389    H    TRP  20           H        TRP  20 -22.753  -7.685  -2.577
  390    HA   TRP  20           HA       TRP  20 -21.166  -6.234  -3.284
  391    HB2  TRP  20           2HB      TRP  20 -19.821  -6.507  -0.605
  392    HB3  TRP  20           1HB      TRP  20 -19.908  -5.094  -1.650
  393    HD1  TRP  20           HD       TRP  20 -22.976  -4.801  -2.092
  394    HE1  TRP  20           1HE      TRP  20 -24.545  -4.207  -0.143
  395    HE3  TRP  20           3HE      TRP  20 -20.020  -6.280   1.792
  396    HZ2  TRP  20           2HZ      TRP  20 -24.519  -4.323   2.684
  397    HZ3  TRP  20           3HZ      TRP  20 -20.853  -5.993   4.087
  398    HH2  TRP  20           HH       TRP  20 -23.056  -5.037   4.524
  399    H    LYS  21           H        LYS  21 -18.361  -6.221  -2.228
  400    HA   LYS  21           HA       LYS  21 -17.403  -8.460  -3.856
  401    HB2  LYS  21           2HB      LYS  21 -16.435  -5.740  -3.261
  402    HB3  LYS  21           1HB      LYS  21 -15.185  -6.977  -3.305
  403    HG2  LYS  21           2HG      LYS  21 -15.260  -6.155  -5.477
  404    HG3  LYS  21           1HG      LYS  21 -16.190  -7.653  -5.552
  405    HD2  LYS  21           2HD      LYS  21 -17.958  -6.535  -6.302
  406    HD3  LYS  21           1HD      LYS  21 -17.954  -5.524  -4.856
  407    HE2  LYS  21           2HE      LYS  21 -16.809  -3.827  -5.881
  408    HE3  LYS  21           1HE      LYS  21 -15.985  -4.915  -6.993
  409    HZ1  LYS  21           3HZ      LYS  21 -18.848  -4.772  -7.358
  410    HZ2  LYS  21           1HZ      LYS  21 -17.604  -4.733  -8.510
  411    HZ3  LYS  21           2HZ      LYS  21 -18.035  -3.322  -7.673
  412    H    ARG  22           H        ARG  22 -16.326 -10.119  -2.999
  413    HA   ARG  22           HA       ARG  22 -16.170 -10.440  -0.174
  414    HB2  ARG  22           2HB      ARG  22 -16.458 -12.472  -1.215
  415    HB3  ARG  22           1HB      ARG  22 -15.437 -12.036  -2.575
  416    HG2  ARG  22           2HG      ARG  22 -14.171 -13.642  -1.552
  417    HG3  ARG  22           1HG      ARG  22 -13.517 -12.175  -0.823
  418    HD2  ARG  22           2HD      ARG  22 -15.290 -12.589   1.017
  419    HD3  ARG  22           1HD      ARG  22 -15.350 -14.228   0.364
  420    HE   ARG  22           HE       ARG  22 -12.845 -12.986   1.318
  421   HH11  ARG  22          2HH1      ARG  22 -15.140 -15.642   1.299
  422   HH12  ARG  22          1HH1      ARG  22 -14.072 -16.736   2.139
  423   HH21  ARG  22          2HH2      ARG  22 -11.442 -14.431   2.409
  424   HH22  ARG  22          1HH2      ARG  22 -11.973 -16.045   2.755
  425    H    CYS  23           H        CYS  23 -14.548 -10.002   1.203
  426    HA   CYS  23           HA       CYS  23 -12.233  -8.634   0.106
  427    HB2  CYS  23           2HB      CYS  23 -12.284  -7.371   1.964
  428    HB3  CYS  23           1HB      CYS  23 -13.879  -8.063   2.204
  429    H    ALA  24           H        ALA  24 -10.068  -9.062   0.949
  430    HA   ALA  24           HA       ALA  24  -9.658 -11.921   0.685
  431    HB1  ALA  24           1HB      ALA  24  -8.360  -9.653  -0.306
  432    HB2  ALA  24           2HB      ALA  24  -7.213 -10.426   0.789
  433    HB3  ALA  24           3HB      ALA  24  -7.913 -11.344  -0.542
  434    H    GLY  25           H        GLY  25  -8.236  -9.379   2.770
  435    HA2  GLY  25           1HA      GLY  25  -6.713 -11.201   4.301
  436    HA3  GLY  25           2HA      GLY  25  -7.065  -9.538   4.736
  437    H    CYS  26           H        CYS  26  -9.243  -9.148   5.700
  438    HA   CYS  26           HA       CYS  26  -9.729 -10.654   7.946
  439    HB2  CYS  26           2HB      CYS  26 -12.100  -9.363   6.740
  440    HB3  CYS  26           1HB      CYS  26 -11.412  -9.181   8.352
  441    H    GLY  27           H        GLY  27 -11.312 -10.882   4.781
  442    HA2  GLY  27           1HA      GLY  27 -11.886 -12.956   3.799
  443    HA3  GLY  27           2HA      GLY  27 -11.932 -13.676   5.402
  444    H    GLY  28           H        GLY  28 -13.495 -10.694   4.323
  445    HA2  GLY  28           1HA      GLY  28 -16.097 -12.047   4.678
  446    HA3  GLY  28           2HA      GLY  28 -15.779 -10.480   5.413
  447    H    LYS  29           H        LYS  29 -16.397  -8.764   4.311
  448    HA   LYS  29           HA       LYS  29 -16.364  -8.797   1.409
  449    HB2  LYS  29           2HB      LYS  29 -18.748  -7.686   1.564
  450    HB3  LYS  29           1HB      LYS  29 -18.583  -9.434   1.501
  451    HG2  LYS  29           2HG      LYS  29 -18.480  -8.923   4.190
  452    HG3  LYS  29           1HG      LYS  29 -19.639  -7.726   3.608
  453    HD2  LYS  29           2HD      LYS  29 -20.216 -10.183   2.317
  454    HD3  LYS  29           1HD      LYS  29 -20.017 -10.516   4.039
  455    HE2  LYS  29           2HE      LYS  29 -21.856  -9.332   4.616
  456    HE3  LYS  29           1HE      LYS  29 -21.612  -8.132   3.349
  457    HZ1  LYS  29           3HZ      LYS  29 -22.211 -10.458   2.024
  458    HZ2  LYS  29           1HZ      LYS  29 -23.246  -9.135   2.267
  459    HZ3  LYS  29           2HZ      LYS  29 -23.272 -10.440   3.348
  460    H    ILE  30           H        ILE  30 -16.082  -6.785   0.523
  461    HA   ILE  30           HA       ILE  30 -15.078  -4.776   2.297
  462    HB   ILE  30           HB       ILE  30 -15.569  -4.704  -0.689
  463   HG12  ILE  30          2HG1      ILE  30 -12.816  -4.610   0.100
  464   HG13  ILE  30          1HG1      ILE  30 -13.587  -5.985   0.883
  465   HG21  ILE  30          1HG2      ILE  30 -13.701  -2.839   0.693
  466   HG22  ILE  30          2HG2      ILE  30 -14.579  -2.637  -0.824
  467   HG23  ILE  30          3HG2      ILE  30 -15.428  -2.481   0.716
  468   HD11  ILE  30          3HD1      ILE  30 -14.219  -5.685  -1.960
  469   HD12  ILE  30          1HD1      ILE  30 -12.523  -6.012  -1.601
  470   HD13  ILE  30          2HD1      ILE  30 -13.776  -7.118  -1.032
  471    H    ALA  31           H        ALA  31 -16.449  -3.650   3.491
  472    HA   ALA  31           HA       ALA  31 -18.850  -2.558   2.197
  473    HB1  ALA  31           1HB      ALA  31 -18.417  -3.307   5.085
  474    HB2  ALA  31           2HB      ALA  31 -19.834  -2.448   4.482
  475    HB3  ALA  31           3HB      ALA  31 -19.499  -4.091   3.934
  476    H    ASP  32           H        ASP  32 -15.910  -1.700   2.761
  477    HA   ASP  32           HA       ASP  32 -16.047   0.623   4.373
  478    HB2  ASP  32           2HB      ASP  32 -14.136  -0.217   2.191
  479    HB3  ASP  32           1HB      ASP  32 -13.932   1.268   3.110
  480    H    ARG  33           H        ARG  33 -15.103   0.924   1.011
  481    HA   ARG  33           HA       ARG  33 -17.458   2.136   0.042
  482    HB2  ARG  33           2HB      ARG  33 -16.142   3.905   1.633
  483    HB3  ARG  33           1HB      ARG  33 -15.371   4.231   0.087
  484    HG2  ARG  33           2HG      ARG  33 -18.241   4.054  -0.192
  485    HG3  ARG  33           1HG      ARG  33 -17.781   5.257   1.013
  486    HD2  ARG  33           2HD      ARG  33 -17.205   6.673  -0.592
  487    HD3  ARG  33           1HD      ARG  33 -16.048   5.506  -1.228
  488    HE   ARG  33           HE       ARG  33 -18.071   4.568  -2.460
  489   HH11  ARG  33          2HH1      ARG  33 -17.729   7.947  -1.623
  490   HH12  ARG  33          1HH1      ARG  33 -18.693   8.506  -2.955
  491   HH21  ARG  33          2HH2      ARG  33 -19.311   5.305  -4.249
  492   HH22  ARG  33          1HH2      ARG  33 -19.589   7.010  -4.446
  493    H    PHE  34           H        PHE  34 -14.038   2.967  -0.431
  494    HA   PHE  34           HA       PHE  34 -14.323   2.262  -3.240
  495    HB2  PHE  34           2HB      PHE  34 -12.570   4.045  -1.687
  496    HB3  PHE  34           1HB      PHE  34 -11.756   3.165  -2.981
  497    HD1  PHE  34           1HD      PHE  34 -15.193   4.573  -2.761
  498    HD2  PHE  34           2HD      PHE  34 -11.415   4.650  -4.715
  499    HE1  PHE  34           1HE      PHE  34 -16.090   6.155  -4.411
  500    HE2  PHE  34           2HE      PHE  34 -12.301   6.240  -6.370
  501    HZ   PHE  34           HZ       PHE  34 -14.641   6.990  -6.224
  502    H    LEU  35           H        LEU  35 -13.010   0.807  -4.281
  503    HA   LEU  35           HA       LEU  35 -11.938  -1.282  -2.534
  504    HB2  LEU  35           2HB      LEU  35 -13.160  -1.218  -5.235
  505    HB3  LEU  35           1HB      LEU  35 -11.907  -2.414  -4.966
  506    HG   LEU  35           HG       LEU  35 -13.422  -2.861  -2.786
  507   HD11  LEU  35          1HD1      LEU  35 -15.111  -1.241  -3.306
  508   HD12  LEU  35          2HD1      LEU  35 -15.304  -1.898  -4.932
  509   HD13  LEU  35          3HD1      LEU  35 -15.785  -2.857  -3.534
  510   HD21  LEU  35          3HD2      LEU  35 -12.738  -4.608  -4.211
  511   HD22  LEU  35          1HD2      LEU  35 -14.500  -4.668  -4.179
  512   HD23  LEU  35          2HD2      LEU  35 -13.666  -3.969  -5.566
  513    H    LEU  36           H        LEU  36  -9.837  -1.876  -2.596
  514    HA   LEU  36           HA       LEU  36  -8.089  -0.258  -4.322
  515    HB2  LEU  36           2HB      LEU  36  -7.457  -1.612  -1.700
  516    HB3  LEU  36           1HB      LEU  36  -6.347  -0.632  -2.639
  517    HG   LEU  36           HG       LEU  36  -8.703   0.907  -2.118
  518   HD11  LEU  36          1HD1      LEU  36  -9.209  -0.381  -0.218
  519   HD12  LEU  36          2HD1      LEU  36  -7.512  -0.504   0.247
  520   HD13  LEU  36          3HD1      LEU  36  -8.353   1.040   0.383
  521   HD21  LEU  36          3HD2      LEU  36  -7.136   2.470  -1.962
  522   HD22  LEU  36          1HD2      LEU  36  -6.402   1.666  -0.574
  523   HD23  LEU  36          2HD2      LEU  36  -5.927   1.211  -2.211
  524    H    TYR  37           H        TYR  37  -6.724  -1.214  -5.683
  525    HA   TYR  37           HA       TYR  37  -6.766  -4.138  -5.892
  526    HB2  TYR  37           2HB      TYR  37  -6.643  -1.930  -7.754
  527    HB3  TYR  37           1HB      TYR  37  -5.293  -3.026  -8.012
  528    HD1  TYR  37           1HD      TYR  37  -6.923  -5.550  -7.109
  529    HD2  TYR  37           2HD      TYR  37  -7.661  -2.383  -9.847
  530    HE1  TYR  37           1HE      TYR  37  -8.377  -7.035  -8.427
  531    HE2  TYR  37           2HE      TYR  37  -9.117  -3.850 -11.165
  532    HH   TYR  37           HH       TYR  37  -9.374  -7.273 -10.528
  533    H    ALA  38           H        ALA  38  -5.171  -5.115  -4.786
  534    HA   ALA  38           HA       ALA  38  -2.475  -3.949  -4.981
  535    HB1  ALA  38           1HB      ALA  38  -1.848  -5.309  -3.071
  536    HB2  ALA  38           2HB      ALA  38  -3.259  -4.322  -2.683
  537    HB3  ALA  38           3HB      ALA  38  -3.454  -6.040  -3.037
  538    H    MET  39           H        MET  39  -2.631  -7.245  -4.091
  539    HA   MET  39           HA       MET  39  -1.403  -7.988  -6.604
  540    HB2  MET  39           2HB      MET  39  -1.150 -10.240  -5.518
  541    HB3  MET  39           1HB      MET  39  -0.354  -8.916  -4.682
  542    HG2  MET  39           2HG      MET  39  -2.495  -8.834  -3.251
  543    HG3  MET  39           1HG      MET  39  -2.793 -10.449  -3.892
  544    HE1  MET  39           3HE      MET  39  -0.224  -8.134  -2.460
  545    HE2  MET  39           1HE      MET  39  -0.848  -8.608  -0.880
  546    HE3  MET  39           2HE      MET  39   0.769  -9.103  -1.373
  547    H    ASP  40           H        ASP  40  -3.738  -7.221  -7.315
  548    HA   ASP  40           HA       ASP  40  -5.400  -7.787  -8.736
  549    HB2  ASP  40           2HB      ASP  40  -3.726  -9.904  -9.014
  550    HB3  ASP  40           1HB      ASP  40  -5.199 -10.711  -8.479
  551    H    SER  41           H        SER  41  -5.341  -8.834  -5.528
  552    HA   SER  41           HA       SER  41  -8.033  -9.892  -5.540
  553    HB2  SER  41           2HB      SER  41  -7.017  -9.191  -2.921
  554    HB3  SER  41           1HB      SER  41  -7.389 -10.787  -3.581
  555    HG   SER  41           HG       SER  41  -5.328 -10.855  -4.488
  556    H    TYR  42           H        TYR  42  -9.617  -8.914  -3.901
  557    HA   TYR  42           HA       TYR  42  -9.734  -6.020  -4.386
  558    HB2  TYR  42           2HB      TYR  42 -11.817  -8.068  -3.637
  559    HB3  TYR  42           1HB      TYR  42 -12.128  -6.341  -3.525
  560    HD1  TYR  42           2HD      TYR  42 -10.770  -5.347  -5.957
  561    HD2  TYR  42           1HD      TYR  42 -13.182  -8.799  -5.362
  562    HE1  TYR  42           2HE      TYR  42 -11.411  -5.301  -8.329
  563    HE2  TYR  42           1HE      TYR  42 -13.830  -8.758  -7.732
  564    HH   TYR  42           HH       TYR  42 -12.669  -6.203  -9.914
  565    H    TRP  43           H        TRP  43  -9.155  -4.678  -2.799
  566    HA   TRP  43           HA       TRP  43  -9.338  -5.673  -0.033
  567    HB2  TRP  43           2HB      TRP  43  -7.279  -3.675  -0.947
  568    HB3  TRP  43           1HB      TRP  43  -7.303  -4.620   0.537
  569    HD1  TRP  43           HD       TRP  43  -6.766  -5.112  -3.254
  570    HE1  TRP  43           1HE      TRP  43  -5.242  -7.148  -3.588
  571    HE3  TRP  43           3HE      TRP  43  -6.335  -6.626   1.609
  572    HZ2  TRP  43           2HZ      TRP  43  -4.011  -9.124  -2.023
  573    HZ3  TRP  43           3HZ      TRP  43  -4.955  -8.608   2.100
  574    HH2  TRP  43           HH       TRP  43  -3.817  -9.822   0.309
  575    H    HIS  44           H        HIS  44  -9.713  -4.159   1.585
  576    HA   HIS  44           HA       HIS  44 -10.676  -1.508   0.738
  577    HB2  HIS  44           2HB      HIS  44 -12.239  -1.603   2.735
  578    HB3  HIS  44           1HB      HIS  44 -12.656  -2.701   1.428
  579    HD1  HIS  44           1HD      HIS  44 -13.105  -2.865   4.789
  580    HD2  HIS  44           2HD      HIS  44 -10.819  -5.199   2.220
  581    HE1  HIS  44           1HE      HIS  44 -12.644  -5.068   6.009
  582    H    SER  45           H        SER  45 -10.857  -0.323   3.272
  583    HA   SER  45           HA       SER  45  -8.128   0.280   3.676
  584    HB2  SER  45           2HB      SER  45  -9.977   0.960   5.877
  585    HB3  SER  45           1HB      SER  45  -8.892   1.996   4.949
  586    HG   SER  45           HG       SER  45 -11.498   1.097   4.298
  587    H    ARG  46           H        ARG  46 -10.330  -1.890   5.362
  588    HA   ARG  46           HA       ARG  46  -8.538  -2.363   7.556
  589    HB2  ARG  46           2HB      ARG  46 -11.184  -3.346   6.688
  590    HB3  ARG  46           1HB      ARG  46 -10.228  -4.490   7.621
  591    HG2  ARG  46           2HG      ARG  46 -10.184  -1.869   8.827
  592    HG3  ARG  46           1HG      ARG  46 -11.834  -2.453   8.605
  593    HD2  ARG  46           2HD      ARG  46 -11.606  -3.802  10.347
  594    HD3  ARG  46           1HD      ARG  46 -10.252  -4.608   9.555
  595    HE   ARG  46           HE       ARG  46  -9.586  -2.115  10.870
  596   HH11  ARG  46          2HH1      ARG  46  -9.817  -5.603  11.148
  597   HH12  ARG  46          1HH1      ARG  46  -8.752  -5.688  12.521
  598   HH21  ARG  46          2HH2      ARG  46  -8.176  -2.236  12.689
  599   HH22  ARG  46          1HH2      ARG  46  -7.817  -3.793  13.382
  600    H    CYS  47           H        CYS  47  -8.656  -3.468   4.356
  601    HA   CYS  47           HA       CYS  47  -7.275  -5.969   5.013
  602    HB2  CYS  47           2HB      CYS  47  -9.124  -5.179   2.945
  603    HB3  CYS  47           1HB      CYS  47  -7.643  -5.811   2.234
  604    H    LEU  48           H        LEU  48  -6.990  -3.165   2.841
  605    HA   LEU  48           HA       LEU  48  -4.344  -3.889   2.024
  606    HB2  LEU  48           2HB      LEU  48  -6.344  -2.355   0.952
  607    HB3  LEU  48           1HB      LEU  48  -5.209  -1.139   1.508
  608    HG   LEU  48           HG       LEU  48  -5.103  -2.260  -0.932
  609   HD11  LEU  48          1HD1      LEU  48  -3.225  -0.900   0.831
  610   HD12  LEU  48          2HD1      LEU  48  -2.462  -1.793  -0.485
  611   HD13  LEU  48          3HD1      LEU  48  -3.669  -0.559  -0.841
  612   HD21  LEU  48          3HD2      LEU  48  -4.380  -4.412   0.598
  613   HD22  LEU  48          1HD2      LEU  48  -3.966  -4.180  -1.100
  614   HD23  LEU  48          2HD2      LEU  48  -2.817  -3.723   0.157
  615    H    LYS  49           H        LYS  49  -3.648  -3.989   4.298
  616    HA   LYS  49           HA       LYS  49  -2.173  -1.548   4.916
  617    HB2  LYS  49           2HB      LYS  49  -2.669  -2.099   7.420
  618    HB3  LYS  49           1HB      LYS  49  -3.865  -1.200   6.499
  619    HG2  LYS  49           2HG      LYS  49  -5.230  -2.718   7.492
  620    HG3  LYS  49           1HG      LYS  49  -4.809  -3.627   6.038
  621    HD2  LYS  49           2HD      LYS  49  -2.776  -4.286   7.749
  622    HD3  LYS  49           1HD      LYS  49  -4.153  -4.150   8.844
  623    HE2  LYS  49           2HE      LYS  49  -4.319  -6.354   8.219
  624    HE3  LYS  49           1HE      LYS  49  -5.352  -5.594   7.011
  625    HZ1  LYS  49           3HZ      LYS  49  -3.093  -7.170   6.580
  626    HZ2  LYS  49           1HZ      LYS  49  -2.707  -5.604   6.061
  627    HZ3  LYS  49           2HZ      LYS  49  -4.060  -6.395   5.423
  628    H    CYS  50           H        CYS  50  -0.343  -2.069   6.470
  629    HA   CYS  50           HA       CYS  50   0.926  -4.516   5.819
  630    HB2  CYS  50           2HB      CYS  50   2.179  -2.503   6.582
  631    HB3  CYS  50           1HB      CYS  50   1.479  -2.701   8.185
  632    H    SER  51           H        SER  51   0.636  -6.499   6.682
  633    HA   SER  51           HA       SER  51  -1.305  -6.826   8.786
  634    HB2  SER  51           2HB      SER  51   0.441  -8.995   7.617
  635    HB3  SER  51           1HB      SER  51  -1.143  -9.166   8.373
  636    HG   SER  51           HG       SER  51  -0.634  -8.860   5.825
  637    H    SER  52           H        SER  52   1.846  -5.987   8.790
  638    HA   SER  52           HA       SER  52   2.439  -7.348  11.322
  639    HB2  SER  52           2HB      SER  52   4.596  -5.767  10.128
  640    HB3  SER  52           1HB      SER  52   4.592  -7.454  10.643
  641    HG   SER  52           HG       SER  52   3.779  -6.340   8.166
  642    H    CYS  53           H        CYS  53   1.973  -4.211   9.834
  643    HA   CYS  53           HA       CYS  53   2.570  -2.886  12.384
  644    HB2  CYS  53           2HB      CYS  53   2.256  -1.821   9.579
  645    HB3  CYS  53           1HB      CYS  53   2.420  -0.783  10.991
  646    H    GLN  54           H        GLN  54  -0.044  -3.779  10.349
  647    HA   GLN  54           HA       GLN  54  -2.246  -3.283  10.243
  648    HB2  GLN  54           2HB      GLN  54  -1.638  -2.830  13.141
  649    HB3  GLN  54           1HB      GLN  54  -3.240  -2.452  12.516
  650    HG2  GLN  54           2HG      GLN  54  -1.887  -5.125  12.253
  651    HG3  GLN  54           1HG      GLN  54  -3.058  -4.711  13.500
  652   HE21  GLN  54          1HE2      GLN  54  -5.068  -3.531  12.359
  653   HE22  GLN  54          2HE2      GLN  54  -5.754  -4.464  11.074
  654    H    ALA  55           H        ALA  55  -0.295  -1.287   9.530
  655    HA   ALA  55           HA       ALA  55  -1.667   1.225  10.177
  656    HB1  ALA  55           1HB      ALA  55   0.952   0.885   8.722
  657    HB2  ALA  55           2HB      ALA  55   0.293   2.358   9.431
  658    HB3  ALA  55           3HB      ALA  55   0.822   1.038  10.473
  659    H    GLN  56           H        GLN  56  -2.636   2.442   8.644
  660    HA   GLN  56           HA       GLN  56  -3.824   1.244   6.464
  661    HB2  GLN  56           2HB      GLN  56  -3.416   4.033   7.376
  662    HB3  GLN  56           1HB      GLN  56  -3.903   3.816   5.700
  663    HG2  GLN  56           2HG      GLN  56  -5.367   3.035   8.193
  664    HG3  GLN  56           1HG      GLN  56  -5.894   4.093   6.884
  665   HE21  GLN  56          1HE2      GLN  56  -6.624   1.313   8.201
  666   HE22  GLN  56          2HE2      GLN  56  -7.051   0.366   6.812
  667    H    LEU  57           H        LEU  57  -3.029   0.515   4.622
  668    HA   LEU  57           HA       LEU  57  -0.530   1.670   3.600
  669    HB2  LEU  57           2HB      LEU  57  -1.605  -0.994   3.748
  670    HB3  LEU  57           1HB      LEU  57  -1.282  -0.581   2.075
  671    HG   LEU  57           HG       LEU  57   1.033  -0.137   2.576
  672   HD11  LEU  57          1HD1      LEU  57   0.109   0.214   5.212
  673   HD12  LEU  57          2HD1      LEU  57   1.247  -1.135   5.234
  674   HD13  LEU  57          3HD1      LEU  57   1.746   0.429   4.592
  675   HD21  LEU  57          3HD2      LEU  57  -0.139  -2.600   2.564
  676   HD22  LEU  57          1HD2      LEU  57   1.597  -2.296   2.485
  677   HD23  LEU  57          2HD2      LEU  57   0.833  -2.654   4.034
  678    H    GLY  58           H        GLY  58  -3.899   1.383   2.969
  679    HA2  GLY  58           1HA      GLY  58  -3.629   2.224   0.194
  680    HA3  GLY  58           2HA      GLY  58  -5.126   1.837   1.028
  681    H    ASP  59           H        ASP  59  -3.903   3.655   3.245
  682    HA   ASP  59           HA       ASP  59  -5.099   6.096   2.160
  683    HB2  ASP  59           2HB      ASP  59  -5.882   5.010   4.362
  684    HB3  ASP  59           1HB      ASP  59  -4.384   5.630   5.049
  685    H    ILE  60           H        ILE  60  -2.277   5.050   1.787
  686    HA   ILE  60           HA       ILE  60  -0.999   7.616   2.412
  687    HB   ILE  60           HB       ILE  60   1.194   6.198   2.477
  688   HG12  ILE  60          2HG1      ILE  60  -0.568   4.150   3.759
  689   HG13  ILE  60          1HG1      ILE  60  -0.330   4.095   2.015
  690   HG21  ILE  60          1HG2      ILE  60   0.194   7.591   4.285
  691   HG22  ILE  60          2HG2      ILE  60  -0.644   6.148   4.859
  692   HG23  ILE  60          3HG2      ILE  60   1.120   6.201   4.856
  693   HD11  ILE  60          3HD1      ILE  60   2.090   3.969   2.365
  694   HD12  ILE  60          1HD1      ILE  60   1.827   3.967   4.109
  695   HD13  ILE  60          2HD1      ILE  60   1.231   2.631   3.126
  696    H    GLY  61           H        GLY  61   0.343   8.418   0.849
  697    HA2  GLY  61           1HA      GLY  61  -0.049   7.439  -1.822
  698    HA3  GLY  61           2HA      GLY  61   0.949   8.809  -1.346
  699    H    THR  62           H        THR  62   2.152   6.763   0.652
  700    HA   THR  62           HA       THR  62   4.423   6.026  -0.873
  701    HB   THR  62           HB       THR  62   4.005   4.513   1.592
  702    HG1  THR  62           1HG      THR  62   4.063   6.446   2.912
  703   HG21  THR  62          3HG2      THR  62   6.116   5.960   2.143
  704   HG22  THR  62          1HG2      THR  62   6.053   6.358   0.427
  705   HG23  THR  62          2HG2      THR  62   6.222   4.677   0.938
  706    H    SER  63           H        SER  63   4.698   4.290  -2.130
  707    HA   SER  63           HA       SER  63   2.495   2.484  -2.488
  708    HB2  SER  63           2HB      SER  63   5.151   2.056  -3.794
  709    HB3  SER  63           1HB      SER  63   3.527   1.866  -4.459
  710    HG   SER  63           HG       SER  63   3.804   4.404  -3.773
  711    H    SER  64           H        SER  64   2.215   0.548  -1.610
  712    HA   SER  64           HA       SER  64   4.043  -0.519   0.292
  713    HB2  SER  64           2HB      SER  64   2.069  -2.419  -0.678
  714    HB3  SER  64           1HB      SER  64   2.229  -1.695   0.923
  715    HG   SER  64           HG       SER  64   1.064   0.088   0.202
  716    H    TYR  65           H        TYR  65   4.821  -2.824   0.154
  717    HA   TYR  65           HA       TYR  65   5.757  -3.387  -2.578
  718    HB2  TYR  65           2HB      TYR  65   7.407  -3.397  -0.045
  719    HB3  TYR  65           1HB      TYR  65   7.964  -3.993  -1.607
  720    HD1  TYR  65           1HD      TYR  65   7.609  -2.236  -3.591
  721    HD2  TYR  65           2HD      TYR  65   7.997  -1.234   0.524
  722    HE1  TYR  65           1HE      TYR  65   8.314   0.030  -4.218
  723    HE2  TYR  65           2HE      TYR  65   8.708   1.036  -0.091
  724    HH   TYR  65           HH       TYR  65   9.633   2.247  -1.925
  725    H    THR  66           H        THR  66   6.572  -5.578  -2.878
  726    HA   THR  66           HA       THR  66   5.701  -7.561  -0.967
  727    HB   THR  66           HB       THR  66   3.714  -6.875  -2.494
  728    HG1  THR  66           1HG      THR  66   3.714  -8.709  -1.124
  729   HG21  THR  66          3HG2      THR  66   4.096  -8.833  -4.452
  730   HG22  THR  66          1HG2      THR  66   5.583  -7.886  -4.440
  731   HG23  THR  66          2HG2      THR  66   4.032  -7.085  -4.692
  732    H    LYS  67           H        LYS  67   6.119  -9.808  -1.915
  733    HA   LYS  67           HA       LYS  67   8.037 -10.052  -4.016
  734    HB2  LYS  67           2HB      LYS  67   9.277  -9.192  -1.876
  735    HB3  LYS  67           1HB      LYS  67   9.084 -10.846  -1.314
  736    HG2  LYS  67           2HG      LYS  67  10.276 -11.642  -3.321
  737    HG3  LYS  67           1HG      LYS  67  10.515  -9.967  -3.817
  738    HD2  LYS  67           2HD      LYS  67  11.838  -9.521  -1.853
  739    HD3  LYS  67           1HD      LYS  67  11.490 -11.124  -1.208
  740    HE2  LYS  67           2HE      LYS  67  13.370 -11.812  -2.180
  741    HE3  LYS  67           1HE      LYS  67  12.544 -11.620  -3.727
  742    HZ1  LYS  67           3HZ      LYS  67  13.444  -9.449  -3.975
  743    HZ2  LYS  67           1HZ      LYS  67  14.731 -10.466  -3.550
  744    HZ3  LYS  67           2HZ      LYS  67  14.054  -9.433  -2.392
  745    H    SER  68           H        SER  68   7.527 -11.777  -0.964
  746    HA   SER  68           HA       SER  68   6.917 -14.203  -2.458
  747    HB2  SER  68           2HB      SER  68   7.010 -14.497   0.427
  748    HB3  SER  68           1HB      SER  68   8.029 -15.243  -0.807
  749    HG   SER  68           HG       SER  68   9.528 -13.798  -0.442
  750    H    GLY  69           H        GLY  69   4.858 -12.507  -2.720
  751    HA2  GLY  69           1HA      GLY  69   2.571 -12.518  -2.615
  752    HA3  GLY  69           2HA      GLY  69   2.707 -14.076  -1.823
  753    H    MET  70           H        MET  70   4.123 -11.183  -0.431
  754    HA   MET  70           HA       MET  70   1.994 -11.238   1.608
  755    HB2  MET  70           2HB      MET  70   4.955 -11.200   1.901
  756    HB3  MET  70           1HB      MET  70   4.011 -10.265   3.054
  757    HG2  MET  70           2HG      MET  70   2.727 -12.293   3.606
  758    HG3  MET  70           1HG      MET  70   3.759 -13.214   2.513
  759    HE1  MET  70           3HE      MET  70   5.378 -14.644   3.373
  760    HE2  MET  70           1HE      MET  70   6.564 -13.396   2.987
  761    HE3  MET  70           2HE      MET  70   6.641 -14.239   4.535
  762    H    ILE  71           H        ILE  71   0.947  -9.378   1.918
  763    HA   ILE  71           HA       ILE  71   1.867  -6.922   0.706
  764    HB   ILE  71           HB       ILE  71  -0.130  -6.291   2.598
  765   HG12  ILE  71          2HG1      ILE  71  -1.906  -7.933   1.527
  766   HG13  ILE  71          1HG1      ILE  71  -0.500  -8.985   1.370
  767   HG21  ILE  71          1HG2      ILE  71  -1.038  -6.755  -0.144
  768   HG22  ILE  71          2HG2      ILE  71  -1.062  -5.288   0.833
  769   HG23  ILE  71          3HG2      ILE  71   0.415  -5.767  -0.010
  770   HD11  ILE  71          3HD1      ILE  71  -1.935  -8.072   3.791
  771   HD12  ILE  71          1HD1      ILE  71  -1.218  -9.638   3.414
  772   HD13  ILE  71          2HD1      ILE  71  -0.187  -8.297   3.914
  773    H    LEU  72           H        LEU  72   3.550  -5.900   1.598
  774    HA   LEU  72           HA       LEU  72   3.613  -5.616   4.513
  775    HB2  LEU  72           2HB      LEU  72   5.480  -6.899   2.776
  776    HB3  LEU  72           1HB      LEU  72   6.240  -5.472   3.454
  777    HG   LEU  72           HG       LEU  72   5.809  -6.252   5.689
  778   HD11  LEU  72          1HD1      LEU  72   3.784  -7.754   4.557
  779   HD12  LEU  72          2HD1      LEU  72   4.969  -8.944   5.099
  780   HD13  LEU  72          3HD1      LEU  72   4.307  -7.778   6.244
  781   HD21  LEU  72          3HD2      LEU  72   7.850  -7.090   5.218
  782   HD22  LEU  72          1HD2      LEU  72   7.002  -8.632   5.311
  783   HD23  LEU  72          2HD2      LEU  72   7.295  -7.884   3.741
  784    H    CYS  73           H        CYS  73   4.857  -3.744   5.249
  785    HA   CYS  73           HA       CYS  73   4.199  -1.435   3.667
  786    HB2  CYS  73           2HB      CYS  73   4.865  -0.158   5.629
  787    HB3  CYS  73           1HB      CYS  73   3.810  -1.483   6.104
  788    H    ARG  74           H        ARG  74   6.008   0.406   4.012
  789    HA   ARG  74           HA       ARG  74   8.098  -0.247   2.231
  790    HB2  ARG  74           2HB      ARG  74   6.981   2.052   2.869
  791    HB3  ARG  74           1HB      ARG  74   8.271   2.118   4.062
  792    HG2  ARG  74           2HG      ARG  74   9.044   1.482   1.279
  793    HG3  ARG  74           1HG      ARG  74   8.499   3.129   1.611
  794    HD2  ARG  74           2HD      ARG  74  10.905   1.675   2.603
  795    HD3  ARG  74           1HD      ARG  74  10.755   3.324   2.002
  796    HE   ARG  74           HE       ARG  74   9.332   3.308   4.341
  797   HH11  ARG  74          2HH1      ARG  74  12.628   2.593   3.418
  798   HH12  ARG  74          1HH1      ARG  74  13.295   2.994   4.972
  799   HH21  ARG  74          2HH2      ARG  74  10.189   3.838   6.391
  800   HH22  ARG  74          1HH2      ARG  74  11.908   3.716   6.664
  801    H    ASN  75           H        ASN  75   7.912  -0.051   5.730
  802    HA   ASN  75           HA       ASN  75  10.778  -0.229   6.058
  803    HB2  ASN  75           2HB      ASN  75   9.460   1.119   7.626
  804    HB3  ASN  75           1HB      ASN  75   8.548  -0.310   8.105
  805   HD21  ASN  75          1HD2      ASN  75   9.113  -0.829  10.088
  806   HD22  ASN  75          2HD2      ASN  75  10.735  -0.911  10.690
  807    H    ASP  76           H        ASP  76   7.971  -2.313   6.419
  808    HA   ASP  76           HA       ASP  76   9.283  -4.375   7.837
  809    HB2  ASP  76           2HB      ASP  76   6.653  -3.886   6.798
  810    HB3  ASP  76           1HB      ASP  76   7.152  -5.528   6.396
  811    H    TYR  77           H        TYR  77   8.647  -3.921   4.371
  812    HA   TYR  77           HA       TYR  77   9.485  -6.495   3.602
  813    HB2  TYR  77           2HB      TYR  77   8.230  -5.217   2.013
  814    HB3  TYR  77           1HB      TYR  77   9.417  -3.912   2.032
  815    HD1  TYR  77           1HD      TYR  77   9.313  -7.596   1.424
  816    HD2  TYR  77           2HD      TYR  77  10.896  -3.824   0.256
  817    HE1  TYR  77           1HE      TYR  77  10.553  -8.686  -0.392
  818    HE2  TYR  77           2HE      TYR  77  12.140  -4.903  -1.567
  819    HH   TYR  77           HH       TYR  77  13.051  -7.179  -2.065
  820    H    ILE  78           H        ILE  78  11.268  -3.433   3.825
  821    HA   ILE  78           HA       ILE  78  13.703  -4.441   2.783
  822    HB   ILE  78           HB       ILE  78  13.300  -2.101   4.661
  823   HG12  ILE  78          2HG1      ILE  78  13.501  -2.121   1.641
  824   HG13  ILE  78          1HG1      ILE  78  11.993  -1.977   2.539
  825   HG21  ILE  78          1HG2      ILE  78  15.604  -2.690   4.673
  826   HG22  ILE  78          2HG2      ILE  78  15.624  -2.908   2.923
  827   HG23  ILE  78          3HG2      ILE  78  15.437  -1.294   3.609
  828   HD11  ILE  78          3HD1      ILE  78  12.770   0.184   1.762
  829   HD12  ILE  78          1HD1      ILE  78  12.779   0.109   3.525
  830   HD13  ILE  78          2HD1      ILE  78  14.291  -0.039   2.628
  831    H    ARG  79           H        ARG  79  12.276  -4.399   5.967
  832    HA   ARG  79           HA       ARG  79  14.630  -5.249   7.352
  833    HB2  ARG  79           2HB      ARG  79  12.158  -4.256   8.092
  834    HB3  ARG  79           1HB      ARG  79  12.081  -5.932   8.612
  835    HG2  ARG  79           2HG      ARG  79  14.306  -5.528   9.759
  836    HG3  ARG  79           1HG      ARG  79  14.027  -3.814   9.454
  837    HD2  ARG  79           2HD      ARG  79  11.673  -5.013  10.558
  838    HD3  ARG  79           1HD      ARG  79  13.062  -5.355  11.586
  839    HE   ARG  79           HE       ARG  79  13.101  -2.638  10.910
  840   HH11  ARG  79          2HH1      ARG  79  11.181  -4.881  12.795
  841   HH12  ARG  79          1HH1      ARG  79  10.639  -3.667  13.918
  842   HH21  ARG  79          2HH2      ARG  79  12.398  -1.039  12.375
  843   HH22  ARG  79          1HH2      ARG  79  11.366  -1.491  13.709
  844    H    LEU  80           H        LEU  80  11.708  -6.854   6.151
  845    HA   LEU  80           HA       LEU  80  12.361  -9.398   7.216
  846    HB2  LEU  80           2HB      LEU  80  10.131  -8.228   6.064
  847    HB3  LEU  80           1HB      LEU  80  10.590  -9.465   4.906
  848    HG   LEU  80           HG       LEU  80  10.664 -11.042   6.965
  849   HD11  LEU  80          1HD1      LEU  80   8.722 -10.143   8.530
  850   HD12  LEU  80          2HD1      LEU  80  10.422  -9.803   8.853
  851   HD13  LEU  80          3HD1      LEU  80   9.414  -8.590   8.063
  852   HD21  LEU  80          3HD2      LEU  80   8.433 -10.081   5.334
  853   HD22  LEU  80          1HD2      LEU  80   8.972 -11.727   5.667
  854   HD23  LEU  80          2HD2      LEU  80   7.947 -10.883   6.827
  855    H    PHE  81           H        PHE  81  12.414  -8.228   3.827
  856    HA   PHE  81           HA       PHE  81  14.177 -10.515   3.245
  857    HB2  PHE  81           2HB      PHE  81  12.222  -9.098   1.424
  858    HB3  PHE  81           1HB      PHE  81  13.337 -10.357   0.905
  859    HD1  PHE  81           2HD      PHE  81  13.049 -12.662   1.696
  860    HD2  PHE  81           1HD      PHE  81  10.225  -9.612   2.587
  861    HE1  PHE  81           2HE      PHE  81  11.395 -14.381   2.297
  862    HE2  PHE  81           1HE      PHE  81   8.556 -11.326   3.188
  863    HZ   PHE  81           HZ       PHE  81   9.145 -13.713   3.043
  864    H    GLY  82           H        GLY  82  13.706  -8.255   0.758
  865    HA2  GLY  82           1HA      GLY  82  15.130  -6.313   0.329
  866    HA3  GLY  82           2HA      GLY  82  16.395  -7.141   1.235
  Start of MODEL   13
    1    H    SER 641           1H       SER 641  46.743   2.959 -20.766
    2    HA   SER 641           HA       SER 641  44.604   2.692 -21.096
    3    HB2  SER 641           2HB      SER 641  44.932  -0.219 -20.373
    4    HB3  SER 641           1HB      SER 641  43.869   0.494 -21.588
    5    HG   SER 641           HG       SER 641  45.572   0.837 -22.908
    6    H    LEU 642           H        LEU 642  43.423   3.755 -19.638
    7    HA   LEU 642           HA       LEU 642  43.166   2.853 -16.914
    8    HB2  LEU 642           2HB      LEU 642  42.844   5.275 -18.299
    9    HB3  LEU 642           1HB      LEU 642  41.255   4.875 -17.676
   10    HG   LEU 642           HG       LEU 642  42.556   4.488 -15.428
   11   HD11  LEU 642          1HD1      LEU 642  44.734   4.909 -15.588
   12   HD12  LEU 642          2HD1      LEU 642  44.558   5.680 -17.165
   13   HD13  LEU 642          3HD1      LEU 642  44.291   6.612 -15.690
   14   HD21  LEU 642          3HD2      LEU 642  40.818   6.246 -16.072
   15   HD22  LEU 642          1HD2      LEU 642  41.912   6.629 -14.743
   16   HD23  LEU 642          2HD2      LEU 642  42.189   7.324 -16.341
   17    H    GLN 643           H        GLN 643  41.926   1.134 -16.494
   18    HA   GLN 643           HA       GLN 643  39.520   0.649 -18.062
   19    HB2  GLN 643           2HB      GLN 643  40.630  -1.005 -15.790
   20    HB3  GLN 643           1HB      GLN 643  39.409  -1.494 -16.957
   21    HG2  GLN 643           2HG      GLN 643  42.303  -0.921 -17.548
   22    HG3  GLN 643           1HG      GLN 643  41.548  -2.511 -17.454
   23   HE21  GLN 643          1HE2      GLN 643  42.791  -0.560 -19.575
   24   HE22  GLN 643          2HE2      GLN 643  41.753  -0.799 -20.942
   25    H    ASN 644           H        ASN 644  37.981   2.084 -17.420
   26    HA   ASN 644           HA       ASN 644  37.436   2.443 -14.585
   27    HB2  ASN 644           2HB      ASN 644  37.281   4.272 -16.459
   28    HB3  ASN 644           1HB      ASN 644  35.689   3.571 -16.748
   29   HD21  ASN 644          1HD2      ASN 644  34.749   5.552 -16.096
   30   HD22  ASN 644          2HD2      ASN 644  34.626   5.964 -14.421
   31    H    ASN 645           H        ASN 645  36.981   0.132 -14.381
   32    HA   ASN 645           HA       ASN 645  34.630  -0.920 -15.659
   33    HB2  ASN 645           2HB      ASN 645  36.764  -1.963 -13.917
   34    HB3  ASN 645           1HB      ASN 645  35.190  -2.720 -13.696
   35   HD21  ASN 645          1HD2      ASN 645  34.352  -4.009 -15.304
   36   HD22  ASN 645          2HD2      ASN 645  35.262  -4.478 -16.700
   37    H    GLN 646           H        GLN 646  32.733  -0.120 -15.050
   38    HA   GLN 646           HA       GLN 646  32.181   0.324 -12.210
   39    HB2  GLN 646           2HB      GLN 646  31.190   1.436 -14.704
   40    HB3  GLN 646           1HB      GLN 646  29.870   0.908 -13.669
   41    HG2  GLN 646           2HG      GLN 646  32.059   2.840 -12.943
   42    HG3  GLN 646           1HG      GLN 646  30.370   3.228 -13.268
   43   HE21  GLN 646          1HE2      GLN 646  32.638   2.071 -10.968
   44   HE22  GLN 646          2HE2      GLN 646  31.546   1.918  -9.633
   45    H    ASP 647           H        ASP 647  31.757  -1.931 -14.687
   46    HA   ASP 647           HA       ASP 647  29.597  -3.336 -13.313
   47    HB2  ASP 647           2HB      ASP 647  29.238  -4.502 -15.261
   48    HB3  ASP 647           1HB      ASP 647  29.974  -3.056 -15.943
   49    H    VAL 648           H        VAL 648  29.908  -5.670 -12.862
   50    HA   VAL 648           HA       VAL 648  32.699  -6.385 -12.373
   51    HB   VAL 648           HB       VAL 648  31.855  -5.459 -10.263
   52   HG11  VAL 648          1HG1      VAL 648  29.889  -5.945  -9.321
   53   HG12  VAL 648          2HG1      VAL 648  29.457  -6.601 -10.901
   54   HG13  VAL 648          3HG1      VAL 648  30.060  -7.672  -9.637
   55   HG21  VAL 648          3HG2      VAL 648  33.511  -6.995  -9.849
   56   HG22  VAL 648          1HG2      VAL 648  32.183  -7.645  -8.888
   57   HG23  VAL 648          2HG2      VAL 648  32.559  -8.348 -10.462
   58    H    SER 649           H        SER 649  33.157  -8.356 -13.045
   59    HA   SER 649           HA       SER 649  31.034 -10.082 -13.997
   60    HB2  SER 649           2HB      SER 649  33.610 -11.265 -14.299
   61    HB3  SER 649           1HB      SER 649  32.586 -10.551 -15.546
   62    HG   SER 649           HG       SER 649  33.643  -8.673 -15.387
   63    H    PHE 650           H        PHE 650  30.697 -10.030 -11.384
   64    HA   PHE 650           HA       PHE 650  32.079 -12.378 -10.279
   65    HB2  PHE 650           2HB      PHE 650  30.981  -9.891  -9.077
   66    HB3  PHE 650           1HB      PHE 650  30.842 -11.364  -8.123
   67    HD1  PHE 650           1HD      PHE 650  33.655 -11.671 -10.177
   68    HD2  PHE 650           2HD      PHE 650  32.295  -9.723  -6.646
   69    HE1  PHE 650           1HE      PHE 650  35.983 -11.404  -9.432
   70    HE2  PHE 650           2HE      PHE 650  34.621  -9.455  -5.896
   71    HZ   PHE 650           HZ       PHE 650  36.469 -10.297  -7.290
   72    H    GLU 651           H        GLU 651  30.841 -13.967 -11.202
   73    HA   GLU 651           HA       GLU 651  28.006 -13.914 -11.308
   74    HB2  GLU 651           2HB      GLU 651  29.604 -16.446 -11.419
   75    HB3  GLU 651           1HB      GLU 651  28.150 -16.018 -12.310
   76    HG2  GLU 651           2HG      GLU 651  29.580 -15.703 -14.003
   77    HG3  GLU 651           1HG      GLU 651  29.858 -14.144 -13.230
   78    H    ASN 652           H        ASN 652  30.264 -14.897  -8.876
   79    HA   ASN 652           HA       ASN 652  28.642 -16.670  -7.407
   80    HB2  ASN 652           2HB      ASN 652  30.659 -16.795  -6.417
   81    HB3  ASN 652           1HB      ASN 652  31.125 -15.195  -6.971
   82   HD21  ASN 652          1HD2      ASN 652  31.363 -13.676  -5.502
   83   HD22  ASN 652          2HD2      ASN 652  30.760 -13.733  -3.869
   84    H    ILE 653           H        ILE 653  28.875 -13.163  -7.435
   85    HA   ILE 653           HA       ILE 653  26.405 -13.066  -5.838
   86    HB   ILE 653           HB       ILE 653  27.209 -10.559  -5.546
   87   HG12  ILE 653          2HG1      ILE 653  29.887 -11.861  -5.330
   88   HG13  ILE 653          1HG1      ILE 653  29.351 -11.339  -6.924
   89   HG21  ILE 653          1HG2      ILE 653  27.178 -11.217  -3.433
   90   HG22  ILE 653          2HG2      ILE 653  27.184 -12.891  -3.989
   91   HG23  ILE 653          3HG2      ILE 653  28.707 -12.074  -3.637
   92   HD11  ILE 653          3HD1      ILE 653  30.638  -9.798  -5.040
   93   HD12  ILE 653          1HD1      ILE 653  29.780  -9.208  -6.465
   94   HD13  ILE 653          2HD1      ILE 653  28.953  -9.293  -4.907
   95    H    GLN 654           H        GLN 654  25.866 -13.594  -8.236
   96    HA   GLN 654           HA       GLN 654  25.866 -11.520 -10.143
   97    HB2  GLN 654           2HB      GLN 654  25.559 -14.097 -10.385
   98    HB3  GLN 654           1HB      GLN 654  23.855 -13.738 -10.134
   99    HG2  GLN 654           2HG      GLN 654  25.103 -12.016 -12.105
  100    HG3  GLN 654           1HG      GLN 654  25.187 -13.726 -12.522
  101   HE21  GLN 654          1HE2      GLN 654  23.647 -11.542 -13.732
  102   HE22  GLN 654          2HE2      GLN 654  21.991 -12.061 -13.687
  103    H    TRP 655           H        TRP 655  23.788 -12.276  -7.498
  104    HA   TRP 655           HA       TRP 655  21.501 -10.888  -8.475
  105    HB2  TRP 655           2HB      TRP 655  20.452 -11.694  -6.649
  106    HB3  TRP 655           1HB      TRP 655  21.880 -12.702  -6.491
  107    HD1  TRP 655           HD       TRP 655  23.786 -11.733  -4.690
  108    HE1  TRP 655           1HE      TRP 655  23.398 -10.521  -2.447
  109    HE3  TRP 655           3HE      TRP 655  18.982 -10.173  -5.436
  110    HZ2  TRP 655           2HZ      TRP 655  21.328  -9.091  -1.173
  111    HZ3  TRP 655           3HZ      TRP 655  17.865  -8.893  -3.663
  112    HH2  TRP 655           HH       TRP 655  19.013  -8.361  -1.571
  113    H    SER 656           H        SER 656  20.609  -8.939  -7.525
  114    HA   SER 656           HA       SER 656  22.478  -6.831  -7.629
  115    HB2  SER 656           2HB      SER 656  19.720  -6.537  -6.455
  116    HB3  SER 656           1HB      SER 656  20.640  -5.382  -7.419
  117    HG   SER 656           HG       SER 656  20.464  -7.133  -9.120
  118    H    ILE 657           H        ILE 657  24.040  -7.187  -6.053
  119    HA   ILE 657           HA       ILE 657  23.452  -7.463  -3.287
  120    HB   ILE 657           HB       ILE 657  25.954  -6.725  -3.094
  121   HG12  ILE 657          2HG1      ILE 657  26.670  -7.742  -5.640
  122   HG13  ILE 657          1HG1      ILE 657  25.482  -6.471  -5.920
  123   HG21  ILE 657          1HG2      ILE 657  25.655  -8.914  -2.589
  124   HG22  ILE 657          2HG2      ILE 657  24.763  -9.252  -4.072
  125   HG23  ILE 657          3HG2      ILE 657  26.521  -9.110  -4.113
  126   HD11  ILE 657          3HD1      ILE 657  26.833  -4.857  -4.844
  127   HD12  ILE 657          1HD1      ILE 657  27.908  -6.091  -4.188
  128   HD13  ILE 657          2HD1      ILE 657  27.892  -5.763  -5.922
  129    H    ASP 658           H        ASP 658  23.124  -4.887  -5.272
  130    HA   ASP 658           HA       ASP 658  24.047  -2.728  -3.700
  131    HB2  ASP 658           2HB      ASP 658  22.739  -3.064  -6.182
  132    HB3  ASP 658           1HB      ASP 658  21.692  -2.028  -5.217
  133    HA   PRO 659           HA       PRO 659  21.255  -3.313  -0.338
  134    HB2  PRO 659           2HB      PRO 659  21.699  -0.925   0.927
  135    HB3  PRO 659           1HB      PRO 659  22.797  -2.306   1.007
  136    HG2  PRO 659           2HG      PRO 659  22.948   0.139  -0.704
  137    HG3  PRO 659           1HG      PRO 659  24.246  -0.707   0.160
  138    HD2  PRO 659           2HD      PRO 659  23.853  -1.003  -2.492
  139    HD3  PRO 659           1HD      PRO 659  24.449  -2.327  -1.472
  140    H    GLY 660           H        GLY 660  19.410  -3.170  -1.871
  141    HA2  GLY 660           1HA      GLY 660  17.232  -2.447  -2.092
  142    HA3  GLY 660           2HA      GLY 660  17.564  -1.239  -0.860
  143    H    ALA 661           H        ALA 661  19.303  -1.597  -3.898
  144    HA   ALA 661           HA       ALA 661  18.725   1.184  -4.506
  145    HB1  ALA 661           1HB      ALA 661  20.654   1.180  -5.627
  146    HB2  ALA 661           2HB      ALA 661  20.939  -0.383  -4.863
  147    HB3  ALA 661           3HB      ALA 661  20.257  -0.306  -6.487
  148    H    ASP 662           H        ASP 662  17.748  -1.981  -5.511
  149    HA   ASP 662           HA       ASP 662  16.064  -0.736  -7.584
  150    HB2  ASP 662           2HB      ASP 662  17.766  -1.990  -8.748
  151    HB3  ASP 662           1HB      ASP 662  17.491  -3.400  -7.728
  152    H    LEU 663           H        LEU 663  14.153  -0.672  -6.649
  153    HA   LEU 663           HA       LEU 663  13.042  -3.202  -5.625
  154    HB2  LEU 663           2HB      LEU 663  13.142  -0.536  -4.403
  155    HB3  LEU 663           1HB      LEU 663  11.534  -1.235  -4.425
  156    HG   LEU 663           HG       LEU 663  12.647  -3.319  -3.371
  157   HD11  LEU 663          1HD1      LEU 663  14.945  -2.803  -3.692
  158   HD12  LEU 663          2HD1      LEU 663  14.763  -1.227  -2.922
  159   HD13  LEU 663          3HD1      LEU 663  14.621  -2.699  -1.961
  160   HD21  LEU 663          3HD2      LEU 663  11.503  -2.557  -1.631
  161   HD22  LEU 663          1HD2      LEU 663  12.847  -1.489  -1.219
  162   HD23  LEU 663          2HD2      LEU 663  11.564  -0.921  -2.287
  163    H    SER 664           H        SER 664  13.089  -1.604  -8.223
  164    HA   SER 664           HA       SER 664  10.519  -0.571  -8.718
  165    HB2  SER 664           2HB      SER 664  11.985  -1.687 -11.020
  166    HB3  SER 664           1HB      SER 664  11.370  -0.056 -10.756
  167    HG   SER 664           HG       SER 664  13.829  -1.202  -9.946
  168    H    GLN 665           H        GLN 665  11.794  -3.781  -8.778
  169    HA   GLN 665           HA       GLN 665   9.636  -4.896 -10.336
  170    HB2  GLN 665           2HB      GLN 665  11.064  -6.883  -8.826
  171    HB3  GLN 665           1HB      GLN 665  11.047  -6.621 -10.563
  172    HG2  GLN 665           2HG      GLN 665  13.284  -6.439 -10.072
  173    HG3  GLN 665           1HG      GLN 665  12.775  -4.753 -10.041
  174   HE21  GLN 665          1HE2      GLN 665  14.827  -6.620  -8.596
  175   HE22  GLN 665          2HE2      GLN 665  14.719  -6.081  -6.959
  176    H    TYR 666           H        TYR 666  10.566  -4.637  -6.968
  177    HA   TYR 666           HA       TYR 666   8.558  -6.395  -5.959
  178    HB2  TYR 666           2HB      TYR 666  10.113  -4.248  -4.512
  179    HB3  TYR 666           1HB      TYR 666   9.221  -5.564  -3.762
  180    HD1  TYR 666           2HD      TYR 666  10.058  -7.856  -5.439
  181    HD2  TYR 666           1HD      TYR 666  12.311  -4.597  -3.883
  182    HE1  TYR 666           2HE      TYR 666  12.081  -9.251  -5.459
  183    HE2  TYR 666           1HE      TYR 666  14.340  -5.984  -3.894
  184    HH   TYR 666           HH       TYR 666  14.873  -8.489  -5.541
  185    H    LYS 667           H        LYS 667   8.437  -3.246  -7.138
  186    HA   LYS 667           HA       LYS 667   6.774  -1.918  -5.335
  187    HB2  LYS 667           2HB      LYS 667   7.669  -1.523  -8.083
  188    HB3  LYS 667           1HB      LYS 667   6.061  -0.880  -7.782
  189    HG2  LYS 667           2HG      LYS 667   7.649  -0.091  -5.604
  190    HG3  LYS 667           1HG      LYS 667   8.598   0.209  -7.061
  191    HD2  LYS 667           2HD      LYS 667   5.728   1.029  -7.000
  192    HD3  LYS 667           1HD      LYS 667   6.918   2.015  -6.147
  193    HE2  LYS 667           2HE      LYS 667   8.245   2.031  -8.305
  194    HE3  LYS 667           1HE      LYS 667   6.817   1.343  -9.080
  195    HZ1  LYS 667           3HZ      LYS 667   7.136   4.003  -7.825
  196    HZ2  LYS 667           1HZ      LYS 667   5.597   3.332  -8.087
  197    HZ3  LYS 667           2HZ      LYS 667   6.630   3.627  -9.398
  198    H    MET 668           H        MET 668   4.776  -2.214  -4.751
  199    HA   MET 668           HA       MET 668   2.896  -3.511  -6.611
  200    HB2  MET 668           2HB      MET 668   3.088  -4.754  -4.541
  201    HB3  MET 668           1HB      MET 668   2.860  -3.293  -3.588
  202    HG2  MET 668           2HG      MET 668   0.627  -3.366  -3.778
  203    HG3  MET 668           1HG      MET 668   0.681  -3.911  -5.454
  204    HE1  MET 668           3HE      MET 668   1.467  -6.801  -1.941
  205    HE2  MET 668           1HE      MET 668   2.728  -5.822  -2.693
  206    HE3  MET 668           2HE      MET 668   1.435  -5.045  -1.779
  207    H    ASP 669           H        ASP 669   1.708  -2.061  -7.654
  208    HA   ASP 669           HA       ASP 669   1.376   0.607  -6.565
  209    HB2  ASP 669           2HB      ASP 669   1.951   0.147  -8.993
  210    HB3  ASP 669           1HB      ASP 669   0.294  -0.421  -9.189
  211    H    VAL 670           H        VAL 670  -0.582   1.614  -6.165
  212    HA   VAL 670           HA       VAL 670  -2.789  -0.248  -5.612
  213    HB   VAL 670           HB       VAL 670  -2.470   2.498  -4.404
  214   HG11  VAL 670          1HG1      VAL 670  -3.760   0.256  -2.980
  215   HG12  VAL 670          2HG1      VAL 670  -4.202   1.962  -3.057
  216   HG13  VAL 670          3HG1      VAL 670  -4.607   0.886  -4.391
  217   HG21  VAL 670          3HG2      VAL 670  -0.621   0.517  -4.033
  218   HG22  VAL 670          1HG2      VAL 670  -0.973   1.808  -2.881
  219   HG23  VAL 670          2HG2      VAL 670  -1.742   0.230  -2.700
  220    H    THR 671           H        THR 671  -4.256  -0.179  -7.209
  221    HA   THR 671           HA       THR 671  -4.879   2.334  -8.537
  222    HB   THR 671           HB       THR 671  -6.599  -0.001  -9.090
  223    HG1  THR 671           1HG      THR 671  -3.820  -0.059  -9.801
  224   HG21  THR 671          3HG2      THR 671  -5.188   0.932 -11.361
  225   HG22  THR 671          1HG2      THR 671  -5.628   2.344 -10.400
  226   HG23  THR 671          2HG2      THR 671  -6.876   1.214 -10.931
  227    H    VAL 672           H        VAL 672  -6.342   3.680  -7.706
  228    HA   VAL 672           HA       VAL 672  -8.108   2.778  -5.594
  229    HB   VAL 672           HB       VAL 672  -8.088   5.561  -6.728
  230   HG11  VAL 672          1HG1      VAL 672  -8.938   4.245  -4.195
  231   HG12  VAL 672          2HG1      VAL 672  -8.395   5.923  -4.140
  232   HG13  VAL 672          3HG1      VAL 672  -9.760   5.471  -5.161
  233   HG21  VAL 672          3HG2      VAL 672  -5.767   5.136  -6.369
  234   HG22  VAL 672          1HG2      VAL 672  -6.340   6.089  -5.001
  235   HG23  VAL 672          2HG2      VAL 672  -6.089   4.352  -4.823
  236    H    ILE 673           H        ILE 673 -10.225   2.396  -5.778
  237    HA   ILE 673           HA       ILE 673 -11.434   2.765  -8.415
  238    HB   ILE 673           HB       ILE 673 -12.120   1.003  -6.078
  239   HG12  ILE 673          2HG1      ILE 673 -12.315  -0.525  -8.297
  240   HG13  ILE 673          1HG1      ILE 673 -11.162   0.677  -8.864
  241   HG21  ILE 673          1HG2      ILE 673 -14.236   0.461  -6.928
  242   HG22  ILE 673          2HG2      ILE 673 -14.170   2.222  -7.014
  243   HG23  ILE 673          3HG2      ILE 673 -13.919   1.255  -8.471
  244   HD11  ILE 673          3HD1      ILE 673 -10.639  -0.531  -6.223
  245   HD12  ILE 673          1HD1      ILE 673 -10.439  -1.567  -7.636
  246   HD13  ILE 673          2HD1      ILE 673  -9.520  -0.066  -7.505
  247    H    ASP 674           H        ASP 674 -12.615   4.491  -8.749
  248    HA   ASP 674           HA       ASP 674 -13.682   6.046  -6.562
  249    HB2  ASP 674           2HB      ASP 674 -12.758   7.159  -8.552
  250    HB3  ASP 674           1HB      ASP 674 -13.982   6.391  -9.555
  251    H    THR 675           H        THR 675 -15.145   4.648  -5.611
  252    HA   THR 675           HA       THR 675 -17.197   3.308  -7.029
  253    HB   THR 675           HB       THR 675 -17.690   3.894  -4.189
  254    HG1  THR 675           1HG      THR 675 -15.886   2.738  -3.469
  255   HG21  THR 675          3HG2      THR 675 -18.904   2.069  -4.698
  256   HG22  THR 675          1HG2      THR 675 -17.388   1.190  -4.486
  257   HG23  THR 675          2HG2      THR 675 -17.908   1.680  -6.099
  258    H    LYS 676           H        LYS 676 -18.351   4.761  -8.267
  259    HA   LYS 676           HA       LYS 676 -19.921   6.818  -6.908
  260    HB2  LYS 676           2HB      LYS 676 -18.880   7.298  -9.116
  261    HB3  LYS 676           1HB      LYS 676 -19.845   6.015  -9.829
  262    HG2  LYS 676           2HG      LYS 676 -20.948   8.004 -10.378
  263    HG3  LYS 676           1HG      LYS 676 -21.881   7.306  -9.054
  264    HD2  LYS 676           2HD      LYS 676 -21.727   9.532  -8.433
  265    HD3  LYS 676           1HD      LYS 676 -20.382   8.801  -7.551
  266    HE2  LYS 676           2HE      LYS 676 -19.617  10.835  -8.565
  267    HE3  LYS 676           1HE      LYS 676 -18.874   9.476  -9.400
  268    HZ1  LYS 676           3HZ      LYS 676 -21.146  11.133 -10.347
  269    HZ2  LYS 676           1HZ      LYS 676 -20.645   9.704 -11.110
  270    HZ3  LYS 676           2HZ      LYS 676 -19.593  11.029 -11.023
  271    H    ASP 677           H        ASP 677 -20.054   3.591  -7.472
  272    HA   ASP 677           HA       ASP 677 -22.906   3.391  -7.998
  273    HB2  ASP 677           2HB      ASP 677 -21.429   1.909  -9.240
  274    HB3  ASP 677           1HB      ASP 677 -20.748   1.289  -7.743
  275    H    GLY 678           H        GLY 678 -24.102   3.766  -6.250
  276    HA2  GLY 678           1HA      GLY 678 -25.235   2.841  -4.406
  277    HA3  GLY 678           2HA      GLY 678 -23.819   1.869  -4.050
  278    H    SER 679           H        SER 679 -22.712   4.922  -4.580
  279    HA   SER 679           HA       SER 679 -22.337   5.374  -1.755
  280    HB2  SER 679           2HB      SER 679 -21.351   7.577  -3.206
  281    HB3  SER 679           1HB      SER 679 -20.427   6.207  -2.585
  282    HG   SER 679           HG       SER 679 -20.037   6.044  -4.687
  283    H    GLN 680           H        GLN 680 -24.585   6.332  -4.099
  284    HA   GLN 680           HA       GLN 680 -25.267   8.795  -2.667
  285    HB2  GLN 680           2HB      GLN 680 -26.178   7.801  -5.371
  286    HB3  GLN 680           1HB      GLN 680 -26.609   9.345  -4.653
  287    HG2  GLN 680           2HG      GLN 680 -24.474  10.215  -4.917
  288    HG3  GLN 680           1HG      GLN 680 -23.740   8.621  -5.070
  289   HE21  GLN 680          1HE2      GLN 680 -23.978   7.485  -7.028
  290   HE22  GLN 680          2HE2      GLN 680 -24.338   8.310  -8.502
  291    H    SER 681           H        SER 681 -26.748   8.609  -1.166
  292    HA   SER 681           HA       SER 681 -28.535   6.351  -1.099
  293    HB2  SER 681           2HB      SER 681 -29.159   8.264   0.917
  294    HB3  SER 681           1HB      SER 681 -28.331   6.715   1.097
  295    HG   SER 681           HG       SER 681 -27.319   9.199   1.267
  296    H    LYS 682           H        LYS 682 -28.746   9.801  -1.750
  297    HA   LYS 682           HA       LYS 682 -31.664   9.663  -1.852
  298    HB2  LYS 682           2HB      LYS 682 -29.773  11.705  -1.237
  299    HB3  LYS 682           1HB      LYS 682 -30.695  12.224  -2.641
  300    HG2  LYS 682           2HG      LYS 682 -32.443  11.098  -0.658
  301    HG3  LYS 682           1HG      LYS 682 -31.451  12.378   0.040
  302    HD2  LYS 682           2HD      LYS 682 -33.194  13.624  -0.765
  303    HD3  LYS 682           1HD      LYS 682 -32.133  13.638  -2.175
  304    HE2  LYS 682           2HE      LYS 682 -34.038  12.995  -3.225
  305    HE3  LYS 682           1HE      LYS 682 -33.500  11.403  -2.700
  306    HZ1  LYS 682           3HZ      LYS 682 -35.842  11.784  -2.197
  307    HZ2  LYS 682           1HZ      LYS 682 -35.435  13.127  -1.242
  308    HZ3  LYS 682           2HZ      LYS 682 -34.939  11.572  -0.777
  309    H    LEU 683           H        LEU 683 -29.419   8.721  -3.885
  310    HA   LEU 683           HA       LEU 683 -30.862   9.737  -6.238
  311    HB2  LEU 683           2HB      LEU 683 -27.909   9.395  -5.821
  312    HB3  LEU 683           1HB      LEU 683 -28.602   9.342  -7.433
  313    HG   LEU 683           HG       LEU 683 -29.678  11.658  -6.386
  314   HD11  LEU 683          1HD1      LEU 683 -28.181  12.796  -5.107
  315   HD12  LEU 683          2HD1      LEU 683 -27.830  11.159  -4.551
  316   HD13  LEU 683          3HD1      LEU 683 -26.793  11.922  -5.757
  317   HD21  LEU 683          3HD2      LEU 683 -28.017  10.843  -8.500
  318   HD22  LEU 683          1HD2      LEU 683 -28.883  12.369  -8.329
  319   HD23  LEU 683          2HD2      LEU 683 -27.227  12.226  -7.743
  320    H    GLY 684           H        GLY 684 -32.088   8.083  -6.822
  321    HA2  GLY 684           1HA      GLY 684 -32.299   6.075  -8.082
  322    HA3  GLY 684           2HA      GLY 684 -30.759   5.538  -7.425
  323    H    GLY 685           H        GLY 685 -32.786   3.770  -7.417
  324    HA2  GLY 685           1HA      GLY 685 -33.421   2.184  -5.808
  325    HA3  GLY 685           2HA      GLY 685 -33.170   3.384  -4.550
  326    H    GLY 901           H        GLY 901 -34.759   5.362  -4.889
  327    HA2  GLY 901           1HA      GLY 901 -37.416   4.214  -4.706
  328    HA3  GLY 901           2HA      GLY 901 -36.969   5.877  -4.351
  329    H    GLY 902           H        GLY 902 -39.188   4.737  -5.967
  330    HA2  GLY 902           1HA      GLY 902 -40.295   5.935  -7.694
  331    HA3  GLY 902           2HA      GLY 902 -38.732   6.445  -8.316
  332    H    SER 903           H        SER 903 -38.140   3.378  -7.727
  333    HA   SER 903           HA       SER 903 -38.512   2.593 -10.465
  334    HB2  SER 903           2HB      SER 903 -37.583   0.665  -8.388
  335    HB3  SER 903           1HB      SER 903 -36.986   0.925 -10.028
  336    HG   SER 903           HG       SER 903 -35.850   1.779  -7.899
  337    H    GLY 904           H        GLY 904 -40.071   1.960  -7.409
  338    HA2  GLY 904           1HA      GLY 904 -42.477   1.127  -8.350
  339    HA3  GLY 904           2HA      GLY 904 -41.514  -0.343  -8.367
  340    H    GLY 905           H        GLY 905 -43.390  -0.858  -6.854
  341    HA2  GLY 905           1HA      GLY 905 -43.304   0.288  -4.221
  342    HA3  GLY 905           2HA      GLY 905 -44.268  -1.090  -4.731
  343    H    HIS 906           H        HIS 906 -41.646  -2.297  -5.789
  344    HA   HIS 906           HA       HIS 906 -40.947  -3.559  -3.254
  345    HB2  HIS 906           2HB      HIS 906 -41.416  -4.720  -5.583
  346    HB3  HIS 906           1HB      HIS 906 -39.711  -4.377  -5.850
  347    HD1  HIS 906           1HD      HIS 906 -37.984  -5.694  -4.367
  348    HD2  HIS 906           2HD      HIS 906 -41.974  -6.706  -3.742
  349    HE1  HIS 906           1HE      HIS 906 -37.976  -7.826  -3.009
  350    H    MET 907           H        MET 907 -39.821  -1.729  -2.393
  351    HA   MET 907           HA       MET 907 -37.307  -1.022  -3.699
  352    HB2  MET 907           2HB      MET 907 -38.646   0.838  -2.887
  353    HB3  MET 907           1HB      MET 907 -38.702   0.137  -1.276
  354    HG2  MET 907           2HG      MET 907 -36.070   0.292  -1.530
  355    HG3  MET 907           1HG      MET 907 -36.510   1.579  -2.649
  356    HE1  MET 907           3HE      MET 907 -38.581   0.373   0.172
  357    HE2  MET 907           1HE      MET 907 -37.327   0.590   1.392
  358    HE3  MET 907           2HE      MET 907 -38.682   1.717   1.312
  359    H    GLY 908           H        GLY 908 -35.871  -2.617  -3.351
  360    HA2  GLY 908           1HA      GLY 908 -35.043  -3.039  -0.579
  361    HA3  GLY 908           2HA      GLY 908 -35.456  -4.459  -1.532
  362    H    SER 909           H        SER 909 -32.937  -4.027  -0.394
  363    HA   SER 909           HA       SER 909 -31.104  -2.985  -2.304
  364    HB2  SER 909           2HB      SER 909 -29.803  -4.824  -0.572
  365    HB3  SER 909           1HB      SER 909 -29.812  -3.062  -0.470
  366    HG   SER 909           HG       SER 909 -30.673  -3.731   1.435
  367    H    GLY 910           H        GLY 910 -30.369  -3.938  -4.111
  368    HA2  GLY 910           1HA      GLY 910 -30.882  -6.792  -4.514
  369    HA3  GLY 910           2HA      GLY 910 -30.365  -5.644  -5.742
  370    H    GLY 911           H        GLY 911 -28.273  -4.609  -3.881
  371    HA2  GLY 911           1HA      GLY 911 -26.386  -6.866  -4.142
  372    HA3  GLY 911           2HA      GLY 911 -25.939  -5.193  -4.443
  373    H    LEU  18           H        LEU  18 -26.705  -7.575  -2.011
  374    HA   LEU  18           HA       LEU  18 -25.801  -5.701   0.078
  375    HB2  LEU  18           2HB      LEU  18 -27.836  -7.795  -0.020
  376    HB3  LEU  18           1HB      LEU  18 -26.779  -7.941   1.371
  377    HG   LEU  18           HG       LEU  18 -28.386  -5.486   0.650
  378   HD11  LEU  18          1HD1      LEU  18 -30.016  -6.857   1.450
  379   HD12  LEU  18          2HD1      LEU  18 -28.891  -7.832   2.394
  380   HD13  LEU  18          3HD1      LEU  18 -29.392  -6.248   2.981
  381   HD21  LEU  18          3HD2      LEU  18 -27.566  -4.461   2.559
  382   HD22  LEU  18          1HD2      LEU  18 -27.007  -5.978   3.261
  383   HD23  LEU  18          2HD2      LEU  18 -26.134  -5.257   1.907
  384    H    SER  19           H        SER  19 -24.603  -8.001  -1.874
  385    HA   SER  19           HA       SER  19 -22.950  -9.337   0.117
  386    HB2  SER  19           2HB      SER  19 -22.261 -10.018  -2.584
  387    HB3  SER  19           1HB      SER  19 -23.009 -11.027  -1.346
  388    HG   SER  19           HG       SER  19 -24.920 -10.680  -2.198
  389    H    TRP  20           H        TRP  20 -22.764  -6.908  -2.361
  390    HA   TRP  20           HA       TRP  20 -21.144  -5.511  -3.097
  391    HB2  TRP  20           2HB      TRP  20 -19.676  -5.955  -0.512
  392    HB3  TRP  20           1HB      TRP  20 -19.774  -4.492  -1.485
  393    HD1  TRP  20           HD       TRP  20 -22.811  -3.981  -1.712
  394    HE1  TRP  20           1HE      TRP  20 -24.246  -3.473   0.361
  395    HE3  TRP  20           3HE      TRP  20 -19.779  -5.978   1.881
  396    HZ2  TRP  20           2HZ      TRP  20 -24.103  -3.858   3.153
  397    HZ3  TRP  20           3HZ      TRP  20 -20.494  -5.857   4.232
  398    HH2  TRP  20           HH       TRP  20 -22.616  -4.817   4.853
  399    H    LYS  21           H        LYS  21 -18.503  -6.563  -1.307
  400    HA   LYS  21           HA       LYS  21 -17.595  -8.432  -3.359
  401    HB2  LYS  21           2HB      LYS  21 -16.771  -5.765  -3.323
  402    HB3  LYS  21           1HB      LYS  21 -15.454  -6.646  -2.560
  403    HG2  LYS  21           2HG      LYS  21 -14.773  -6.831  -4.707
  404    HG3  LYS  21           1HG      LYS  21 -15.839  -8.239  -4.657
  405    HD2  LYS  21           2HD      LYS  21 -17.679  -6.626  -5.431
  406    HD3  LYS  21           1HD      LYS  21 -16.357  -5.527  -5.836
  407    HE2  LYS  21           2HE      LYS  21 -15.488  -6.985  -7.450
  408    HE3  LYS  21           1HE      LYS  21 -16.391  -8.364  -6.820
  409    HZ1  LYS  21           3HZ      LYS  21 -17.127  -6.985  -8.966
  410    HZ2  LYS  21           1HZ      LYS  21 -17.978  -6.117  -7.779
  411    HZ3  LYS  21           2HZ      LYS  21 -18.229  -7.786  -7.957
  412    H    ARG  22           H        ARG  22 -16.134  -9.951  -2.629
  413    HA   ARG  22           HA       ARG  22 -16.157 -10.381   0.217
  414    HB2  ARG  22           2HB      ARG  22 -16.214 -12.062  -1.866
  415    HB3  ARG  22           1HB      ARG  22 -14.480 -12.063  -1.574
  416    HG2  ARG  22           2HG      ARG  22 -16.370 -12.520   0.687
  417    HG3  ARG  22           1HG      ARG  22 -15.993 -13.830  -0.436
  418    HD2  ARG  22           2HD      ARG  22 -13.516 -12.825   0.116
  419    HD3  ARG  22           1HD      ARG  22 -14.347 -12.607   1.656
  420    HE   ARG  22           HE       ARG  22 -14.905 -15.186   0.841
  421   HH11  ARG  22          2HH1      ARG  22 -12.016 -13.322   1.522
  422   HH12  ARG  22          1HH1      ARG  22 -11.141 -14.689   2.151
  423   HH21  ARG  22          2HH2      ARG  22 -13.753 -16.967   1.630
  424   HH22  ARG  22          1HH2      ARG  22 -12.125 -16.762   2.201
  425    H    CYS  23           H        CYS  23 -14.538 -10.125   1.642
  426    HA   CYS  23           HA       CYS  23 -12.346  -8.464   1.148
  427    HB2  CYS  23           2HB      CYS  23 -13.090 -10.321   3.361
  428    HB3  CYS  23           1HB      CYS  23 -11.485  -9.616   3.324
  429    H    ALA  24           H        ALA  24 -10.120  -8.887   1.126
  430    HA   ALA  24           HA       ALA  24  -9.384 -11.613   0.274
  431    HB1  ALA  24           1HB      ALA  24  -7.956  -9.026  -0.340
  432    HB2  ALA  24           2HB      ALA  24  -7.531 -10.629  -0.938
  433    HB3  ALA  24           3HB      ALA  24  -9.044  -9.873  -1.441
  434    H    GLY  25           H        GLY  25  -8.798  -9.013   2.505
  435    HA2  GLY  25           1HA      GLY  25  -6.469 -10.418   3.622
  436    HA3  GLY  25           2HA      GLY  25  -6.890  -8.741   3.914
  437    H    CYS  26           H        CYS  26  -9.552  -8.956   4.691
  438    HA   CYS  26           HA       CYS  26  -9.212  -9.909   7.372
  439    HB2  CYS  26           2HB      CYS  26 -11.893  -9.125   6.297
  440    HB3  CYS  26           1HB      CYS  26 -11.220  -8.862   7.899
  441    H    GLY  27           H        GLY  27 -12.197 -10.471   5.636
  442    HA2  GLY  27           1HA      GLY  27 -12.315 -13.022   4.915
  443    HA3  GLY  27           2HA      GLY  27 -12.231 -13.200   6.663
  444    H    GLY  28           H        GLY  28 -13.966 -11.266   4.254
  445    HA2  GLY  28           1HA      GLY  28 -16.521 -12.240   4.929
  446    HA3  GLY  28           2HA      GLY  28 -16.238 -10.726   5.782
  447    H    LYS  29           H        LYS  29 -17.460  -9.275   4.714
  448    HA   LYS  29           HA       LYS  29 -16.848  -8.967   1.854
  449    HB2  LYS  29           2HB      LYS  29 -19.170  -7.532   2.193
  450    HB3  LYS  29           1HB      LYS  29 -19.051  -9.134   1.484
  451    HG2  LYS  29           2HG      LYS  29 -19.286  -9.923   3.968
  452    HG3  LYS  29           1HG      LYS  29 -19.994  -8.318   4.183
  453    HD2  LYS  29           2HD      LYS  29 -21.130  -9.377   1.837
  454    HD3  LYS  29           1HD      LYS  29 -21.156 -10.679   3.030
  455    HE2  LYS  29           2HE      LYS  29 -22.054  -7.924   3.773
  456    HE3  LYS  29           1HE      LYS  29 -23.138  -9.011   2.904
  457    HZ1  LYS  29           3HZ      LYS  29 -23.447 -10.273   4.703
  458    HZ2  LYS  29           1HZ      LYS  29 -22.883  -8.929   5.572
  459    HZ3  LYS  29           2HZ      LYS  29 -21.824 -10.202   5.187
  460    H    ILE  30           H        ILE  30 -16.363  -6.966   1.104
  461    HA   ILE  30           HA       ILE  30 -15.121  -5.210   2.944
  462    HB   ILE  30           HB       ILE  30 -15.682  -5.024  -0.009
  463   HG12  ILE  30          2HG1      ILE  30 -12.929  -5.001   1.004
  464   HG13  ILE  30          1HG1      ILE  30 -13.830  -6.446   1.445
  465   HG21  ILE  30          1HG2      ILE  30 -15.098  -2.859   1.740
  466   HG22  ILE  30          2HG2      ILE  30 -13.680  -3.168   0.735
  467   HG23  ILE  30          3HG2      ILE  30 -15.242  -2.851  -0.017
  468   HD11  ILE  30          3HD1      ILE  30 -12.926  -5.510  -1.208
  469   HD12  ILE  30          1HD1      ILE  30 -12.983  -7.136  -0.528
  470   HD13  ILE  30          2HD1      ILE  30 -14.460  -6.379  -1.124
  471    H    ALA  31           H        ALA  31 -16.230  -4.001   4.296
  472    HA   ALA  31           HA       ALA  31 -18.739  -2.765   3.437
  473    HB1  ALA  31           1HB      ALA  31 -19.451  -2.896   5.568
  474    HB2  ALA  31           2HB      ALA  31 -18.184  -4.116   5.703
  475    HB3  ALA  31           3HB      ALA  31 -17.876  -2.462   6.235
  476    H    ASP  32           H        ASP  32 -16.081  -1.818   2.614
  477    HA   ASP  32           HA       ASP  32 -15.917   0.786   3.943
  478    HB2  ASP  32           2HB      ASP  32 -14.129  -0.706   2.039
  479    HB3  ASP  32           1HB      ASP  32 -13.966   1.037   2.219
  480    H    ARG  33           H        ARG  33 -15.316   2.570   2.148
  481    HA   ARG  33           HA       ARG  33 -17.549   2.514   0.252
  482    HB2  ARG  33           2HB      ARG  33 -17.428   4.447   1.781
  483    HB3  ARG  33           1HB      ARG  33 -15.827   4.835   1.160
  484    HG2  ARG  33           2HG      ARG  33 -16.636   5.662  -0.804
  485    HG3  ARG  33           1HG      ARG  33 -18.068   4.633  -0.780
  486    HD2  ARG  33           2HD      ARG  33 -17.707   6.806   1.249
  487    HD3  ARG  33           1HD      ARG  33 -18.335   7.169  -0.356
  488    HE   ARG  33           HE       ARG  33 -19.766   5.009   0.754
  489   HH11  ARG  33          2HH1      ARG  33 -19.329   8.457   1.192
  490   HH12  ARG  33          1HH1      ARG  33 -20.942   8.715   1.785
  491   HH21  ARG  33          2HH2      ARG  33 -21.895   5.335   1.514
  492   HH22  ARG  33          1HH2      ARG  33 -22.405   6.932   1.961
  493    H    PHE  34           H        PHE  34 -14.119   3.428   0.419
  494    HA   PHE  34           HA       PHE  34 -13.949   3.104  -2.492
  495    HB2  PHE  34           2HB      PHE  34 -12.470   4.725  -0.497
  496    HB3  PHE  34           1HB      PHE  34 -11.530   4.089  -1.844
  497    HD1  PHE  34           1HD      PHE  34 -14.961   5.508  -1.493
  498    HD2  PHE  34           2HD      PHE  34 -11.201   5.659  -3.482
  499    HE1  PHE  34           1HE      PHE  34 -15.813   7.302  -2.941
  500    HE2  PHE  34           2HE      PHE  34 -12.037   7.467  -4.931
  501    HZ   PHE  34           HZ       PHE  34 -14.347   8.286  -4.667
  502    H    LEU  35           H        LEU  35 -13.096   1.334  -3.311
  503    HA   LEU  35           HA       LEU  35 -11.535  -0.393  -1.540
  504    HB2  LEU  35           2HB      LEU  35 -11.883  -2.010  -3.588
  505    HB3  LEU  35           1HB      LEU  35 -13.126  -1.785  -2.373
  506    HG   LEU  35           HG       LEU  35 -13.398   0.105  -4.567
  507   HD11  LEU  35          1HD1      LEU  35 -13.366  -2.842  -5.153
  508   HD12  LEU  35          2HD1      LEU  35 -14.269  -1.684  -6.130
  509   HD13  LEU  35          3HD1      LEU  35 -12.516  -1.549  -5.997
  510   HD21  LEU  35          3HD2      LEU  35 -15.088  -0.382  -2.840
  511   HD22  LEU  35          1HD2      LEU  35 -15.689  -0.645  -4.477
  512   HD23  LEU  35          2HD2      LEU  35 -15.232  -2.021  -3.475
  513    H    LEU  36           H        LEU  36  -9.602  -1.352  -2.272
  514    HA   LEU  36           HA       LEU  36  -8.175   0.330  -4.217
  515    HB2  LEU  36           2HB      LEU  36  -7.172  -1.034  -1.718
  516    HB3  LEU  36           1HB      LEU  36  -6.136  -0.253  -2.891
  517    HG   LEU  36           HG       LEU  36  -6.320   1.338  -1.224
  518   HD11  LEU  36          1HD1      LEU  36  -8.324   1.881  -3.371
  519   HD12  LEU  36          2HD1      LEU  36  -8.043   3.051  -2.081
  520   HD13  LEU  36          3HD1      LEU  36  -6.716   2.568  -3.139
  521   HD21  LEU  36          3HD2      LEU  36  -9.042   1.764  -0.699
  522   HD22  LEU  36          1HD2      LEU  36  -8.787   0.018  -0.640
  523   HD23  LEU  36          2HD2      LEU  36  -7.821   1.087   0.379
  524    H    TYR  37           H        TYR  37  -6.904  -0.636  -5.716
  525    HA   TYR  37           HA       TYR  37  -7.024  -3.549  -5.985
  526    HB2  TYR  37           2HB      TYR  37  -6.663  -1.279  -7.769
  527    HB3  TYR  37           1HB      TYR  37  -5.446  -2.518  -8.034
  528    HD1  TYR  37           2HD      TYR  37  -6.889  -5.002  -7.627
  529    HD2  TYR  37           1HD      TYR  37  -8.161  -1.399  -9.487
  530    HE1  TYR  37           2HE      TYR  37  -8.475  -6.283  -8.999
  531    HE2  TYR  37           1HE      TYR  37  -9.751  -2.655 -10.859
  532    HH   TYR  37           HH       TYR  37  -9.764  -5.324 -11.698
  533    H    ALA  38           H        ALA  38  -5.201  -4.837  -6.006
  534    HA   ALA  38           HA       ALA  38  -2.577  -3.670  -5.728
  535    HB1  ALA  38           1HB      ALA  38  -3.195  -3.617  -3.419
  536    HB2  ALA  38           2HB      ALA  38  -3.788  -5.277  -3.485
  537    HB3  ALA  38           3HB      ALA  38  -2.064  -4.951  -3.645
  538    H    MET  39           H        MET  39  -3.125  -6.801  -4.403
  539    HA   MET  39           HA       MET  39  -1.664  -7.984  -6.604
  540    HB2  MET  39           2HB      MET  39  -1.650  -8.427  -3.909
  541    HB3  MET  39           1HB      MET  39  -2.658  -9.753  -4.474
  542    HG2  MET  39           2HG      MET  39  -0.924 -10.581  -5.877
  543    HG3  MET  39           1HG      MET  39   0.057  -9.143  -5.605
  544    HE1  MET  39           3HE      MET  39   0.993  -9.332  -1.942
  545    HE2  MET  39           1HE      MET  39  -0.030  -8.374  -3.014
  546    HE3  MET  39           2HE      MET  39  -0.761  -9.493  -1.865
  547    H    ASP  40           H        ASP  40  -3.936  -7.209  -7.696
  548    HA   ASP  40           HA       ASP  40  -5.398  -8.007  -9.240
  549    HB2  ASP  40           2HB      ASP  40  -3.752 -10.143  -8.898
  550    HB3  ASP  40           1HB      ASP  40  -5.302 -10.841  -8.442
  551    H    SER  41           H        SER  41  -5.801  -8.373  -5.942
  552    HA   SER  41           HA       SER  41  -8.523  -9.431  -6.221
  553    HB2  SER  41           2HB      SER  41  -7.785  -9.139  -3.484
  554    HB3  SER  41           1HB      SER  41  -8.009 -10.631  -4.403
  555    HG   SER  41           HG       SER  41  -5.807 -10.413  -5.089
  556    H    TYR  42           H        TYR  42 -10.108  -8.467  -4.622
  557    HA   TYR  42           HA       TYR  42  -9.949  -5.555  -4.769
  558    HB2  TYR  42           2HB      TYR  42 -12.185  -7.485  -4.176
  559    HB3  TYR  42           1HB      TYR  42 -12.345  -5.765  -3.854
  560    HD1  TYR  42           1HD      TYR  42 -11.118  -7.902  -6.673
  561    HD2  TYR  42           2HD      TYR  42 -13.491  -4.592  -5.460
  562    HE1  TYR  42           1HE      TYR  42 -11.788  -7.535  -9.006
  563    HE2  TYR  42           2HE      TYR  42 -14.168  -4.215  -7.793
  564    HH   TYR  42           HH       TYR  42 -13.130  -6.410 -10.377
  565    H    TRP  43           H        TRP  43  -9.204  -4.440  -3.107
  566    HA   TRP  43           HA       TRP  43  -9.519  -5.576  -0.403
  567    HB2  TRP  43           2HB      TRP  43  -7.308  -3.667  -1.120
  568    HB3  TRP  43           1HB      TRP  43  -7.413  -4.761   0.251
  569    HD1  TRP  43           HD       TRP  43  -6.911  -4.943  -3.589
  570    HE1  TRP  43           1HE      TRP  43  -5.414  -6.968  -4.093
  571    HE3  TRP  43           3HE      TRP  43  -6.431  -6.807   1.147
  572    HZ2  TRP  43           2HZ      TRP  43  -4.161  -9.056  -2.679
  573    HZ3  TRP  43           3HZ      TRP  43  -5.055  -8.817   1.483
  574    HH2  TRP  43           HH       TRP  43  -3.945  -9.917  -0.395
  575    H    HIS  44           H        HIS  44  -9.770  -4.025   1.309
  576    HA   HIS  44           HA       HIS  44 -10.366  -1.273   0.402
  577    HB2  HIS  44           2HB      HIS  44 -11.860  -1.081   2.445
  578    HB3  HIS  44           1HB      HIS  44 -12.467  -2.119   1.164
  579    HD1  HIS  44           1HD      HIS  44 -13.027  -2.238   4.458
  580    HD2  HIS  44           2HD      HIS  44 -10.839  -4.806   2.022
  581    HE1  HIS  44           1HE      HIS  44 -12.947  -4.523   5.625
  582    H    SER  45           H        SER  45 -10.449  -0.062   2.929
  583    HA   SER  45           HA       SER  45  -7.707   0.368   3.354
  584    HB2  SER  45           2HB      SER  45  -9.588   1.065   5.540
  585    HB3  SER  45           1HB      SER  45  -8.372   2.056   4.731
  586    HG   SER  45           HG       SER  45 -11.010   1.432   3.909
  587    H    ARG  46           H        ARG  46  -9.941  -1.865   4.839
  588    HA   ARG  46           HA       ARG  46  -8.098  -2.491   6.994
  589    HB2  ARG  46           2HB      ARG  46 -10.894  -2.702   6.617
  590    HB3  ARG  46           1HB      ARG  46 -10.282  -4.335   6.848
  591    HG2  ARG  46           2HG      ARG  46  -9.146  -2.426   8.722
  592    HG3  ARG  46           1HG      ARG  46 -10.903  -2.549   8.831
  593    HD2  ARG  46           2HD      ARG  46  -9.103  -4.960   8.808
  594    HD3  ARG  46           1HD      ARG  46  -9.562  -4.132  10.296
  595    HE   ARG  46           HE       ARG  46 -11.191  -5.885   8.708
  596   HH11  ARG  46          2HH1      ARG  46 -11.230  -3.229  11.001
  597   HH12  ARG  46          1HH1      ARG  46 -12.867  -3.532  11.515
  598   HH21  ARG  46          2HH2      ARG  46 -13.328  -6.312   9.418
  599   HH22  ARG  46          1HH2      ARG  46 -14.051  -5.287  10.629
  600    H    CYS  47           H        CYS  47  -8.901  -3.699   3.859
  601    HA   CYS  47           HA       CYS  47  -7.732  -6.312   4.356
  602    HB2  CYS  47           2HB      CYS  47  -9.329  -5.065   2.233
  603    HB3  CYS  47           1HB      CYS  47  -8.027  -6.076   1.622
  604    H    LEU  48           H        LEU  48  -7.100  -3.491   2.295
  605    HA   LEU  48           HA       LEU  48  -4.474  -4.408   1.586
  606    HB2  LEU  48           2HB      LEU  48  -6.339  -2.638   0.520
  607    HB3  LEU  48           1HB      LEU  48  -5.038  -1.604   1.066
  608    HG   LEU  48           HG       LEU  48  -5.197  -3.258  -1.289
  609   HD11  LEU  48          1HD1      LEU  48  -4.480  -0.795  -0.794
  610   HD12  LEU  48          2HD1      LEU  48  -2.886  -1.525  -0.603
  611   HD13  LEU  48          3HD1      LEU  48  -3.760  -1.700  -2.126
  612   HD21  LEU  48          3HD2      LEU  48  -3.208  -4.044   0.734
  613   HD22  LEU  48          1HD2      LEU  48  -3.854  -4.945  -0.637
  614   HD23  LEU  48          2HD2      LEU  48  -2.572  -3.760  -0.886
  615    H    LYS  49           H        LYS  49  -3.489  -4.570   3.636
  616    HA   LYS  49           HA       LYS  49  -2.336  -2.029   4.473
  617    HB2  LYS  49           2HB      LYS  49  -2.543  -3.129   6.913
  618    HB3  LYS  49           1HB      LYS  49  -3.755  -2.034   6.271
  619    HG2  LYS  49           2HG      LYS  49  -5.159  -3.668   6.928
  620    HG3  LYS  49           1HG      LYS  49  -4.734  -4.364   5.363
  621    HD2  LYS  49           2HD      LYS  49  -2.810  -5.505   6.657
  622    HD3  LYS  49           1HD      LYS  49  -3.752  -5.109   8.097
  623    HE2  LYS  49           2HE      LYS  49  -5.336  -6.653   7.640
  624    HE3  LYS  49           1HE      LYS  49  -5.265  -6.357   5.903
  625    HZ1  LYS  49           3HZ      LYS  49  -3.119  -7.600   5.915
  626    HZ2  LYS  49           1HZ      LYS  49  -4.480  -8.541   6.280
  627    HZ3  LYS  49           2HZ      LYS  49  -3.439  -8.045   7.520
  628    H    CYS  50           H        CYS  50  -0.539  -2.513   6.119
  629    HA   CYS  50           HA       CYS  50   1.207  -4.495   5.031
  630    HB2  CYS  50           2HB      CYS  50   2.037  -2.372   5.900
  631    HB3  CYS  50           1HB      CYS  50   1.392  -2.750   7.490
  632    H    SER  51           H        SER  51   1.541  -6.527   5.744
  633    HA   SER  51           HA       SER  51  -0.250  -7.598   7.730
  634    HB2  SER  51           2HB      SER  51   2.016  -9.182   6.570
  635    HB3  SER  51           1HB      SER  51   0.370  -9.693   6.953
  636    HG   SER  51           HG       SER  51   1.278  -8.165   4.742
  637    H    SER  52           H        SER  52   2.582  -5.957   7.970
  638    HA   SER  52           HA       SER  52   3.620  -7.582  10.173
  639    HB2  SER  52           2HB      SER  52   5.269  -5.308   9.410
  640    HB3  SER  52           1HB      SER  52   5.680  -7.025   9.478
  641    HG   SER  52           HG       SER  52   4.449  -5.595   7.352
  642    H    CYS  53           H        CYS  53   2.893  -4.142   9.424
  643    HA   CYS  53           HA       CYS  53   2.751  -3.730  12.337
  644    HB2  CYS  53           2HB      CYS  53   3.350  -1.412  12.001
  645    HB3  CYS  53           1HB      CYS  53   4.548  -2.443  11.230
  646    H    GLN  54           H        GLN  54   0.913  -3.939   9.582
  647    HA   GLN  54           HA       GLN  54  -1.283  -3.648   9.145
  648    HB2  GLN  54           2HB      GLN  54  -1.386  -3.043  12.100
  649    HB3  GLN  54           1HB      GLN  54  -2.813  -3.111  11.078
  650    HG2  GLN  54           2HG      GLN  54  -1.030  -5.449  10.955
  651    HG3  GLN  54           1HG      GLN  54  -1.873  -5.191  12.482
  652   HE21  GLN  54          1HE2      GLN  54  -4.194  -3.956  11.237
  653   HE22  GLN  54          2HE2      GLN  54  -5.069  -5.241  10.464
  654    H    ALA  55           H        ALA  55   0.676  -1.406   9.010
  655    HA   ALA  55           HA       ALA  55  -0.652   1.020   9.585
  656    HB1  ALA  55           1HB      ALA  55   1.577   0.287   7.712
  657    HB2  ALA  55           2HB      ALA  55   0.913   1.921   7.758
  658    HB3  ALA  55           3HB      ALA  55   1.646   1.226   9.204
  659    H    GLN  56           H        GLN  56  -1.752   2.449   8.172
  660    HA   GLN  56           HA       GLN  56  -3.669   1.194   6.544
  661    HB2  GLN  56           2HB      GLN  56  -3.032   3.908   7.440
  662    HB3  GLN  56           1HB      GLN  56  -3.790   3.843   5.852
  663    HG2  GLN  56           2HG      GLN  56  -4.857   2.757   8.437
  664    HG3  GLN  56           1HG      GLN  56  -5.502   4.074   7.463
  665   HE21  GLN  56          1HE2      GLN  56  -5.665   0.808   8.136
  666   HE22  GLN  56          2HE2      GLN  56  -6.609   0.303   6.768
  667    H    LEU  57           H        LEU  57  -3.078   0.205   4.742
  668    HA   LEU  57           HA       LEU  57  -1.346   1.608   2.839
  669    HB2  LEU  57           2HB      LEU  57  -1.859  -1.188   3.501
  670    HB3  LEU  57           1HB      LEU  57  -1.926  -0.884   1.778
  671    HG   LEU  57           HG       LEU  57   0.330   0.065   1.869
  672   HD11  LEU  57          1HD1      LEU  57   0.259  -0.772   4.753
  673   HD12  LEU  57          2HD1      LEU  57   1.700  -0.256   3.876
  674   HD13  LEU  57          3HD1      LEU  57   0.376   0.878   4.137
  675   HD21  LEU  57          3HD2      LEU  57   1.164  -1.956   1.483
  676   HD22  LEU  57          1HD2      LEU  57   0.893  -2.465   3.151
  677   HD23  LEU  57          2HD2      LEU  57  -0.411  -2.585   1.970
  678    H    GLY  58           H        GLY  58  -4.560   1.122   3.545
  679    HA2  GLY  58           1HA      GLY  58  -5.469   1.038   0.782
  680    HA3  GLY  58           2HA      GLY  58  -6.477   0.925   2.218
  681    H    ASP  59           H        ASP  59  -6.113   3.105   3.632
  682    HA   ASP  59           HA       ASP  59  -7.279   5.112   1.933
  683    HB2  ASP  59           2HB      ASP  59  -7.845   4.465   4.445
  684    HB3  ASP  59           1HB      ASP  59  -6.633   5.698   4.781
  685    H    ILE  60           H        ILE  60  -4.250   4.300   2.487
  686    HA   ILE  60           HA       ILE  60  -3.255   7.026   2.007
  687    HB   ILE  60           HB       ILE  60  -1.666   4.894   3.439
  688   HG12  ILE  60          2HG1      ILE  60  -3.724   5.656   4.727
  689   HG13  ILE  60          1HG1      ILE  60  -2.181   5.874   5.541
  690   HG21  ILE  60          1HG2      ILE  60  -0.016   6.294   2.876
  691   HG22  ILE  60          2HG2      ILE  60  -1.134   7.600   2.481
  692   HG23  ILE  60          3HG2      ILE  60  -0.655   7.327   4.155
  693   HD11  ILE  60          3HD1      ILE  60  -3.695   7.785   5.826
  694   HD12  ILE  60          1HD1      ILE  60  -2.197   8.232   5.009
  695   HD13  ILE  60          2HD1      ILE  60  -3.684   8.036   4.082
  696    H    GLY  61           H        GLY  61  -1.879   7.213   0.281
  697    HA2  GLY  61           1HA      GLY  61  -1.810   4.956  -1.526
  698    HA3  GLY  61           2HA      GLY  61  -1.235   6.583  -1.860
  699    H    THR  62           H        THR  62  -0.350   4.255   0.663
  700    HA   THR  62           HA       THR  62   2.444   4.790   0.275
  701    HB   THR  62           HB       THR  62   1.861   2.430   1.862
  702    HG1  THR  62           1HG      THR  62   0.155   3.136   2.892
  703   HG21  THR  62          3HG2      THR  62   3.834   4.181   1.840
  704   HG22  THR  62          1HG2      THR  62   3.360   3.365   3.329
  705   HG23  THR  62          2HG2      THR  62   2.810   5.012   3.013
  706    H    SER  63           H        SER  63   3.580   3.905  -1.297
  707    HA   SER  63           HA       SER  63   2.751   1.695  -2.842
  708    HB2  SER  63           2HB      SER  63   5.632   2.280  -2.858
  709    HB3  SER  63           1HB      SER  63   4.472   2.293  -4.186
  710    HG   SER  63           HG       SER  63   3.818   4.356  -3.568
  711    H    SER  64           H        SER  64   2.716  -0.347  -2.194
  712    HA   SER  64           HA       SER  64   4.405  -1.199   0.016
  713    HB2  SER  64           2HB      SER  64   2.777  -3.317  -0.992
  714    HB3  SER  64           1HB      SER  64   2.591  -2.424   0.521
  715    HG   SER  64           HG       SER  64   1.383  -0.861  -0.637
  716    H    TYR  65           H        TYR  65   5.396  -3.424  -0.191
  717    HA   TYR  65           HA       TYR  65   6.310  -3.946  -2.933
  718    HB2  TYR  65           2HB      TYR  65   8.055  -3.944  -0.463
  719    HB3  TYR  65           1HB      TYR  65   8.568  -4.429  -2.075
  720    HD1  TYR  65           2HD      TYR  65   8.335  -2.615  -3.938
  721    HD2  TYR  65           1HD      TYR  65   8.342  -1.759   0.224
  722    HE1  TYR  65           2HE      TYR  65   8.990  -0.295  -4.422
  723    HE2  TYR  65           1HE      TYR  65   8.994   0.559  -0.247
  724    HH   TYR  65           HH       TYR  65   9.500   1.692  -3.588
  725    H    THR  66           H        THR  66   6.808  -6.106  -3.387
  726    HA   THR  66           HA       THR  66   5.868  -8.031  -1.364
  727    HB   THR  66           HB       THR  66   4.249  -7.654  -3.259
  728    HG1  THR  66           1HG      THR  66   3.883  -9.907  -3.533
  729   HG21  THR  66          3HG2      THR  66   5.138  -7.503  -5.307
  730   HG22  THR  66          1HG2      THR  66   5.230  -9.263  -5.266
  731   HG23  THR  66          2HG2      THR  66   6.632  -8.297  -4.809
  732    H    LYS  67           H        LYS  67   6.525 -10.323  -2.098
  733    HA   LYS  67           HA       LYS  67   8.884 -10.672  -3.635
  734    HB2  LYS  67           2HB      LYS  67   9.524  -9.704  -1.204
  735    HB3  LYS  67           1HB      LYS  67   9.414 -11.416  -0.807
  736    HG2  LYS  67           2HG      LYS  67  11.044 -11.925  -2.558
  737    HG3  LYS  67           1HG      LYS  67  11.164 -10.204  -2.935
  738    HD2  LYS  67           2HD      LYS  67  11.777  -9.910  -0.457
  739    HD3  LYS  67           1HD      LYS  67  12.042 -11.654  -0.457
  740    HE2  LYS  67           2HE      LYS  67  14.148 -10.946  -0.964
  741    HE3  LYS  67           1HE      LYS  67  13.486 -11.074  -2.592
  742    HZ1  LYS  67           3HZ      LYS  67  14.173  -8.969  -2.804
  743    HZ2  LYS  67           1HZ      LYS  67  14.344  -8.742  -1.129
  744    HZ3  LYS  67           2HZ      LYS  67  12.825  -8.552  -1.862
  745    H    SER  68           H        SER  68   7.332 -12.052  -0.754
  746    HA   SER  68           HA       SER  68   7.039 -14.595  -2.190
  747    HB2  SER  68           2HB      SER  68   6.481 -14.543   0.707
  748    HB3  SER  68           1HB      SER  68   7.447 -15.678  -0.241
  749    HG   SER  68           HG       SER  68   9.139 -14.179  -0.241
  750    H    GLY  69           H        GLY  69   5.279 -12.320  -2.607
  751    HA2  GLY  69           1HA      GLY  69   3.014 -12.019  -2.944
  752    HA3  GLY  69           2HA      GLY  69   2.765 -13.643  -2.316
  753    H    MET  70           H        MET  70   4.442 -11.198  -0.493
  754    HA   MET  70           HA       MET  70   2.233 -11.219   1.445
  755    HB2  MET  70           2HB      MET  70   4.761 -12.075   1.888
  756    HB3  MET  70           1HB      MET  70   4.937 -10.381   2.324
  757    HG2  MET  70           2HG      MET  70   4.043 -10.786   4.300
  758    HG3  MET  70           1HG      MET  70   2.564 -11.359   3.533
  759    HE1  MET  70           3HE      MET  70   5.772 -13.637   5.667
  760    HE2  MET  70           1HE      MET  70   6.368 -13.166   4.075
  761    HE3  MET  70           2HE      MET  70   5.755 -11.940   5.183
  762    H    ILE  71           H        ILE  71   1.400  -9.319   2.134
  763    HA   ILE  71           HA       ILE  71   2.266  -6.908   0.750
  764    HB   ILE  71           HB       ILE  71   0.025  -6.897   2.727
  765   HG12  ILE  71          2HG1      ILE  71  -0.881  -7.547   0.043
  766   HG13  ILE  71          1HG1      ILE  71   0.140  -8.819   0.708
  767   HG21  ILE  71          1HG2      ILE  71   0.859  -5.370   0.327
  768   HG22  ILE  71          2HG2      ILE  71  -0.870  -5.499   0.660
  769   HG23  ILE  71          3HG2      ILE  71   0.212  -4.802   1.867
  770   HD11  ILE  71          3HD1      ILE  71  -2.103  -7.688   2.322
  771   HD12  ILE  71          1HD1      ILE  71  -2.405  -8.915   1.090
  772   HD13  ILE  71          2HD1      ILE  71  -1.322  -9.266   2.436
  773    H    LEU  72           H        LEU  72   3.809  -5.714   1.636
  774    HA   LEU  72           HA       LEU  72   3.700  -5.173   4.521
  775    HB2  LEU  72           2HB      LEU  72   6.353  -5.425   3.155
  776    HB3  LEU  72           1HB      LEU  72   5.966  -5.564   4.860
  777    HG   LEU  72           HG       LEU  72   4.637  -7.675   3.469
  778   HD11  LEU  72          1HD1      LEU  72   6.941  -6.926   2.101
  779   HD12  LEU  72          2HD1      LEU  72   7.424  -8.308   3.089
  780   HD13  LEU  72          3HD1      LEU  72   6.071  -8.456   1.966
  781   HD21  LEU  72          3HD2      LEU  72   6.185  -7.228   5.798
  782   HD22  LEU  72          1HD2      LEU  72   5.194  -8.628   5.389
  783   HD23  LEU  72          2HD2      LEU  72   6.896  -8.587   4.929
  784    H    CYS  73           H        CYS  73   4.615  -3.128   5.126
  785    HA   CYS  73           HA       CYS  73   4.129  -1.117   3.150
  786    HB2  CYS  73           2HB      CYS  73   4.519   0.484   4.931
  787    HB3  CYS  73           1HB      CYS  73   3.493  -0.821   5.521
  788    H    ARG  74           H        ARG  74   5.701   0.797   3.111
  789    HA   ARG  74           HA       ARG  74   8.011   0.026   1.722
  790    HB2  ARG  74           2HB      ARG  74   6.746   2.523   2.577
  791    HB3  ARG  74           1HB      ARG  74   8.499   2.625   2.514
  792    HG2  ARG  74           2HG      ARG  74   8.000   1.423   0.155
  793    HG3  ARG  74           1HG      ARG  74   6.536   2.388   0.343
  794    HD2  ARG  74           2HD      ARG  74   8.570   3.435  -0.851
  795    HD3  ARG  74           1HD      ARG  74   7.701   4.392   0.348
  796    HE   ARG  74           HE       ARG  74   9.493   4.012   1.892
  797   HH11  ARG  74          2HH1      ARG  74  10.134   2.860  -1.363
  798   HH12  ARG  74          1HH1      ARG  74  11.857   2.940  -1.182
  799   HH21  ARG  74          2HH2      ARG  74  11.771   4.076   2.141
  800   HH22  ARG  74          1HH2      ARG  74  12.794   3.636   0.796
  801    H    ASN  75           H        ASN  75   7.454   0.858   5.062
  802    HA   ASN  75           HA       ASN  75  10.263   1.121   5.679
  803    HB2  ASN  75           2HB      ASN  75   8.648   2.531   6.847
  804    HB3  ASN  75           1HB      ASN  75   7.812   1.109   7.462
  805   HD21  ASN  75          1HD2      ASN  75   8.326   0.491   9.439
  806   HD22  ASN  75          2HD2      ASN  75   9.788   0.881  10.284
  807    H    ASP  76           H        ASP  76   7.778  -1.323   5.928
  808    HA   ASP  76           HA       ASP  76   9.268  -2.916   7.815
  809    HB2  ASP  76           2HB      ASP  76   6.577  -2.887   6.755
  810    HB3  ASP  76           1HB      ASP  76   7.245  -4.517   6.755
  811    H    TYR  77           H        TYR  77   8.635  -2.964   4.354
  812    HA   TYR  77           HA       TYR  77   9.310  -5.598   3.802
  813    HB2  TYR  77           2HB      TYR  77   8.287  -4.106   2.153
  814    HB3  TYR  77           1HB      TYR  77   9.783  -3.180   2.052
  815    HD1  TYR  77           1HD      TYR  77   8.677  -6.745   1.780
  816    HD2  TYR  77           2HD      TYR  77  11.165  -3.638   0.267
  817    HE1  TYR  77           1HE      TYR  77   9.493  -8.258   0.025
  818    HE2  TYR  77           2HE      TYR  77  11.993  -5.148  -1.488
  819    HH   TYR  77           HH       TYR  77  10.516  -7.834  -2.429
  820    H    ILE  78           H        ILE  78  11.432  -2.794   4.100
  821    HA   ILE  78           HA       ILE  78  13.761  -4.087   3.121
  822    HB   ILE  78           HB       ILE  78  13.714  -1.723   4.993
  823   HG12  ILE  78          2HG1      ILE  78  13.576  -1.621   1.976
  824   HG13  ILE  78          1HG1      ILE  78  12.151  -1.503   3.003
  825   HG21  ILE  78          1HG2      ILE  78  15.640  -2.009   2.755
  826   HG22  ILE  78          2HG2      ILE  78  15.858  -1.301   4.356
  827   HG23  ILE  78          3HG2      ILE  78  15.859  -3.053   4.157
  828   HD11  ILE  78          3HD1      ILE  78  12.842   0.553   3.896
  829   HD12  ILE  78          1HD1      ILE  78  14.483   0.362   3.276
  830   HD13  ILE  78          2HD1      ILE  78  13.147   0.660   2.161
  831    H    ARG  79           H        ARG  79  12.367  -3.723   6.325
  832    HA   ARG  79           HA       ARG  79  14.644  -4.899   7.649
  833    HB2  ARG  79           2HB      ARG  79  12.554  -3.308   8.481
  834    HB3  ARG  79           1HB      ARG  79  12.109  -4.883   9.124
  835    HG2  ARG  79           2HG      ARG  79  14.903  -4.009   9.549
  836    HG3  ARG  79           1HG      ARG  79  13.647  -3.158  10.449
  837    HD2  ARG  79           2HD      ARG  79  14.151  -4.871  11.900
  838    HD3  ARG  79           1HD      ARG  79  12.811  -5.574  10.997
  839    HE   ARG  79           HE       ARG  79  14.956  -6.387   9.584
  840   HH11  ARG  79          2HH1      ARG  79  14.184  -6.534  12.999
  841   HH12  ARG  79          1HH1      ARG  79  15.098  -7.996  13.264
  842   HH21  ARG  79          2HH2      ARG  79  16.165  -8.272   9.918
  843   HH22  ARG  79          1HH2      ARG  79  16.242  -8.979  11.507
  844    H    LEU  80           H        LEU  80  11.464  -5.913   6.572
  845    HA   LEU  80           HA       LEU  80  11.428  -8.437   7.843
  846    HB2  LEU  80           2HB      LEU  80   9.703  -6.900   6.235
  847    HB3  LEU  80           1HB      LEU  80   9.921  -8.416   5.381
  848    HG   LEU  80           HG       LEU  80   7.953  -8.515   6.800
  849   HD11  LEU  80          1HD1      LEU  80   9.932 -10.399   6.687
  850   HD12  LEU  80          2HD1      LEU  80   9.655 -10.242   8.423
  851   HD13  LEU  80          3HD1      LEU  80   8.316 -10.649   7.349
  852   HD21  LEU  80          3HD2      LEU  80   7.843  -7.722   8.879
  853   HD22  LEU  80          1HD2      LEU  80   9.347  -8.514   9.354
  854   HD23  LEU  80          2HD2      LEU  80   9.392  -6.950   8.538
  855    H    PHE  81           H        PHE  81  12.026  -7.597   4.425
  856    HA   PHE  81           HA       PHE  81  13.338 -10.220   4.130
  857    HB2  PHE  81           2HB      PHE  81  11.827  -8.554   2.112
  858    HB3  PHE  81           1HB      PHE  81  12.810  -9.946   1.673
  859    HD1  PHE  81           2HD      PHE  81  12.102 -12.192   2.213
  860    HD2  PHE  81           1HD      PHE  81   9.729  -8.825   3.281
  861    HE1  PHE  81           2HE      PHE  81  10.190 -13.683   2.647
  862    HE2  PHE  81           1HE      PHE  81   7.811 -10.309   3.715
  863    HZ   PHE  81           HZ       PHE  81   8.045 -12.744   3.399
  864    H    GLY  82           H        GLY  82  13.373  -7.055   2.481
  865    HA2  GLY  82           1HA      GLY  82  15.148  -5.785   1.745
  866    HA3  GLY  82           2HA      GLY  82  16.202  -6.754   2.770
  Start of MODEL   14
    1    H    SER 641           1H       SER 641  31.805  -4.928  19.676
    2    HA   SER 641           HA       SER 641  32.542  -4.663  21.702
    3    HB2  SER 641           2HB      SER 641  35.200  -3.592  20.920
    4    HB3  SER 641           1HB      SER 641  34.793  -4.921  22.008
    5    HG   SER 641           HG       SER 641  35.428  -6.086  20.361
    6    H    LEU 642           H        LEU 642  32.664  -3.163  23.358
    7    HA   LEU 642           HA       LEU 642  32.598  -1.177  24.435
    8    HB2  LEU 642           2HB      LEU 642  34.155  -0.444  22.016
    9    HB3  LEU 642           1HB      LEU 642  33.479   0.868  22.961
   10    HG   LEU 642           HG       LEU 642  34.841  -1.085  24.628
   11   HD11  LEU 642          1HD1      LEU 642  36.937  -1.111  23.783
   12   HD12  LEU 642          2HD1      LEU 642  36.066  -0.950  22.258
   13   HD13  LEU 642          3HD1      LEU 642  36.770   0.474  23.022
   14   HD21  LEU 642          3HD2      LEU 642  34.216   1.071  25.454
   15   HD22  LEU 642          1HD2      LEU 642  35.976   0.987  25.403
   16   HD23  LEU 642          2HD2      LEU 642  35.097   1.878  24.159
   17    H    GLN 643           H        GLN 643  31.959  -0.095  21.091
   18    HA   GLN 643           HA       GLN 643  29.676   1.405  22.008
   19    HB2  GLN 643           2HB      GLN 643  31.398   1.467  19.751
   20    HB3  GLN 643           1HB      GLN 643  29.759   1.233  19.156
   21    HG2  GLN 643           2HG      GLN 643  30.719   3.460  20.942
   22    HG3  GLN 643           1HG      GLN 643  30.288   3.582  19.237
   23   HE21  GLN 643          1HE2      GLN 643  29.226   4.284  22.200
   24   HE22  GLN 643          2HE2      GLN 643  27.516   4.206  21.947
   25    H    ASN 644           H        ASN 644  28.077   0.102  22.684
   26    HA   ASN 644           HA       ASN 644  27.308  -2.249  21.213
   27    HB2  ASN 644           2HB      ASN 644  27.120  -1.555  23.842
   28    HB3  ASN 644           1HB      ASN 644  25.472  -1.252  23.299
   29   HD21  ASN 644          1HD2      ASN 644  27.639  -3.553  24.370
   30   HD22  ASN 644          2HD2      ASN 644  26.733  -4.978  23.982
   31    H    ASN 645           H        ASN 645  26.896  -1.006  19.216
   32    HA   ASN 645           HA       ASN 645  24.057  -0.585  18.949
   33    HB2  ASN 645           2HB      ASN 645  23.992   1.649  18.709
   34    HB3  ASN 645           1HB      ASN 645  25.602   1.679  19.411
   35   HD21  ASN 645          1HD2      ASN 645  27.375   1.995  18.087
   36   HD22  ASN 645          2HD2      ASN 645  27.228   2.565  16.459
   37    H    GLN 646           H        GLN 646  23.347  -0.772  16.777
   38    HA   GLN 646           HA       GLN 646  25.369  -2.073  15.076
   39    HB2  GLN 646           2HB      GLN 646  22.371  -2.391  14.904
   40    HB3  GLN 646           1HB      GLN 646  23.596  -3.374  14.116
   41    HG2  GLN 646           2HG      GLN 646  23.921  -3.343  16.990
   42    HG3  GLN 646           1HG      GLN 646  22.323  -3.909  16.506
   43   HE21  GLN 646          1HE2      GLN 646  22.120  -5.951  15.882
   44   HE22  GLN 646          2HE2      GLN 646  23.430  -7.027  15.520
   45    H    ASP 647           H        ASP 647  22.370  -0.172  14.765
   46    HA   ASP 647           HA       ASP 647  23.234   0.698  12.111
   47    HB2  ASP 647           2HB      ASP 647  20.997  -0.008  12.026
   48    HB3  ASP 647           1HB      ASP 647  20.599   0.749  13.564
   49    H    VAL 648           H        VAL 648  24.346   2.492  11.935
   50    HA   VAL 648           HA       VAL 648  24.147   4.515  14.057
   51    HB   VAL 648           HB       VAL 648  26.262   5.420  12.842
   52   HG11  VAL 648          1HG1      VAL 648  26.622   4.678  14.990
   53   HG12  VAL 648          2HG1      VAL 648  26.064   3.042  14.631
   54   HG13  VAL 648          3HG1      VAL 648  27.642   3.579  14.061
   55   HG21  VAL 648          3HG2      VAL 648  27.600   3.559  11.823
   56   HG22  VAL 648          1HG2      VAL 648  26.120   2.602  11.790
   57   HG23  VAL 648          2HG2      VAL 648  26.223   4.097  10.861
   58    H    SER 649           H        SER 649  24.435   6.801  13.317
   59    HA   SER 649           HA       SER 649  22.637   7.379  11.142
   60    HB2  SER 649           2HB      SER 649  23.673   9.791  11.939
   61    HB3  SER 649           1HB      SER 649  22.257   9.022  12.658
   62    HG   SER 649           HG       SER 649  24.616   9.576  13.790
   63    H    PHE 650           H        PHE 650  23.217   8.144   9.124
   64    HA   PHE 650           HA       PHE 650  26.095   8.522   8.659
   65    HB2  PHE 650           2HB      PHE 650  24.257   6.596   7.403
   66    HB3  PHE 650           1HB      PHE 650  25.276   7.490   6.278
   67    HD1  PHE 650           1HD      PHE 650  27.707   7.822   7.973
   68    HD2  PHE 650           2HD      PHE 650  25.189   4.452   7.318
   69    HE1  PHE 650           1HE      PHE 650  29.586   6.323   8.486
   70    HE2  PHE 650           2HE      PHE 650  27.067   2.948   7.825
   71    HZ   PHE 650           HZ       PHE 650  29.267   3.882   8.410
   72    H    GLU 651           H        GLU 651  25.606  10.765   8.841
   73    HA   GLU 651           HA       GLU 651  23.842  12.093   7.049
   74    HB2  GLU 651           2HB      GLU 651  25.118  14.143   7.776
   75    HB3  GLU 651           1HB      GLU 651  24.419  13.200   9.083
   76    HG2  GLU 651           2HG      GLU 651  27.192  12.529   8.349
   77    HG3  GLU 651           1HG      GLU 651  26.940  14.113   9.079
   78    H    ASN 652           H        ASN 652  26.917  10.725   6.651
   79    HA   ASN 652           HA       ASN 652  27.965  12.478   4.682
   80    HB2  ASN 652           2HB      ASN 652  28.634   9.745   5.664
   81    HB3  ASN 652           1HB      ASN 652  29.276  10.237   4.101
   82   HD21  ASN 652          1HD2      ASN 652  31.387  10.388   4.690
   83   HD22  ASN 652          2HD2      ASN 652  31.986  11.550   5.836
   84    H    ILE 653           H        ILE 653  26.274   9.354   4.459
   85    HA   ILE 653           HA       ILE 653  25.929   9.810   1.584
   86    HB   ILE 653           HB       ILE 653  24.788   7.338   2.175
   87   HG12  ILE 653          2HG1      ILE 653  27.512   7.201   3.378
   88   HG13  ILE 653          1HG1      ILE 653  26.192   7.770   4.395
   89   HG21  ILE 653          1HG2      ILE 653  26.001   7.817   0.174
   90   HG22  ILE 653          2HG2      ILE 653  27.496   8.067   1.077
   91   HG23  ILE 653          3HG2      ILE 653  26.783   6.457   0.980
   92   HD11  ILE 653          3HD1      ILE 653  25.441   5.387   2.965
   93   HD12  ILE 653          1HD1      ILE 653  26.915   5.137   3.904
   94   HD13  ILE 653          2HD1      ILE 653  25.448   5.708   4.698
   95    H    GLN 654           H        GLN 654  24.211  11.116   1.318
   96    HA   GLN 654           HA       GLN 654  21.654  10.163   2.417
   97    HB2  GLN 654           2HB      GLN 654  22.523  13.013   1.922
   98    HB3  GLN 654           1HB      GLN 654  20.889  12.533   2.350
   99    HG2  GLN 654           2HG      GLN 654  23.257  11.908   4.082
  100    HG3  GLN 654           1HG      GLN 654  22.345  13.413   4.213
  101   HE21  GLN 654          1HE2      GLN 654  22.644  10.359   5.391
  102   HE22  GLN 654          2HE2      GLN 654  21.068  10.167   6.079
  103    H    TRP 655           H        TRP 655  20.576   9.252   0.813
  104    HA   TRP 655           HA       TRP 655  20.818  10.380  -1.881
  105    HB2  TRP 655           2HB      TRP 655  19.967   7.715  -0.814
  106    HB3  TRP 655           1HB      TRP 655  19.418   8.229  -2.408
  107    HD1  TRP 655           HD       TRP 655  22.110   6.341  -0.887
  108    HE1  TRP 655           1HE      TRP 655  24.159   6.170  -2.445
  109    HE3  TRP 655           3HE      TRP 655  20.870   9.994  -4.247
  110    HZ2  TRP 655           2HZ      TRP 655  25.112   7.426  -4.782
  111    HZ3  TRP 655           3HZ      TRP 655  22.408  10.449  -6.114
  112    HH2  TRP 655           HH       TRP 655  24.486   9.190  -6.372
  113    H    SER 656           H        SER 656  19.471  12.029  -2.123
  114    HA   SER 656           HA       SER 656  16.863  12.055  -0.855
  115    HB2  SER 656           2HB      SER 656  17.610  14.183  -2.784
  116    HB3  SER 656           1HB      SER 656  16.917  14.319  -1.166
  117    HG   SER 656           HG       SER 656  19.627  13.809  -1.864
  118    H    ILE 657           H        ILE 657  16.702   9.989  -2.394
  119    HA   ILE 657           HA       ILE 657  14.944  10.829  -4.585
  120    HB   ILE 657           HB       ILE 657  15.841   8.614  -5.727
  121   HG12  ILE 657          2HG1      ILE 657  18.542   9.217  -5.172
  122   HG13  ILE 657          1HG1      ILE 657  17.743   9.068  -3.610
  123   HG21  ILE 657          1HG2      ILE 657  16.278  11.375  -6.073
  124   HG22  ILE 657          2HG2      ILE 657  17.823  10.571  -6.355
  125   HG23  ILE 657          3HG2      ILE 657  16.399  10.094  -7.278
  126   HD11  ILE 657          3HD1      ILE 657  16.767   6.896  -4.889
  127   HD12  ILE 657          1HD1      ILE 657  18.368   7.028  -5.617
  128   HD13  ILE 657          2HD1      ILE 657  18.204   6.895  -3.867
  129    H    ASP 658           H        ASP 658  14.331   8.152  -5.395
  130    HA   ASP 658           HA       ASP 658  12.848   7.276  -3.027
  131    HB2  ASP 658           2HB      ASP 658  11.773   7.618  -5.361
  132    HB3  ASP 658           1HB      ASP 658  12.542   6.086  -5.776
  133    HA   PRO 659           HA       PRO 659  16.082   4.183  -2.592
  134    HB2  PRO 659           2HB      PRO 659  15.199   3.200  -0.222
  135    HB3  PRO 659           1HB      PRO 659  16.124   4.699  -0.356
  136    HG2  PRO 659           2HG      PRO 659  13.170   4.315  -0.062
  137    HG3  PRO 659           1HG      PRO 659  14.231   5.496   0.732
  138    HD2  PRO 659           2HD      PRO 659  12.667   6.119  -1.399
  139    HD3  PRO 659           1HD      PRO 659  14.229   6.904  -1.091
  140    H    GLY 660           H        GLY 660  12.700   3.804  -2.886
  141    HA2  GLY 660           1HA      GLY 660  12.899   0.872  -2.998
  142    HA3  GLY 660           2HA      GLY 660  11.412   1.794  -2.837
  143    H    ALA 661           H        ALA 661  13.385   3.285  -5.058
  144    HA   ALA 661           HA       ALA 661  11.742   2.571  -7.277
  145    HB1  ALA 661           1HB      ALA 661  13.119   4.042  -8.569
  146    HB2  ALA 661           2HB      ALA 661  12.864   4.781  -6.989
  147    HB3  ALA 661           3HB      ALA 661  14.397   3.993  -7.355
  148    H    ASP 662           H        ASP 662  14.508   1.191  -5.858
  149    HA   ASP 662           HA       ASP 662  15.262  -0.269  -8.267
  150    HB2  ASP 662           2HB      ASP 662  16.827   0.694  -6.332
  151    HB3  ASP 662           1HB      ASP 662  16.502  -0.891  -5.634
  152    H    LEU 663           H        LEU 663  12.748  -0.522  -6.500
  153    HA   LEU 663           HA       LEU 663  12.781  -3.466  -6.469
  154    HB2  LEU 663           2HB      LEU 663  11.229  -1.661  -4.601
  155    HB3  LEU 663           1HB      LEU 663  11.185  -3.413  -4.607
  156    HG   LEU 663           HG       LEU 663  13.774  -1.976  -4.132
  157   HD11  LEU 663          1HD1      LEU 663  11.434  -2.070  -2.359
  158   HD12  LEU 663          2HD1      LEU 663  12.952  -2.593  -1.629
  159   HD13  LEU 663          3HD1      LEU 663  12.829  -0.990  -2.350
  160   HD21  LEU 663          3HD2      LEU 663  13.397  -4.534  -4.537
  161   HD22  LEU 663          1HD2      LEU 663  14.507  -3.984  -3.280
  162   HD23  LEU 663          2HD2      LEU 663  12.882  -4.519  -2.850
  163    H    SER 664           H        SER 664  12.214  -2.317  -8.751
  164    HA   SER 664           HA       SER 664   9.786  -1.128  -9.264
  165    HB2  SER 664           2HB      SER 664  10.461  -2.812 -11.459
  166    HB3  SER 664           1HB      SER 664  10.772  -1.084 -11.269
  167    HG   SER 664           HG       SER 664  12.784  -1.807 -11.343
  168    H    GLN 665           H        GLN 665  10.524  -4.605  -9.531
  169    HA   GLN 665           HA       GLN 665   7.856  -5.297 -10.276
  170    HB2  GLN 665           2HB      GLN 665   9.910  -7.201  -9.167
  171    HB3  GLN 665           1HB      GLN 665   8.604  -7.544 -10.292
  172    HG2  GLN 665           2HG      GLN 665  10.731  -5.622 -11.093
  173    HG3  GLN 665           1HG      GLN 665  11.071  -7.352 -11.120
  174   HE21  GLN 665          1HE2      GLN 665   8.950  -8.552 -12.047
  175   HE22  GLN 665          2HE2      GLN 665   8.477  -7.952 -13.607
  176    H    TYR 666           H        TYR 666   9.163  -4.450  -7.324
  177    HA   TYR 666           HA       TYR 666   7.638  -6.385  -5.776
  178    HB2  TYR 666           2HB      TYR 666   9.612  -4.272  -4.906
  179    HB3  TYR 666           1HB      TYR 666   8.808  -5.397  -3.819
  180    HD1  TYR 666           2HD      TYR 666  11.250  -5.131  -6.584
  181    HD2  TYR 666           1HD      TYR 666   9.572  -7.650  -3.590
  182    HE1  TYR 666           2HE      TYR 666  13.040  -6.770  -6.969
  183    HE2  TYR 666           1HE      TYR 666  11.364  -9.293  -3.965
  184    HH   TYR 666           HH       TYR 666  14.173  -8.590  -5.668
  185    H    LYS 667           H        LYS 667   7.399  -3.103  -6.819
  186    HA   LYS 667           HA       LYS 667   5.564  -2.386  -4.684
  187    HB2  LYS 667           2HB      LYS 667   5.378  -0.396  -6.617
  188    HB3  LYS 667           1HB      LYS 667   6.318  -0.339  -5.138
  189    HG2  LYS 667           2HG      LYS 667   8.178  -1.443  -6.522
  190    HG3  LYS 667           1HG      LYS 667   7.226  -0.950  -7.924
  191    HD2  LYS 667           2HD      LYS 667   7.230   1.385  -6.959
  192    HD3  LYS 667           1HD      LYS 667   8.423   0.811  -5.792
  193    HE2  LYS 667           2HE      LYS 667   9.936   1.428  -7.320
  194    HE3  LYS 667           1HE      LYS 667   9.478  -0.053  -8.156
  195    HZ1  LYS 667           3HZ      LYS 667   9.044   1.310  -9.849
  196    HZ2  LYS 667           1HZ      LYS 667   8.982   2.697  -8.874
  197    HZ3  LYS 667           2HZ      LYS 667   7.617   1.692  -9.022
  198    H    MET 668           H        MET 668   3.462  -2.590  -4.758
  199    HA   MET 668           HA       MET 668   2.180  -3.375  -7.264
  200    HB2  MET 668           2HB      MET 668   0.242  -3.939  -5.862
  201    HB3  MET 668           1HB      MET 668   1.697  -4.747  -5.300
  202    HG2  MET 668           2HG      MET 668   1.903  -2.796  -3.644
  203    HG3  MET 668           1HG      MET 668   0.223  -2.457  -4.052
  204    HE1  MET 668           3HE      MET 668   1.964  -5.948  -1.726
  205    HE2  MET 668           1HE      MET 668   1.887  -6.259  -3.460
  206    HE3  MET 668           2HE      MET 668   2.787  -4.868  -2.854
  207    H    ASP 669           H        ASP 669   0.614  -2.163  -8.260
  208    HA   ASP 669           HA       ASP 669   0.528   0.637  -7.529
  209    HB2  ASP 669           2HB      ASP 669   0.743   0.158  -9.885
  210    HB3  ASP 669           1HB      ASP 669  -0.672  -0.887  -9.851
  211    H    VAL 670           H        VAL 670  -0.902   1.389  -6.142
  212    HA   VAL 670           HA       VAL 670  -3.243  -0.168  -5.455
  213    HB   VAL 670           HB       VAL 670  -2.509   2.556  -4.374
  214   HG11  VAL 670          1HG1      VAL 670  -3.750   1.732  -2.382
  215   HG12  VAL 670          2HG1      VAL 670  -4.748   1.896  -3.827
  216   HG13  VAL 670          3HG1      VAL 670  -4.204   0.302  -3.308
  217   HG21  VAL 670          3HG2      VAL 670  -1.487  -0.157  -3.588
  218   HG22  VAL 670          1HG2      VAL 670  -0.571   1.306  -3.952
  219   HG23  VAL 670          2HG2      VAL 670  -1.505   1.201  -2.460
  220    H    THR 671           H        THR 671  -4.583  -0.060  -7.210
  221    HA   THR 671           HA       THR 671  -5.419   2.522  -8.241
  222    HB   THR 671           HB       THR 671  -6.898   0.090  -9.066
  223    HG1  THR 671           1HG      THR 671  -4.111   0.440  -9.600
  224   HG21  THR 671          3HG2      THR 671  -6.555   2.638 -10.035
  225   HG22  THR 671          1HG2      THR 671  -7.189   1.271 -10.953
  226   HG23  THR 671          2HG2      THR 671  -5.479   1.688 -11.060
  227    H    VAL 672           H        VAL 672  -6.696   3.604  -6.870
  228    HA   VAL 672           HA       VAL 672  -8.657   2.216  -5.247
  229    HB   VAL 672           HB       VAL 672  -8.541   5.201  -5.396
  230   HG11  VAL 672          1HG1      VAL 672  -8.607   3.772  -2.831
  231   HG12  VAL 672          2HG1      VAL 672  -9.580   5.127  -3.404
  232   HG13  VAL 672          3HG1      VAL 672  -9.985   3.481  -3.892
  233   HG21  VAL 672          3HG2      VAL 672  -6.723   5.162  -3.683
  234   HG22  VAL 672          1HG2      VAL 672  -6.487   3.452  -4.046
  235   HG23  VAL 672          2HG2      VAL 672  -6.205   4.665  -5.296
  236    H    ILE 673           H        ILE 673 -10.711   1.920  -5.789
  237    HA   ILE 673           HA       ILE 673 -11.619   2.952  -8.343
  238    HB   ILE 673           HB       ILE 673 -12.713   0.900  -6.432
  239   HG12  ILE 673          2HG1      ILE 673 -12.663  -0.250  -8.875
  240   HG13  ILE 673          1HG1      ILE 673 -11.382   0.940  -9.082
  241   HG21  ILE 673          1HG2      ILE 673 -14.115   1.750  -8.953
  242   HG22  ILE 673          2HG2      ILE 673 -14.682   0.628  -7.715
  243   HG23  ILE 673          3HG2      ILE 673 -14.559   2.350  -7.354
  244   HD11  ILE 673          3HD1      ILE 673 -10.034  -0.046  -7.504
  245   HD12  ILE 673          1HD1      ILE 673 -11.383  -0.836  -6.685
  246   HD13  ILE 673          2HD1      ILE 673 -10.817  -1.442  -8.242
  247    H    ASP 674           H        ASP 674 -12.830   4.656  -8.595
  248    HA   ASP 674           HA       ASP 674 -13.847   6.139  -6.346
  249    HB2  ASP 674           2HB      ASP 674 -12.962   7.443  -8.126
  250    HB3  ASP 674           1HB      ASP 674 -13.869   6.547  -9.337
  251    H    THR 675           H        THR 675 -15.516   5.109  -5.370
  252    HA   THR 675           HA       THR 675 -17.500   3.625  -6.719
  253    HB   THR 675           HB       THR 675 -18.227   4.712  -4.084
  254    HG1  THR 675           1HG      THR 675 -16.537   3.293  -3.129
  255   HG21  THR 675          3HG2      THR 675 -18.790   2.462  -5.621
  256   HG22  THR 675          1HG2      THR 675 -19.278   2.742  -3.948
  257   HG23  THR 675          2HG2      THR 675 -17.792   1.855  -4.299
  258    H    LYS 676           H        LYS 676 -19.066   4.356  -7.928
  259    HA   LYS 676           HA       LYS 676 -19.965   7.092  -7.848
  260    HB2  LYS 676           2HB      LYS 676 -21.488   6.350  -9.674
  261    HB3  LYS 676           1HB      LYS 676 -19.796   5.988  -9.993
  262    HG2  LYS 676           2HG      LYS 676 -20.316   3.859 -10.319
  263    HG3  LYS 676           1HG      LYS 676 -20.911   3.746  -8.663
  264    HD2  LYS 676           2HD      LYS 676 -22.715   5.019 -10.629
  265    HD3  LYS 676           1HD      LYS 676 -22.437   3.287 -10.825
  266    HE2  LYS 676           2HE      LYS 676 -23.053   4.292  -8.097
  267    HE3  LYS 676           1HE      LYS 676 -24.366   4.255  -9.269
  268    HZ1  LYS 676           3HZ      LYS 676 -22.698   1.860  -8.955
  269    HZ2  LYS 676           1HZ      LYS 676 -24.332   1.990  -9.389
  270    HZ3  LYS 676           2HZ      LYS 676 -23.863   2.196  -7.768
  271    H    ASP 677           H        ASP 677 -20.657   4.546  -5.921
  272    HA   ASP 677           HA       ASP 677 -23.496   4.447  -6.137
  273    HB2  ASP 677           2HB      ASP 677 -21.634   2.661  -5.315
  274    HB3  ASP 677           1HB      ASP 677 -22.221   3.257  -3.763
  275    H    GLY 678           H        GLY 678 -24.476   4.228  -3.728
  276    HA2  GLY 678           1HA      GLY 678 -25.210   5.407  -1.867
  277    HA3  GLY 678           2HA      GLY 678 -23.892   6.543  -2.105
  278    H    SER 679           H        SER 679 -25.256   6.367  -5.037
  279    HA   SER 679           HA       SER 679 -26.779   8.814  -4.566
  280    HB2  SER 679           2HB      SER 679 -26.679   8.657  -7.228
  281    HB3  SER 679           1HB      SER 679 -25.320   9.266  -6.278
  282    HG   SER 679           HG       SER 679 -24.189   7.642  -6.972
  283    H    GLN 680           H        GLN 680 -27.406   5.602  -4.745
  284    HA   GLN 680           HA       GLN 680 -29.774   5.739  -6.419
  285    HB2  GLN 680           2HB      GLN 680 -28.293   3.546  -5.020
  286    HB3  GLN 680           1HB      GLN 680 -29.954   3.280  -5.532
  287    HG2  GLN 680           2HG      GLN 680 -29.130   2.673  -7.492
  288    HG3  GLN 680           1HG      GLN 680 -28.753   4.375  -7.761
  289   HE21  GLN 680          1HE2      GLN 680 -27.267   2.110  -5.505
  290   HE22  GLN 680          2HE2      GLN 680 -25.676   2.190  -6.193
  291    H    SER 681           H        SER 681 -30.226   7.480  -4.512
  292    HA   SER 681           HA       SER 681 -31.204   6.583  -2.047
  293    HB2  SER 681           2HB      SER 681 -32.625   8.906  -2.732
  294    HB3  SER 681           1HB      SER 681 -31.123   8.810  -1.811
  295    HG   SER 681           HG       SER 681 -30.440   9.989  -3.455
  296    H    LYS 682           H        LYS 682 -32.877   7.229  -5.114
  297    HA   LYS 682           HA       LYS 682 -35.439   6.452  -4.003
  298    HB2  LYS 682           2HB      LYS 682 -34.510   7.386  -6.708
  299    HB3  LYS 682           1HB      LYS 682 -36.125   6.730  -6.486
  300    HG2  LYS 682           2HG      LYS 682 -36.764   8.486  -5.068
  301    HG3  LYS 682           1HG      LYS 682 -35.094   8.999  -4.816
  302    HD2  LYS 682           2HD      LYS 682 -35.358   9.189  -7.532
  303    HD3  LYS 682           1HD      LYS 682 -36.962   9.659  -6.967
  304    HE2  LYS 682           2HE      LYS 682 -36.164  11.494  -5.812
  305    HE3  LYS 682           1HE      LYS 682 -34.540  10.823  -5.666
  306    HZ1  LYS 682           3HZ      LYS 682 -35.715  11.699  -8.248
  307    HZ2  LYS 682           1HZ      LYS 682 -34.094  11.309  -7.930
  308    HZ3  LYS 682           2HZ      LYS 682 -34.776  12.713  -7.262
  309    H    LEU 683           H        LEU 683 -32.805   4.962  -5.568
  310    HA   LEU 683           HA       LEU 683 -34.330   2.782  -6.707
  311    HB2  LEU 683           2HB      LEU 683 -31.539   3.710  -6.756
  312    HB3  LEU 683           1HB      LEU 683 -31.730   1.966  -6.793
  313    HG   LEU 683           HG       LEU 683 -33.474   2.586  -8.711
  314   HD11  LEU 683          1HD1      LEU 683 -31.746   4.479  -9.837
  315   HD12  LEU 683          2HD1      LEU 683 -33.417   4.713  -9.322
  316   HD13  LEU 683          3HD1      LEU 683 -32.096   5.048  -8.204
  317   HD21  LEU 683          3HD2      LEU 683 -31.845   1.934 -10.271
  318   HD22  LEU 683          1HD2      LEU 683 -30.529   2.616  -9.313
  319   HD23  LEU 683          2HD2      LEU 683 -31.367   1.164  -8.760
  320    H    GLY 684           H        GLY 684 -32.898   3.544  -3.712
  321    HA2  GLY 684           1HA      GLY 684 -33.903   1.801  -2.054
  322    HA3  GLY 684           2HA      GLY 684 -32.786   0.731  -2.890
  323    H    GLY 685           H        GLY 685 -32.631   4.036  -1.575
  324    HA2  GLY 685           1HA      GLY 685 -30.044   3.305  -0.362
  325    HA3  GLY 685           2HA      GLY 685 -30.497   4.930  -0.859
  326    H    GLY 901           H        GLY 901 -30.977   2.420   1.532
  327    HA2  GLY 901           1HA      GLY 901 -31.050   4.020   3.738
  328    HA3  GLY 901           2HA      GLY 901 -32.716   4.002   3.174
  329    H    GLY 902           H        GLY 902 -32.522   3.059   5.557
  330    HA2  GLY 902           1HA      GLY 902 -33.080   0.235   5.266
  331    HA3  GLY 902           2HA      GLY 902 -31.682   0.602   6.270
  332    H    SER 903           H        SER 903 -32.694  -0.223   8.134
  333    HA   SER 903           HA       SER 903 -35.201   0.858   9.035
  334    HB2  SER 903           2HB      SER 903 -33.725  -0.438  11.136
  335    HB3  SER 903           1HB      SER 903 -35.172  -0.999  10.295
  336    HG   SER 903           HG       SER 903 -32.452  -1.466   9.676
  337    H    GLY 904           H        GLY 904 -34.324   3.127   8.794
  338    HA2  GLY 904           1HA      GLY 904 -33.840   5.104   9.876
  339    HA3  GLY 904           2HA      GLY 904 -33.712   4.192  11.376
  340    H    GLY 905           H        GLY 905 -31.782   4.401  12.287
  341    HA2  GLY 905           1HA      GLY 905 -29.428   4.926  10.657
  342    HA3  GLY 905           2HA      GLY 905 -29.491   4.849  12.412
  343    H    HIS 906           H        HIS 906 -31.090   2.209  11.635
  344    HA   HIS 906           HA       HIS 906 -28.695   0.542  11.849
  345    HB2  HIS 906           2HB      HIS 906 -31.604  -0.062  12.423
  346    HB3  HIS 906           1HB      HIS 906 -30.301  -1.236  12.565
  347    HD1  HIS 906           1HD      HIS 906 -28.313  -0.388  14.334
  348    HD2  HIS 906           2HD      HIS 906 -32.123   1.240  14.717
  349    HE1  HIS 906           1HE      HIS 906 -28.446   0.578  16.669
  350    H    MET 907           H        MET 907 -28.227   0.799   9.578
  351    HA   MET 907           HA       MET 907 -30.008  -0.674   7.770
  352    HB2  MET 907           2HB      MET 907 -29.273   1.555   7.037
  353    HB3  MET 907           1HB      MET 907 -27.594   1.051   7.175
  354    HG2  MET 907           2HG      MET 907 -28.008  -0.650   5.430
  355    HG3  MET 907           1HG      MET 907 -29.647  -0.025   5.253
  356    HE1  MET 907           3HE      MET 907 -26.866  -0.246   3.189
  357    HE2  MET 907           1HE      MET 907 -26.059   1.312   3.022
  358    HE3  MET 907           2HE      MET 907 -25.910   0.400   4.524
  359    H    GLY 908           H        GLY 908 -29.505  -2.677   7.094
  360    HA2  GLY 908           1HA      GLY 908 -26.792  -3.574   6.845
  361    HA3  GLY 908           2HA      GLY 908 -27.571  -4.241   8.268
  362    H    SER 909           H        SER 909 -27.248  -4.415   4.859
  363    HA   SER 909           HA       SER 909 -29.439  -6.258   4.497
  364    HB2  SER 909           2HB      SER 909 -27.613  -6.301   2.301
  365    HB3  SER 909           1HB      SER 909 -29.213  -5.562   2.371
  366    HG   SER 909           HG       SER 909 -27.598  -4.016   1.879
  367    H    GLY 910           H        GLY 910 -28.646  -7.733   6.186
  368    HA2  GLY 910           1HA      GLY 910 -26.195  -9.118   5.973
  369    HA3  GLY 910           2HA      GLY 910 -27.591  -9.637   6.905
  370    H    GLY 911           H        GLY 911 -25.835 -11.339   5.456
  371    HA2  GLY 911           1HA      GLY 911 -26.406 -13.362   4.355
  372    HA3  GLY 911           2HA      GLY 911 -27.793 -12.552   3.638
  373    H    LEU  18           H        LEU  18 -26.397 -10.244   2.732
  374    HA   LEU  18           HA       LEU  18 -25.236 -11.333   0.320
  375    HB2  LEU  18           2HB      LEU  18 -26.003  -8.597   1.263
  376    HB3  LEU  18           1HB      LEU  18 -24.954  -8.776  -0.128
  377    HG   LEU  18           HG       LEU  18 -27.046 -10.481  -0.715
  378   HD11  LEU  18          1HD1      LEU  18 -29.025  -8.902  -0.442
  379   HD12  LEU  18          2HD1      LEU  18 -28.491  -9.777   0.994
  380   HD13  LEU  18          3HD1      LEU  18 -28.056  -8.083   0.782
  381   HD21  LEU  18          3HD2      LEU  18 -26.103  -9.161  -2.398
  382   HD22  LEU  18          1HD2      LEU  18 -27.741  -8.531  -2.225
  383   HD23  LEU  18          2HD2      LEU  18 -26.382  -7.663  -1.508
  384    H    SER  19           H        SER  19 -23.147 -11.120  -0.353
  385    HA   SER  19           HA       SER  19 -21.198 -10.322   1.689
  386    HB2  SER  19           2HB      SER  19 -20.391 -11.644  -0.867
  387    HB3  SER  19           1HB      SER  19 -19.709 -11.820   0.750
  388    HG   SER  19           HG       SER  19 -21.978 -12.786   1.141
  389    H    TRP  20           H        TRP  20 -22.553  -9.447  -1.324
  390    HA   TRP  20           HA       TRP  20 -22.262  -7.729  -2.767
  391    HB2  TRP  20           2HB      TRP  20 -20.394  -6.338  -0.883
  392    HB3  TRP  20           1HB      TRP  20 -21.567  -5.642  -1.992
  393    HD1  TRP  20           HD       TRP  20 -24.279  -6.610  -1.135
  394    HE1  TRP  20           1HE      TRP  20 -25.224  -6.237   1.233
  395    HE3  TRP  20           3HE      TRP  20 -19.898  -5.867   1.385
  396    HZ2  TRP  20           2HZ      TRP  20 -24.251  -5.696   3.817
  397    HZ3  TRP  20           3HZ      TRP  20 -19.995  -5.425   3.811
  398    HH2  TRP  20           HH       TRP  20 -22.124  -5.343   4.997
  399    H    LYS  21           H        LYS  21 -19.152  -7.276  -1.290
  400    HA   LYS  21           HA       LYS  21 -17.828  -8.552  -3.568
  401    HB2  LYS  21           2HB      LYS  21 -17.518  -5.738  -2.617
  402    HB3  LYS  21           1HB      LYS  21 -16.077  -6.584  -3.162
  403    HG2  LYS  21           2HG      LYS  21 -18.520  -5.836  -4.719
  404    HG3  LYS  21           1HG      LYS  21 -16.830  -5.466  -5.057
  405    HD2  LYS  21           2HD      LYS  21 -16.404  -7.561  -5.919
  406    HD3  LYS  21           1HD      LYS  21 -17.713  -8.315  -5.008
  407    HE2  LYS  21           2HE      LYS  21 -18.602  -6.284  -6.918
  408    HE3  LYS  21           1HE      LYS  21 -17.794  -7.661  -7.662
  409    HZ1  LYS  21           3HZ      LYS  21 -19.868  -8.173  -5.646
  410    HZ2  LYS  21           1HZ      LYS  21 -19.413  -9.103  -6.990
  411    HZ3  LYS  21           2HZ      LYS  21 -20.347  -7.701  -7.203
  412    H    ARG  22           H        ARG  22 -16.315  -9.958  -2.918
  413    HA   ARG  22           HA       ARG  22 -15.651  -9.948  -0.060
  414    HB2  ARG  22           2HB      ARG  22 -16.825 -11.927  -1.406
  415    HB3  ARG  22           1HB      ARG  22 -15.154 -12.338  -1.767
  416    HG2  ARG  22           2HG      ARG  22 -14.934 -13.291   0.214
  417    HG3  ARG  22           1HG      ARG  22 -15.377 -11.781   1.015
  418    HD2  ARG  22           2HD      ARG  22 -17.728 -12.338   0.831
  419    HD3  ARG  22           1HD      ARG  22 -17.333 -13.806  -0.062
  420    HE   ARG  22           HE       ARG  22 -16.145 -13.589   2.576
  421   HH11  ARG  22          2HH1      ARG  22 -18.842 -14.758   0.677
  422   HH12  ARG  22          1HH1      ARG  22 -19.274 -16.000   1.807
  423   HH21  ARG  22          2HH2      ARG  22 -16.707 -15.225   4.070
  424   HH22  ARG  22          1HH2      ARG  22 -18.065 -16.265   3.740
  425    H    CYS  23           H        CYS  23 -13.730  -9.233   0.420
  426    HA   CYS  23           HA       CYS  23 -11.615  -8.908  -1.456
  427    HB2  CYS  23           2HB      CYS  23 -10.493  -8.476   0.963
  428    HB3  CYS  23           1HB      CYS  23 -11.490  -7.287   0.127
  429    H    ALA  24           H        ALA  24  -9.492  -9.823  -1.266
  430    HA   ALA  24           HA       ALA  24  -9.558 -12.644  -0.648
  431    HB1  ALA  24           1HB      ALA  24  -7.258 -12.642  -1.586
  432    HB2  ALA  24           2HB      ALA  24  -8.477 -11.989  -2.683
  433    HB3  ALA  24           3HB      ALA  24  -7.399 -10.897  -1.813
  434    H    GLY  25           H        GLY  25  -8.922  -9.912   1.152
  435    HA2  GLY  25           1HA      GLY  25  -6.672 -10.999   2.646
  436    HA3  GLY  25           2HA      GLY  25  -7.416  -9.427   2.877
  437    H    CYS  26           H        CYS  26  -9.325  -9.265   4.139
  438    HA   CYS  26           HA       CYS  26  -9.328 -11.052   6.349
  439    HB2  CYS  26           2HB      CYS  26 -10.860  -9.599   7.379
  440    HB3  CYS  26           1HB      CYS  26  -9.840  -8.561   6.401
  441    H    GLY  27           H        GLY  27 -11.363 -10.703   3.518
  442    HA2  GLY  27           1HA      GLY  27 -12.436 -12.461   2.449
  443    HA3  GLY  27           2HA      GLY  27 -12.116 -13.473   3.846
  444    H    GLY  28           H        GLY  28 -13.480 -10.685   4.984
  445    HA2  GLY  28           1HA      GLY  28 -16.006 -12.005   5.427
  446    HA3  GLY  28           2HA      GLY  28 -15.543 -10.412   6.012
  447    H    LYS  29           H        LYS  29 -15.957  -8.613   4.777
  448    HA   LYS  29           HA       LYS  29 -16.799  -8.718   2.069
  449    HB2  LYS  29           2HB      LYS  29 -19.091  -7.739   2.514
  450    HB3  LYS  29           1HB      LYS  29 -18.919  -9.451   2.877
  451    HG2  LYS  29           2HG      LYS  29 -18.293  -8.012   5.235
  452    HG3  LYS  29           1HG      LYS  29 -19.783  -7.340   4.568
  453    HD2  LYS  29           2HD      LYS  29 -19.622 -10.278   4.570
  454    HD3  LYS  29           1HD      LYS  29 -19.672  -9.527   6.165
  455    HE2  LYS  29           2HE      LYS  29 -21.742  -8.495   5.732
  456    HE3  LYS  29           1HE      LYS  29 -21.613  -8.785   3.997
  457    HZ1  LYS  29           3HZ      LYS  29 -21.990 -11.085   4.308
  458    HZ2  LYS  29           1HZ      LYS  29 -23.176 -10.285   5.216
  459    HZ3  LYS  29           2HZ      LYS  29 -21.837 -10.970   5.993
  460    H    ILE  30           H        ILE  30 -16.805  -6.654   1.150
  461    HA   ILE  30           HA       ILE  30 -15.311  -4.734   2.643
  462    HB   ILE  30           HB       ILE  30 -16.552  -4.508  -0.103
  463   HG12  ILE  30          2HG1      ILE  30 -13.662  -4.978   0.642
  464   HG13  ILE  30          1HG1      ILE  30 -14.785  -6.284   0.281
  465   HG21  ILE  30          1HG2      ILE  30 -14.582  -2.724   1.322
  466   HG22  ILE  30          2HG2      ILE  30 -14.918  -2.652  -0.408
  467   HG23  ILE  30          3HG2      ILE  30 -16.197  -2.299   0.752
  468   HD11  ILE  30          3HD1      ILE  30 -14.024  -4.066  -1.608
  469   HD12  ILE  30          1HD1      ILE  30 -13.383  -5.710  -1.632
  470   HD13  ILE  30          2HD1      ILE  30 -15.092  -5.424  -1.965
  471    H    ALA  31           H        ALA  31 -16.245  -3.616   4.189
  472    HA   ALA  31           HA       ALA  31 -18.907  -2.461   3.728
  473    HB1  ALA  31           1HB      ALA  31 -17.579  -3.566   6.054
  474    HB2  ALA  31           2HB      ALA  31 -18.199  -1.944   6.361
  475    HB3  ALA  31           3HB      ALA  31 -19.286  -3.211   5.793
  476    H    ASP  32           H        ASP  32 -16.169  -1.625   2.784
  477    HA   ASP  32           HA       ASP  32 -15.819   0.978   4.035
  478    HB2  ASP  32           2HB      ASP  32 -14.050  -0.780   2.922
  479    HB3  ASP  32           1HB      ASP  32 -14.287   0.352   1.595
  480    H    ARG  33           H        ARG  33 -15.399   2.807   2.352
  481    HA   ARG  33           HA       ARG  33 -17.758   2.918   0.640
  482    HB2  ARG  33           2HB      ARG  33 -17.359   4.847   2.057
  483    HB3  ARG  33           1HB      ARG  33 -15.732   5.023   1.417
  484    HG2  ARG  33           2HG      ARG  33 -17.077   5.213  -0.867
  485    HG3  ARG  33           1HG      ARG  33 -18.329   5.784   0.233
  486    HD2  ARG  33           2HD      ARG  33 -15.534   6.876   0.300
  487    HD3  ARG  33           1HD      ARG  33 -16.765   7.527  -0.778
  488    HE   ARG  33           HE       ARG  33 -18.094   8.001   1.260
  489   HH11  ARG  33          2HH1      ARG  33 -14.624   7.594   1.531
  490   HH12  ARG  33          1HH1      ARG  33 -14.487   8.566   2.963
  491   HH21  ARG  33          2HH2      ARG  33 -17.932   9.273   3.133
  492   HH22  ARG  33          1HH2      ARG  33 -16.382   9.536   3.878
  493    H    PHE  34           H        PHE  34 -14.275   3.549   0.374
  494    HA   PHE  34           HA       PHE  34 -14.429   3.086  -2.521
  495    HB2  PHE  34           2HB      PHE  34 -12.612   4.601  -0.726
  496    HB3  PHE  34           1HB      PHE  34 -11.869   3.836  -2.126
  497    HD1  PHE  34           1HD      PHE  34 -15.221   5.414  -1.802
  498    HD2  PHE  34           2HD      PHE  34 -11.346   5.582  -3.544
  499    HE1  PHE  34           1HE      PHE  34 -15.943   7.298  -3.212
  500    HE2  PHE  34           2HE      PHE  34 -12.055   7.462  -4.957
  501    HZ   PHE  34           HZ       PHE  34 -14.354   8.320  -4.796
  502    H    LEU  35           H        LEU  35 -13.633   1.264  -3.396
  503    HA   LEU  35           HA       LEU  35 -12.039  -0.509  -1.693
  504    HB2  LEU  35           2HB      LEU  35 -12.418  -2.153  -3.619
  505    HB3  LEU  35           1HB      LEU  35 -13.781  -1.771  -2.586
  506    HG   LEU  35           HG       LEU  35 -13.628  -0.035  -4.927
  507   HD11  LEU  35          1HD1      LEU  35 -14.211  -1.671  -6.579
  508   HD12  LEU  35          2HD1      LEU  35 -12.671  -2.140  -5.859
  509   HD13  LEU  35          3HD1      LEU  35 -14.156  -2.968  -5.387
  510   HD21  LEU  35          3HD2      LEU  35 -16.010  -0.944  -5.088
  511   HD22  LEU  35          1HD2      LEU  35 -15.669  -1.754  -3.559
  512   HD23  LEU  35          2HD2      LEU  35 -15.594   0.005  -3.662
  513    H    LEU  36           H        LEU  36 -10.072  -1.392  -2.489
  514    HA   LEU  36           HA       LEU  36  -8.796   0.340  -4.504
  515    HB2  LEU  36           2HB      LEU  36  -6.805  -0.297  -2.675
  516    HB3  LEU  36           1HB      LEU  36  -7.590   1.256  -2.882
  517    HG   LEU  36           HG       LEU  36  -9.226  -0.418  -1.219
  518   HD11  LEU  36          1HD1      LEU  36  -6.540  -1.033  -0.907
  519   HD12  LEU  36          2HD1      LEU  36  -6.892   0.107   0.392
  520   HD13  LEU  36          3HD1      LEU  36  -7.845  -1.366   0.232
  521   HD21  LEU  36          3HD2      LEU  36  -9.043   1.451   0.303
  522   HD22  LEU  36          1HD2      LEU  36  -7.667   2.088  -0.598
  523   HD23  LEU  36          2HD2      LEU  36  -9.265   2.043  -1.343
  524    H    TYR  37           H        TYR  37  -6.925  -0.519  -5.515
  525    HA   TYR  37           HA       TYR  37  -6.942  -3.449  -5.665
  526    HB2  TYR  37           2HB      TYR  37  -6.578  -1.288  -7.600
  527    HB3  TYR  37           1HB      TYR  37  -5.334  -2.528  -7.719
  528    HD1  TYR  37           1HD      TYR  37  -6.447  -5.022  -7.447
  529    HD2  TYR  37           2HD      TYR  37  -8.334  -1.560  -9.029
  530    HE1  TYR  37           1HE      TYR  37  -7.993  -6.455  -8.703
  531    HE2  TYR  37           2HE      TYR  37  -9.888  -2.971 -10.291
  532    HH   TYR  37           HH       TYR  37  -9.689  -6.529 -10.148
  533    H    ALA  38           H        ALA  38  -5.029  -4.612  -5.592
  534    HA   ALA  38           HA       ALA  38  -2.599  -3.136  -4.868
  535    HB1  ALA  38           1HB      ALA  38  -4.050  -4.984  -3.204
  536    HB2  ALA  38           2HB      ALA  38  -2.420  -5.574  -3.524
  537    HB3  ALA  38           3HB      ALA  38  -2.656  -3.977  -2.813
  538    H    MET  39           H        MET  39  -3.208  -6.610  -5.088
  539    HA   MET  39           HA       MET  39  -1.212  -6.761  -7.218
  540    HB2  MET  39           2HB      MET  39  -2.473  -9.082  -5.769
  541    HB3  MET  39           1HB      MET  39  -0.981  -9.073  -6.693
  542    HG2  MET  39           2HG      MET  39  -0.116  -9.032  -4.605
  543    HG3  MET  39           1HG      MET  39  -0.283  -7.297  -4.868
  544    HE1  MET  39           3HE      MET  39  -1.028  -8.201  -1.069
  545    HE2  MET  39           1HE      MET  39  -0.769  -9.718  -1.931
  546    HE3  MET  39           2HE      MET  39   0.260  -8.326  -2.268
  547    H    ASP  40           H        ASP  40  -4.248  -8.519  -6.516
  548    HA   ASP  40           HA       ASP  40  -5.218  -7.945  -9.190
  549    HB2  ASP  40           2HB      ASP  40  -5.307 -10.138  -9.981
  550    HB3  ASP  40           1HB      ASP  40  -3.749 -10.092  -9.164
  551    H    SER  41           H        SER  41  -5.759  -8.209  -5.981
  552    HA   SER  41           HA       SER  41  -8.568  -9.003  -6.278
  553    HB2  SER  41           2HB      SER  41  -7.790  -8.665  -3.544
  554    HB3  SER  41           1HB      SER  41  -8.253 -10.150  -4.378
  555    HG   SER  41           HG       SER  41  -6.233 -10.709  -4.517
  556    H    TYR  42           H        TYR  42 -10.102  -7.788  -4.822
  557    HA   TYR  42           HA       TYR  42  -9.415  -4.928  -4.840
  558    HB2  TYR  42           2HB      TYR  42 -12.038  -4.801  -4.441
  559    HB3  TYR  42           1HB      TYR  42 -11.360  -4.957  -6.057
  560    HD1  TYR  42           1HD      TYR  42 -11.420  -7.151  -7.208
  561    HD2  TYR  42           2HD      TYR  42 -13.366  -6.525  -3.480
  562    HE1  TYR  42           1HE      TYR  42 -12.764  -9.183  -7.576
  563    HE2  TYR  42           2HE      TYR  42 -14.710  -8.554  -3.829
  564    HH   TYR  42           HH       TYR  42 -13.977 -10.897  -5.950
  565    H    TRP  43           H        TRP  43  -9.169  -3.904  -2.957
  566    HA   TRP  43           HA       TRP  43  -9.893  -5.396  -0.515
  567    HB2  TRP  43           2HB      TRP  43  -7.556  -3.511  -0.684
  568    HB3  TRP  43           1HB      TRP  43  -7.876  -4.754   0.514
  569    HD1  TRP  43           HD       TRP  43  -6.979  -4.550  -3.259
  570    HE1  TRP  43           1HE      TRP  43  -5.485  -6.559  -3.827
  571    HE3  TRP  43           3HE      TRP  43  -6.988  -6.883   1.288
  572    HZ2  TRP  43           2HZ      TRP  43  -4.427  -8.825  -2.527
  573    HZ3  TRP  43           3HZ      TRP  43  -5.702  -8.969   1.540
  574    HH2  TRP  43           HH       TRP  43  -4.452  -9.916  -0.332
  575    H    HIS  44           H        HIS  44  -9.798  -3.935   1.437
  576    HA   HIS  44           HA       HIS  44 -10.698  -1.193   0.870
  577    HB2  HIS  44           2HB      HIS  44 -12.101  -1.407   3.010
  578    HB3  HIS  44           1HB      HIS  44 -12.711  -2.236   1.586
  579    HD1  HIS  44           1HD      HIS  44 -12.735  -2.862   4.996
  580    HD2  HIS  44           2HD      HIS  44 -11.304  -5.046   1.754
  581    HE1  HIS  44           1HE      HIS  44 -12.559  -5.300   5.751
  582    H    SER  45           H        SER  45 -10.624  -0.044   3.277
  583    HA   SER  45           HA       SER  45  -7.866   0.282   3.684
  584    HB2  SER  45           2HB      SER  45  -9.880   1.121   5.745
  585    HB3  SER  45           1HB      SER  45  -8.432   1.965   5.193
  586    HG   SER  45           HG       SER  45 -10.927   1.665   3.869
  587    H    ARG  46           H        ARG  46 -10.108  -1.908   5.181
  588    HA   ARG  46           HA       ARG  46  -8.319  -2.407   7.421
  589    HB2  ARG  46           2HB      ARG  46 -11.122  -2.879   6.837
  590    HB3  ARG  46           1HB      ARG  46 -10.344  -4.308   7.505
  591    HG2  ARG  46           2HG      ARG  46 -10.292  -1.570   8.752
  592    HG3  ARG  46           1HG      ARG  46 -11.367  -2.886   9.224
  593    HD2  ARG  46           2HD      ARG  46  -9.753  -3.954  10.364
  594    HD3  ARG  46           1HD      ARG  46  -8.527  -3.606   9.144
  595    HE   ARG  46           HE       ARG  46  -9.394  -1.685  11.217
  596   HH11  ARG  46          2HH1      ARG  46  -6.902  -3.089   9.190
  597   HH12  ARG  46          1HH1      ARG  46  -5.652  -2.051   9.804
  598   HH21  ARG  46          2HH2      ARG  46  -7.765  -0.334  12.019
  599   HH22  ARG  46          1HH2      ARG  46  -6.135  -0.490  11.416
  600    H    CYS  47           H        CYS  47  -8.663  -3.561   4.270
  601    HA   CYS  47           HA       CYS  47  -7.666  -6.228   4.967
  602    HB2  CYS  47           2HB      CYS  47  -9.463  -5.294   2.976
  603    HB3  CYS  47           1HB      CYS  47  -8.044  -5.923   2.148
  604    H    LEU  48           H        LEU  48  -6.956  -3.582   2.678
  605    HA   LEU  48           HA       LEU  48  -4.404  -4.711   2.019
  606    HB2  LEU  48           2HB      LEU  48  -6.144  -2.949   0.807
  607    HB3  LEU  48           1HB      LEU  48  -4.829  -1.910   1.317
  608    HG   LEU  48           HG       LEU  48  -4.974  -3.559  -0.982
  609   HD11  LEU  48          1HD1      LEU  48  -3.681  -1.892  -1.625
  610   HD12  LEU  48          2HD1      LEU  48  -3.557  -1.347   0.049
  611   HD13  LEU  48          3HD1      LEU  48  -2.378  -2.490  -0.597
  612   HD21  LEU  48          3HD2      LEU  48  -4.027  -5.293   0.642
  613   HD22  LEU  48          1HD2      LEU  48  -3.134  -5.005  -0.851
  614   HD23  LEU  48          2HD2      LEU  48  -2.573  -4.295   0.663
  615    H    LYS  49           H        LYS  49  -3.436  -4.813   4.082
  616    HA   LYS  49           HA       LYS  49  -2.235  -2.262   4.888
  617    HB2  LYS  49           2HB      LYS  49  -2.378  -3.370   7.302
  618    HB3  LYS  49           1HB      LYS  49  -3.670  -2.361   6.676
  619    HG2  LYS  49           2HG      LYS  49  -4.721  -4.235   7.622
  620    HG3  LYS  49           1HG      LYS  49  -4.768  -4.499   5.877
  621    HD2  LYS  49           2HD      LYS  49  -2.891  -6.009   6.010
  622    HD3  LYS  49           1HD      LYS  49  -2.693  -5.670   7.730
  623    HE2  LYS  49           2HE      LYS  49  -5.192  -6.479   7.840
  624    HE3  LYS  49           1HE      LYS  49  -4.766  -7.291   6.336
  625    HZ1  LYS  49           3HZ      LYS  49  -4.444  -8.607   8.437
  626    HZ2  LYS  49           1HZ      LYS  49  -3.156  -7.568   8.802
  627    HZ3  LYS  49           2HZ      LYS  49  -3.097  -8.530   7.408
  628    H    CYS  50           H        CYS  50  -0.322  -2.600   6.289
  629    HA   CYS  50           HA       CYS  50   1.479  -4.548   5.326
  630    HB2  CYS  50           2HB      CYS  50   2.048  -2.324   6.383
  631    HB3  CYS  50           1HB      CYS  50   1.620  -3.023   7.938
  632    H    SER  51           H        SER  51   1.858  -6.583   5.996
  633    HA   SER  51           HA       SER  51   0.064  -7.748   7.933
  634    HB2  SER  51           2HB      SER  51   2.399  -9.172   6.659
  635    HB3  SER  51           1HB      SER  51   0.855  -9.840   7.189
  636    HG   SER  51           HG       SER  51   1.003  -7.911   5.128
  637    H    SER  52           H        SER  52   2.911  -6.071   8.183
  638    HA   SER  52           HA       SER  52   3.843  -7.630  10.486
  639    HB2  SER  52           2HB      SER  52   5.217  -5.534   8.800
  640    HB3  SER  52           1HB      SER  52   5.922  -6.230  10.260
  641    HG   SER  52           HG       SER  52   6.647  -7.364   8.479
  642    H    CYS  53           H        CYS  53   3.229  -4.201   9.578
  643    HA   CYS  53           HA       CYS  53   2.942  -3.684  12.463
  644    HB2  CYS  53           2HB      CYS  53   3.629  -1.423  12.138
  645    HB3  CYS  53           1HB      CYS  53   4.801  -2.454  11.328
  646    H    GLN  54           H        GLN  54   1.152  -4.172   9.800
  647    HA   GLN  54           HA       GLN  54  -1.041  -3.931   9.325
  648    HB2  GLN  54           2HB      GLN  54  -1.055  -2.990  12.179
  649    HB3  GLN  54           1HB      GLN  54  -2.517  -2.953  11.201
  650    HG2  GLN  54           2HG      GLN  54  -0.910  -5.458  11.459
  651    HG3  GLN  54           1HG      GLN  54  -2.073  -4.991  12.701
  652   HE21  GLN  54          1HE2      GLN  54  -4.181  -4.076  11.449
  653   HE22  GLN  54          2HE2      GLN  54  -4.854  -5.239  10.358
  654    H    ALA  55           H        ALA  55   0.914  -1.811   8.731
  655    HA   ALA  55           HA       ALA  55  -0.377   0.707   8.907
  656    HB1  ALA  55           1HB      ALA  55   1.160   1.046   6.751
  657    HB2  ALA  55           2HB      ALA  55   1.811   1.031   8.389
  658    HB3  ALA  55           3HB      ALA  55   1.905  -0.420   7.391
  659    H    GLN  56           H        GLN  56  -2.121   1.415   7.842
  660    HA   GLN  56           HA       GLN  56  -3.477  -0.210   5.951
  661    HB2  GLN  56           2HB      GLN  56  -3.893   2.572   7.009
  662    HB3  GLN  56           1HB      GLN  56  -4.917   1.909   5.743
  663    HG2  GLN  56           2HG      GLN  56  -6.094   0.732   7.195
  664    HG3  GLN  56           1HG      GLN  56  -4.646   0.057   7.930
  665   HE21  GLN  56          1HE2      GLN  56  -7.249   2.151   8.315
  666   HE22  GLN  56          2HE2      GLN  56  -6.761   2.900   9.798
  667    H    LEU  57           H        LEU  57  -1.719  -0.416   4.395
  668    HA   LEU  57           HA       LEU  57  -0.608   1.755   3.000
  669    HB2  LEU  57           2HB      LEU  57  -0.900  -1.120   2.128
  670    HB3  LEU  57           1HB      LEU  57   0.172   0.061   1.402
  671    HG   LEU  57           HG       LEU  57   0.449  -0.565   4.314
  672   HD11  LEU  57          1HD1      LEU  57   2.195  -2.119   2.582
  673   HD12  LEU  57          2HD1      LEU  57   1.298  -2.606   4.020
  674   HD13  LEU  57          3HD1      LEU  57   0.498  -2.586   2.448
  675   HD21  LEU  57          3HD2      LEU  57   1.899   0.871   2.255
  676   HD22  LEU  57          1HD2      LEU  57   2.070   0.937   4.009
  677   HD23  LEU  57          2HD2      LEU  57   2.918  -0.303   3.086
  678    H    GLY  58           H        GLY  58  -3.631   0.126   2.637
  679    HA2  GLY  58           1HA      GLY  58  -4.053   0.962  -0.087
  680    HA3  GLY  58           2HA      GLY  58  -5.242   0.233   0.980
  681    H    ASP  59           H        ASP  59  -4.390   2.428   2.989
  682    HA   ASP  59           HA       ASP  59  -6.288   4.398   1.936
  683    HB2  ASP  59           2HB      ASP  59  -6.611   3.179   4.219
  684    HB3  ASP  59           1HB      ASP  59  -5.401   4.320   4.803
  685    H    ILE  60           H        ILE  60  -3.240   4.001   1.743
  686    HA   ILE  60           HA       ILE  60  -2.684   6.876   1.863
  687    HB   ILE  60           HB       ILE  60  -0.500   4.911   2.510
  688   HG12  ILE  60          2HG1      ILE  60  -1.974   6.346   4.701
  689   HG13  ILE  60          1HG1      ILE  60  -2.533   4.772   4.145
  690   HG21  ILE  60          1HG2      ILE  60   0.733   6.749   2.575
  691   HG22  ILE  60          2HG2      ILE  60  -0.686   7.716   2.168
  692   HG23  ILE  60          3HG2      ILE  60  -0.285   7.404   3.858
  693   HD11  ILE  60          3HD1      ILE  60  -0.765   5.136   6.137
  694   HD12  ILE  60          1HD1      ILE  60  -0.845   3.681   5.141
  695   HD13  ILE  60          2HD1      ILE  60   0.331   4.940   4.767
  696    H    GLY  61           H        GLY  61  -1.310   7.581   0.197
  697    HA2  GLY  61           1HA      GLY  61  -1.143   5.925  -2.138
  698    HA3  GLY  61           2HA      GLY  61  -0.420   7.515  -1.941
  699    H    THR  62           H        THR  62   0.019   4.413  -0.290
  700    HA   THR  62           HA       THR  62   2.900   4.845  -0.300
  701    HB   THR  62           HB       THR  62   2.479   2.501   1.068
  702    HG1  THR  62           1HG      THR  62   0.180   2.815   0.874
  703   HG21  THR  62          3HG2      THR  62   3.595   3.745   2.548
  704   HG22  THR  62          1HG2      THR  62   2.118   4.642   2.900
  705   HG23  THR  62          2HG2      THR  62   3.202   5.198   1.626
  706    H    SER  63           H        SER  63   4.270   3.734  -1.547
  707    HA   SER  63           HA       SER  63   3.354   1.712  -3.349
  708    HB2  SER  63           2HB      SER  63   6.235   1.819  -3.046
  709    HB3  SER  63           1HB      SER  63   5.244   2.264  -4.439
  710    HG   SER  63           HG       SER  63   5.299   4.305  -3.853
  711    H    SER  64           H        SER  64   2.503   0.131  -1.926
  712    HA   SER  64           HA       SER  64   4.043  -1.100   0.114
  713    HB2  SER  64           2HB      SER  64   1.958  -2.805  -0.946
  714    HB3  SER  64           1HB      SER  64   2.055  -2.004   0.622
  715    HG   SER  64           HG       SER  64   0.411  -1.419  -1.289
  716    H    TYR  65           H        TYR  65   5.140  -3.030   0.128
  717    HA   TYR  65           HA       TYR  65   5.895  -4.037  -2.536
  718    HB2  TYR  65           2HB      TYR  65   7.549  -3.810  -0.013
  719    HB3  TYR  65           1HB      TYR  65   8.086  -4.629  -1.478
  720    HD1  TYR  65           1HD      TYR  65   8.069  -3.211  -3.650
  721    HD2  TYR  65           2HD      TYR  65   7.992  -1.538   0.260
  722    HE1  TYR  65           1HE      TYR  65   8.874  -1.078  -4.557
  723    HE2  TYR  65           2HE      TYR  65   8.806   0.605  -0.637
  724    HH   TYR  65           HH       TYR  65   9.867   0.908  -3.958
  725    H    THR  66           H        THR  66   6.545  -6.308  -2.623
  726    HA   THR  66           HA       THR  66   5.742  -7.980  -0.405
  727    HB   THR  66           HB       THR  66   3.678  -7.504  -1.849
  728    HG1  THR  66           1HG      THR  66   3.735  -9.198  -0.342
  729   HG21  THR  66          3HG2      THR  66   4.246  -7.757  -4.065
  730   HG22  THR  66          1HG2      THR  66   3.601  -9.364  -3.716
  731   HG23  THR  66          2HG2      THR  66   5.345  -9.095  -3.738
  732    H    LYS  67           H        LYS  67   6.311 -10.192  -0.679
  733    HA   LYS  67           HA       LYS  67   8.028 -10.929  -2.883
  734    HB2  LYS  67           2HB      LYS  67   9.312  -9.646  -0.955
  735    HB3  LYS  67           1HB      LYS  67   9.239 -11.219  -0.170
  736    HG2  LYS  67           2HG      LYS  67  10.120 -11.437  -2.916
  737    HG3  LYS  67           1HG      LYS  67  11.146 -10.351  -1.979
  738    HD2  LYS  67           2HD      LYS  67  10.704 -12.512  -0.291
  739    HD3  LYS  67           1HD      LYS  67  10.934 -13.239  -1.883
  740    HE2  LYS  67           2HE      LYS  67  12.932 -11.465  -1.931
  741    HE3  LYS  67           1HE      LYS  67  12.832 -11.719  -0.191
  742    HZ1  LYS  67           3HZ      LYS  67  12.986 -14.154  -0.670
  743    HZ2  LYS  67           1HZ      LYS  67  14.381 -13.268  -1.057
  744    HZ3  LYS  67           2HZ      LYS  67  13.324 -13.760  -2.286
  745    H    SER  68           H        SER  68   7.734 -12.022   0.487
  746    HA   SER  68           HA       SER  68   7.291 -14.732  -0.306
  747    HB2  SER  68           2HB      SER  68   6.672 -14.337   2.452
  748    HB3  SER  68           1HB      SER  68   8.114 -15.065   1.746
  749    HG   SER  68           HG       SER  68   8.531 -13.215   3.094
  750    H    GLY  69           H        GLY  69   5.256 -12.508  -0.907
  751    HA2  GLY  69           1HA      GLY  69   3.015 -12.820  -1.483
  752    HA3  GLY  69           2HA      GLY  69   2.949 -14.192  -0.390
  753    H    MET  70           H        MET  70   4.365 -11.718   1.270
  754    HA   MET  70           HA       MET  70   1.805 -11.051   2.535
  755    HB2  MET  70           2HB      MET  70   4.582 -10.580   3.638
  756    HB3  MET  70           1HB      MET  70   3.057 -10.452   4.504
  757    HG2  MET  70           2HG      MET  70   2.746 -12.930   3.991
  758    HG3  MET  70           1HG      MET  70   4.453 -12.924   3.545
  759    HE1  MET  70           3HE      MET  70   6.425 -12.778   5.211
  760    HE2  MET  70           1HE      MET  70   5.929 -11.106   5.469
  761    HE3  MET  70           2HE      MET  70   6.274 -12.144   6.852
  762    H    ILE  71           H        ILE  71   1.085  -8.982   2.675
  763    HA   ILE  71           HA       ILE  71   2.398  -6.968   1.068
  764    HB   ILE  71           HB       ILE  71   0.222  -6.049   2.814
  765   HG12  ILE  71          2HG1      ILE  71  -1.304  -7.328   0.928
  766   HG13  ILE  71          1HG1      ILE  71  -0.081  -8.542   1.288
  767   HG21  ILE  71          1HG2      ILE  71   1.242  -5.635   0.121
  768   HG22  ILE  71          2HG2      ILE  71  -0.521  -5.675   0.193
  769   HG23  ILE  71          3HG2      ILE  71   0.377  -4.534   1.193
  770   HD11  ILE  71          3HD1      ILE  71  -0.673  -7.965   3.767
  771   HD12  ILE  71          1HD1      ILE  71  -2.176  -7.386   3.046
  772   HD13  ILE  71          2HD1      ILE  71  -1.681  -9.064   2.826
  773    H    LEU  72           H        LEU  72   3.837  -5.534   1.822
  774    HA   LEU  72           HA       LEU  72   3.915  -5.011   4.712
  775    HB2  LEU  72           2HB      LEU  72   5.988  -6.249   3.007
  776    HB3  LEU  72           1HB      LEU  72   6.555  -4.990   4.087
  777    HG   LEU  72           HG       LEU  72   5.298  -6.340   5.926
  778   HD11  LEU  72          1HD1      LEU  72   4.680  -8.469   5.539
  779   HD12  LEU  72          2HD1      LEU  72   4.482  -7.882   3.888
  780   HD13  LEU  72          3HD1      LEU  72   5.952  -8.741   4.348
  781   HD21  LEU  72          3HD2      LEU  72   7.306  -7.261   6.536
  782   HD22  LEU  72          1HD2      LEU  72   7.704  -7.752   4.888
  783   HD23  LEU  72          2HD2      LEU  72   7.842  -6.057   5.361
  784    H    CYS  73           H        CYS  73   4.708  -2.973   5.290
  785    HA   CYS  73           HA       CYS  73   4.509  -0.949   3.296
  786    HB2  CYS  73           2HB      CYS  73   4.974   0.632   5.070
  787    HB3  CYS  73           1HB      CYS  73   3.844  -0.577   5.658
  788    H    ARG  74           H        ARG  74   6.260   0.765   3.158
  789    HA   ARG  74           HA       ARG  74   8.474  -0.379   1.869
  790    HB2  ARG  74           2HB      ARG  74   8.567   2.435   2.889
  791    HB3  ARG  74           1HB      ARG  74   9.130   1.789   1.353
  792    HG2  ARG  74           2HG      ARG  74   6.695   1.417   0.771
  793    HG3  ARG  74           1HG      ARG  74   6.311   2.398   2.187
  794    HD2  ARG  74           2HD      ARG  74   6.291   3.919   0.412
  795    HD3  ARG  74           1HD      ARG  74   7.871   4.150   1.163
  796    HE   ARG  74           HE       ARG  74   7.774   2.285  -1.060
  797   HH11  ARG  74          2HH1      ARG  74   8.403   5.557  -0.006
  798   HH12  ARG  74          1HH1      ARG  74   9.409   5.946  -1.365
  799   HH21  ARG  74          2HH2      ARG  74   9.098   2.772  -2.847
  800   HH22  ARG  74          1HH2      ARG  74   9.820   4.353  -2.993
  801    H    ASN  75           H        ASN  75   8.032   0.862   5.112
  802    HA   ASN  75           HA       ASN  75  10.819   0.860   5.776
  803    HB2  ASN  75           2HB      ASN  75  10.014   2.202   7.378
  804    HB3  ASN  75           1HB      ASN  75   8.362   1.742   6.985
  805   HD21  ASN  75          1HD2      ASN  75   7.322   0.201   8.212
  806   HD22  ASN  75          2HD2      ASN  75   7.951  -0.373   9.721
  807    H    ASP  76           H        ASP  76   8.105  -1.339   6.261
  808    HA   ASP  76           HA       ASP  76   9.470  -3.053   8.073
  809    HB2  ASP  76           2HB      ASP  76   6.848  -2.884   6.881
  810    HB3  ASP  76           1HB      ASP  76   7.438  -4.544   6.843
  811    H    TYR  77           H        TYR  77   8.731  -3.279   4.608
  812    HA   TYR  77           HA       TYR  77   9.725  -5.860   4.249
  813    HB2  TYR  77           2HB      TYR  77   8.353  -4.878   2.536
  814    HB3  TYR  77           1HB      TYR  77   9.528  -3.589   2.267
  815    HD1  TYR  77           1HD      TYR  77   9.784  -7.302   2.557
  816    HD2  TYR  77           2HD      TYR  77  10.570  -3.841   0.209
  817    HE1  TYR  77           1HE      TYR  77  10.948  -8.693   0.903
  818    HE2  TYR  77           2HE      TYR  77  11.741  -5.226  -1.450
  819    HH   TYR  77           HH       TYR  77  12.964  -8.043  -0.927
  820    H    ILE  78           H        ILE  78  11.375  -2.739   3.856
  821    HA   ILE  78           HA       ILE  78  13.798  -3.853   2.911
  822    HB   ILE  78           HB       ILE  78  13.246  -1.185   4.212
  823   HG12  ILE  78          2HG1      ILE  78  13.786  -1.878   1.317
  824   HG13  ILE  78          1HG1      ILE  78  12.174  -1.701   1.996
  825   HG21  ILE  78          1HG2      ILE  78  15.514  -1.364   4.583
  826   HG22  ILE  78          2HG2      ILE  78  15.781  -2.359   3.151
  827   HG23  ILE  78          3HG2      ILE  78  15.480  -0.628   2.981
  828   HD11  ILE  78          3HD1      ILE  78  12.544   0.360   1.036
  829   HD12  ILE  78          1HD1      ILE  78  12.998   0.642   2.716
  830   HD13  ILE  78          2HD1      ILE  78  14.247   0.387   1.497
  831    H    ARG  79           H        ARG  79  12.663  -3.002   6.146
  832    HA   ARG  79           HA       ARG  79  15.152  -3.467   7.443
  833    HB2  ARG  79           2HB      ARG  79  12.410  -2.806   8.228
  834    HB3  ARG  79           1HB      ARG  79  13.239  -3.833   9.389
  835    HG2  ARG  79           2HG      ARG  79  14.860  -2.239   9.837
  836    HG3  ARG  79           1HG      ARG  79  14.558  -1.364   8.334
  837    HD2  ARG  79           2HD      ARG  79  13.363   0.033   9.601
  838    HD3  ARG  79           1HD      ARG  79  12.131  -1.226   9.591
  839    HE   ARG  79           HE       ARG  79  14.137  -1.376  11.697
  840   HH11  ARG  79          2HH1      ARG  79  10.925  -0.351  10.751
  841   HH12  ARG  79          1HH1      ARG  79  10.313  -0.328  12.380
  842   HH21  ARG  79          2HH2      ARG  79  13.357  -1.333  13.842
  843   HH22  ARG  79          1HH2      ARG  79  11.700  -0.875  14.145
  844    H    LEU  80           H        LEU  80  12.263  -5.448   6.907
  845    HA   LEU  80           HA       LEU  80  13.251  -7.635   8.472
  846    HB2  LEU  80           2HB      LEU  80  10.911  -7.261   6.629
  847    HB3  LEU  80           1HB      LEU  80  11.316  -8.845   7.266
  848    HG   LEU  80           HG       LEU  80  10.764  -6.453   9.020
  849   HD11  LEU  80          1HD1      LEU  80   8.803  -8.644   8.837
  850   HD12  LEU  80          2HD1      LEU  80   8.557  -6.909   9.039
  851   HD13  LEU  80          3HD1      LEU  80   8.894  -7.573   7.440
  852   HD21  LEU  80          3HD2      LEU  80  10.231  -8.944  10.258
  853   HD22  LEU  80          1HD2      LEU  80  11.823  -9.054   9.507
  854   HD23  LEU  80          2HD2      LEU  80  11.484  -7.767  10.664
  855    H    PHE  81           H        PHE  81  12.591  -7.333   4.972
  856    HA   PHE  81           HA       PHE  81  14.251  -9.721   4.560
  857    HB2  PHE  81           2HB      PHE  81  12.338  -8.438   2.601
  858    HB3  PHE  81           1HB      PHE  81  13.115 -10.005   2.446
  859    HD1  PHE  81           1HD      PHE  81  10.568  -8.099   4.311
  860    HD2  PHE  81           2HD      PHE  81  12.169 -11.942   3.422
  861    HE1  PHE  81           1HE      PHE  81   8.604  -9.155   5.349
  862    HE2  PHE  81           2HE      PHE  81  10.200 -13.002   4.456
  863    HZ   PHE  81           HZ       PHE  81   8.420 -11.607   5.426
  864    H    GLY  82           H        GLY  82  13.471  -6.845   2.608
  865    HA2  GLY  82           1HA      GLY  82  14.895  -5.417   1.462
  866    HA3  GLY  82           2HA      GLY  82  16.265  -6.235   2.204
  Start of MODEL   15
    1    H    SER 641           1H       SER 641  -8.508 -11.361 -24.528
    2    HA   SER 641           HA       SER 641  -8.002 -14.017 -25.276
    3    HB2  SER 641           2HB      SER 641  -9.873 -12.610 -26.963
    4    HB3  SER 641           1HB      SER 641 -10.189 -13.820 -25.716
    5    HG   SER 641           HG       SER 641 -10.688 -12.288 -24.344
    6    H    LEU 642           H        LEU 642  -7.812 -10.976 -27.143
    7    HA   LEU 642           HA       LEU 642  -6.446 -12.505 -29.266
    8    HB2  LEU 642           2HB      LEU 642  -8.123 -10.004 -29.466
    9    HB3  LEU 642           1HB      LEU 642  -7.215 -10.696 -30.796
   10    HG   LEU 642           HG       LEU 642  -8.912 -12.709 -29.648
   11   HD11  LEU 642          1HD1      LEU 642 -10.305 -10.875 -28.887
   12   HD12  LEU 642          2HD1      LEU 642 -10.295 -10.172 -30.505
   13   HD13  LEU 642          3HD1      LEU 642 -11.080 -11.728 -30.222
   14   HD21  LEU 642          3HD2      LEU 642  -9.296 -13.208 -31.827
   15   HD22  LEU 642          1HD2      LEU 642  -9.461 -11.519 -32.302
   16   HD23  LEU 642          2HD2      LEU 642  -7.860 -12.210 -32.045
   17    H    GLN 643           H        GLN 643  -4.785 -11.861 -27.367
   18    HA   GLN 643           HA       GLN 643  -3.699  -9.215 -27.607
   19    HB2  GLN 643           2HB      GLN 643  -3.185 -11.612 -25.968
   20    HB3  GLN 643           1HB      GLN 643  -1.771 -10.623 -26.305
   21    HG2  GLN 643           2HG      GLN 643  -2.525  -9.721 -24.335
   22    HG3  GLN 643           1HG      GLN 643  -3.272  -8.660 -25.527
   23   HE21  GLN 643          1HE2      GLN 643  -4.377  -8.572 -23.159
   24   HE22  GLN 643          2HE2      GLN 643  -5.875  -9.442 -23.105
   25    H    ASN 644           H        ASN 644  -3.522  -9.471 -29.990
   26    HA   ASN 644           HA       ASN 644  -1.194 -10.984 -30.895
   27    HB2  ASN 644           2HB      ASN 644  -1.924 -10.472 -33.136
   28    HB3  ASN 644           1HB      ASN 644  -3.323 -11.011 -32.215
   29   HD21  ASN 644          1HD2      ASN 644  -5.009  -9.636 -31.898
   30   HD22  ASN 644          2HD2      ASN 644  -5.112  -8.056 -32.602
   31    H    ASN 645           H        ASN 645  -1.517  -8.241 -29.355
   32    HA   ASN 645           HA       ASN 645   0.511  -6.808 -30.934
   33    HB2  ASN 645           2HB      ASN 645  -2.007  -5.899 -30.638
   34    HB3  ASN 645           1HB      ASN 645  -1.293  -5.244 -29.169
   35   HD21  ASN 645          1HD2      ASN 645  -2.094  -4.413 -32.144
   36   HD22  ASN 645          2HD2      ASN 645  -0.856  -3.243 -32.499
   37    H    GLN 646           H        GLN 646   1.657  -5.148 -29.503
   38    HA   GLN 646           HA       GLN 646   2.536  -6.489 -27.070
   39    HB2  GLN 646           2HB      GLN 646   4.052  -5.365 -28.869
   40    HB3  GLN 646           1HB      GLN 646   3.591  -3.859 -28.087
   41    HG2  GLN 646           2HG      GLN 646   4.359  -5.185 -25.924
   42    HG3  GLN 646           1HG      GLN 646   5.322  -6.056 -27.116
   43   HE21  GLN 646          1HE2      GLN 646   4.813  -3.023 -25.504
   44   HE22  GLN 646          2HE2      GLN 646   6.274  -2.268 -26.045
   45    H    ASP 647           H        ASP 647   2.758  -5.229 -25.048
   46    HA   ASP 647           HA       ASP 647   0.470  -3.589 -24.509
   47    HB2  ASP 647           2HB      ASP 647   1.723  -5.098 -22.833
   48    HB3  ASP 647           1HB      ASP 647   2.898  -3.789 -22.729
   49    H    VAL 648           H        VAL 648   0.351  -1.621 -25.338
   50    HA   VAL 648           HA       VAL 648   2.579  -0.259 -26.398
   51    HB   VAL 648           HB       VAL 648   0.020   1.169 -25.772
   52   HG11  VAL 648          1HG1      VAL 648   0.587   2.555 -27.475
   53   HG12  VAL 648          2HG1      VAL 648   2.205   2.021 -27.025
   54   HG13  VAL 648          3HG1      VAL 648   1.384   1.282 -28.399
   55   HG21  VAL 648          3HG2      VAL 648  -0.383  -1.206 -26.689
   56   HG22  VAL 648          1HG2      VAL 648  -1.173   0.150 -27.496
   57   HG23  VAL 648          2HG2      VAL 648   0.272  -0.575 -28.201
   58    H    SER 649           H        SER 649   4.123   0.581 -25.202
   59    HA   SER 649           HA       SER 649   3.754   1.626 -22.586
   60    HB2  SER 649           2HB      SER 649   6.139   2.603 -23.914
   61    HB3  SER 649           1HB      SER 649   5.997   1.495 -22.548
   62    HG   SER 649           HG       SER 649   6.647   0.947 -25.080
   63    H    PHE 650           H        PHE 650   3.726   3.760 -21.905
   64    HA   PHE 650           HA       PHE 650   2.561   5.605 -23.802
   65    HB2  PHE 650           2HB      PHE 650   3.011   5.665 -20.820
   66    HB3  PHE 650           1HB      PHE 650   2.467   7.092 -21.695
   67    HD1  PHE 650           2HD      PHE 650   1.602   3.494 -21.231
   68    HD2  PHE 650           1HD      PHE 650   0.216   7.455 -21.931
   69    HE1  PHE 650           2HE      PHE 650  -0.720   2.704 -21.061
   70    HE2  PHE 650           1HE      PHE 650  -2.109   6.672 -21.756
   71    HZ   PHE 650           HZ       PHE 650  -2.581   4.294 -21.323
   72    H    GLU 651           H        GLU 651   3.350   7.708 -24.234
   73    HA   GLU 651           HA       GLU 651   6.237   8.015 -24.057
   74    HB2  GLU 651           2HB      GLU 651   4.981  10.387 -25.030
   75    HB3  GLU 651           1HB      GLU 651   5.976   9.240 -25.912
   76    HG2  GLU 651           2HG      GLU 651   4.020   9.291 -27.139
   77    HG3  GLU 651           1HG      GLU 651   3.815   7.860 -26.130
   78    H    ASN 652           H        ASN 652   3.298   9.244 -22.652
   79    HA   ASN 652           HA       ASN 652   4.248  11.359 -21.119
   80    HB2  ASN 652           2HB      ASN 652   2.028   9.382 -20.812
   81    HB3  ASN 652           1HB      ASN 652   2.470  10.337 -19.401
   82   HD21  ASN 652          1HD2      ASN 652   1.903  12.448 -19.299
   83   HD22  ASN 652          2HD2      ASN 652   0.994  13.263 -20.533
   84    H    ILE 653           H        ILE 653   4.068   7.909 -20.279
   85    HA   ILE 653           HA       ILE 653   6.124   8.358 -18.233
   86    HB   ILE 653           HB       ILE 653   4.915   5.673 -18.457
   87   HG12  ILE 653          2HG1      ILE 653   3.272   7.788 -17.096
   88   HG13  ILE 653          1HG1      ILE 653   3.040   7.455 -18.809
   89   HG21  ILE 653          1HG2      ILE 653   6.542   6.798 -16.697
   90   HG22  ILE 653          2HG2      ILE 653   5.013   7.254 -15.950
   91   HG23  ILE 653          3HG2      ILE 653   5.384   5.553 -16.231
   92   HD11  ILE 653          3HD1      ILE 653   2.913   5.305 -16.725
   93   HD12  ILE 653          1HD1      ILE 653   1.508   6.265 -17.193
   94   HD13  ILE 653          2HD1      ILE 653   2.328   5.259 -18.388
   95    H    GLN 654           H        GLN 654   7.629   8.606 -20.061
   96    HA   GLN 654           HA       GLN 654   8.218   6.306 -21.681
   97    HB2  GLN 654           2HB      GLN 654   9.033   9.100 -21.550
   98    HB3  GLN 654           1HB      GLN 654  10.389   8.026 -21.873
   99    HG2  GLN 654           2HG      GLN 654   7.830   8.158 -23.456
  100    HG3  GLN 654           1HG      GLN 654   9.381   8.851 -23.930
  101   HE21  GLN 654          1HE2      GLN 654   7.535   5.938 -23.557
  102   HE22  GLN 654          2HE2      GLN 654   8.640   4.885 -24.381
  103    H    TRP 655           H        TRP 655   8.344   5.147 -19.447
  104    HA   TRP 655           HA       TRP 655  11.040   5.331 -18.320
  105    HB2  TRP 655           2HB      TRP 655  10.202   4.184 -16.394
  106    HB3  TRP 655           1HB      TRP 655   9.032   5.430 -16.804
  107    HD1  TRP 655           HD       TRP 655   6.958   4.316 -18.541
  108    HE1  TRP 655           1HE      TRP 655   5.599   2.183 -18.060
  109    HE3  TRP 655           3HE      TRP 655  10.143   2.086 -15.226
  110    HZ2  TRP 655           2HZ      TRP 655   5.855  -0.139 -16.472
  111    HZ3  TRP 655           3HZ      TRP 655   9.507  -0.091 -14.267
  112    HH2  TRP 655           HH       TRP 655   7.403  -1.179 -14.879
  113    H    SER 656           H        SER 656  12.383   3.548 -18.144
  114    HA   SER 656           HA       SER 656  11.621   1.218 -19.771
  115    HB2  SER 656           2HB      SER 656  14.373   1.088 -19.282
  116    HB3  SER 656           1HB      SER 656  13.594   1.588 -20.786
  117    HG   SER 656           HG       SER 656  13.593   3.741 -19.952
  118    H    ILE 657           H        ILE 657  12.641  -0.869 -18.963
  119    HA   ILE 657           HA       ILE 657  11.961  -1.173 -16.188
  120    HB   ILE 657           HB       ILE 657  13.011  -3.110 -18.246
  121   HG12  ILE 657          2HG1      ILE 657  10.610  -2.157 -18.243
  122   HG13  ILE 657          1HG1      ILE 657  10.809  -3.900 -18.388
  123   HG21  ILE 657          1HG2      ILE 657  12.067  -3.894 -15.502
  124   HG22  ILE 657          2HG2      ILE 657  12.875  -4.890 -16.712
  125   HG23  ILE 657          3HG2      ILE 657  13.771  -3.625 -15.874
  126   HD11  ILE 657          3HD1      ILE 657   9.056  -2.809 -16.739
  127   HD12  ILE 657          1HD1      ILE 657   9.904  -4.302 -16.341
  128   HD13  ILE 657          2HD1      ILE 657  10.458  -2.769 -15.668
  129    H    ASP 658           H        ASP 658  13.314  -0.384 -14.746
  130    HA   ASP 658           HA       ASP 658  16.135  -0.238 -15.039
  131    HB2  ASP 658           2HB      ASP 658  14.269   0.828 -13.286
  132    HB3  ASP 658           1HB      ASP 658  15.166  -0.300 -12.274
  133    HA   PRO 659           HA       PRO 659  17.019  -4.509 -14.257
  134    HB2  PRO 659           2HB      PRO 659  19.764  -3.632 -13.659
  135    HB3  PRO 659           1HB      PRO 659  19.172  -4.669 -14.960
  136    HG2  PRO 659           2HG      PRO 659  20.044  -2.173 -15.435
  137    HG3  PRO 659           1HG      PRO 659  18.703  -2.890 -16.351
  138    HD2  PRO 659           2HD      PRO 659  18.616  -0.940 -14.073
  139    HD3  PRO 659           1HD      PRO 659  17.672  -0.958 -15.579
  140    H    GLY 660           H        GLY 660  15.714  -3.923 -12.155
  141    HA2  GLY 660           1HA      GLY 660  15.465  -4.536  -9.954
  142    HA3  GLY 660           2HA      GLY 660  17.027  -5.329 -10.079
  143    H    ALA 661           H        ALA 661  16.452  -1.892 -10.584
  144    HA   ALA 661           HA       ALA 661  18.500  -1.234  -8.683
  145    HB1  ALA 661           1HB      ALA 661  18.504   0.242 -10.450
  146    HB2  ALA 661           2HB      ALA 661  16.743   0.334 -10.518
  147    HB3  ALA 661           3HB      ALA 661  17.620   1.159  -9.229
  148    H    ASP 662           H        ASP 662  15.076  -0.256  -8.892
  149    HA   ASP 662           HA       ASP 662  15.047   0.000  -5.967
  150    HB2  ASP 662           2HB      ASP 662  14.233   1.857  -7.684
  151    HB3  ASP 662           1HB      ASP 662  12.751   0.907  -7.661
  152    H    LEU 663           H        LEU 663  12.420  -0.320  -5.389
  153    HA   LEU 663           HA       LEU 663  12.033  -3.177  -5.984
  154    HB2  LEU 663           2HB      LEU 663  10.776  -1.605  -3.740
  155    HB3  LEU 663           1HB      LEU 663  10.849  -3.348  -3.914
  156    HG   LEU 663           HG       LEU 663  13.381  -1.764  -3.659
  157   HD11  LEU 663          1HD1      LEU 663  11.451  -1.470  -1.790
  158   HD12  LEU 663          2HD1      LEU 663  12.278  -2.908  -1.189
  159   HD13  LEU 663          3HD1      LEU 663  13.180  -1.415  -1.450
  160   HD21  LEU 663          3HD2      LEU 663  13.047  -4.370  -2.359
  161   HD22  LEU 663          1HD2      LEU 663  12.890  -4.402  -4.116
  162   HD23  LEU 663          2HD2      LEU 663  14.356  -3.763  -3.372
  163    H    SER 664           H        SER 664  11.234  -0.864  -7.629
  164    HA   SER 664           HA       SER 664   8.508  -0.314  -7.474
  165    HB2  SER 664           2HB      SER 664   9.684  -0.401 -10.176
  166    HB3  SER 664           1HB      SER 664   8.918   0.939  -9.316
  167    HG   SER 664           HG       SER 664  11.379   0.874  -9.755
  168    H    GLN 665           H        GLN 665  10.187  -3.083  -8.763
  169    HA   GLN 665           HA       GLN 665   7.885  -4.056 -10.213
  170    HB2  GLN 665           2HB      GLN 665  10.699  -4.847  -9.879
  171    HB3  GLN 665           1HB      GLN 665   9.582  -6.197 -10.027
  172    HG2  GLN 665           2HG      GLN 665  10.504  -5.536 -12.184
  173    HG3  GLN 665           1HG      GLN 665   8.756  -5.324 -12.127
  174   HE21  GLN 665          1HE2      GLN 665   8.305  -3.670 -13.400
  175   HE22  GLN 665          2HE2      GLN 665   9.085  -2.124 -13.352
  176    H    TYR 666           H        TYR 666   9.065  -4.217  -7.008
  177    HA   TYR 666           HA       TYR 666   7.584  -6.643  -6.352
  178    HB2  TYR 666           2HB      TYR 666   9.415  -4.835  -4.777
  179    HB3  TYR 666           1HB      TYR 666   8.431  -6.066  -3.988
  180    HD1  TYR 666           1HD      TYR 666   8.773  -8.481  -4.633
  181    HD2  TYR 666           2HD      TYR 666  11.444  -5.394  -5.837
  182    HE1  TYR 666           1HE      TYR 666  10.498 -10.166  -5.117
  183    HE2  TYR 666           2HE      TYR 666  13.173  -7.071  -6.323
  184    HH   TYR 666           HH       TYR 666  13.762  -9.221  -6.118
  185    H    LYS 667           H        LYS 667   7.241  -3.246  -6.328
  186    HA   LYS 667           HA       LYS 667   5.169  -3.141  -4.347
  187    HB2  LYS 667           2HB      LYS 667   5.621  -0.958  -4.413
  188    HB3  LYS 667           1HB      LYS 667   6.788  -1.268  -5.679
  189    HG2  LYS 667           2HG      LYS 667   4.353  -1.201  -7.004
  190    HG3  LYS 667           1HG      LYS 667   4.244   0.090  -5.808
  191    HD2  LYS 667           2HD      LYS 667   6.091   1.217  -6.686
  192    HD3  LYS 667           1HD      LYS 667   6.673  -0.213  -7.538
  193    HE2  LYS 667           2HE      LYS 667   4.022   0.972  -8.250
  194    HE3  LYS 667           1HE      LYS 667   5.504   1.709  -8.856
  195    HZ1  LYS 667           3HZ      LYS 667   4.199  -0.286 -10.075
  196    HZ2  LYS 667           1HZ      LYS 667   5.351  -1.164  -9.186
  197    HZ3  LYS 667           2HZ      LYS 667   5.855   0.031 -10.278
  198    H    MET 668           H        MET 668   3.019  -3.096  -4.639
  199    HA   MET 668           HA       MET 668   1.994  -3.923  -7.236
  200    HB2  MET 668           2HB      MET 668   0.605  -3.538  -4.581
  201    HB3  MET 668           1HB      MET 668  -0.154  -4.186  -6.030
  202    HG2  MET 668           2HG      MET 668   0.816  -6.207  -5.791
  203    HG3  MET 668           1HG      MET 668   2.294  -5.538  -5.100
  204    HE1  MET 668           3HE      MET 668   0.577  -4.507  -1.530
  205    HE2  MET 668           1HE      MET 668   1.871  -4.055  -2.643
  206    HE3  MET 668           2HE      MET 668   0.197  -3.640  -3.018
  207    H    ASP 669           H        ASP 669   1.174  -2.506  -8.650
  208    HA   ASP 669           HA       ASP 669   1.057   0.271  -7.988
  209    HB2  ASP 669           2HB      ASP 669   0.768  -1.355 -10.411
  210    HB3  ASP 669           1HB      ASP 669  -0.283   0.059 -10.379
  211    H    VAL 670           H        VAL 670  -0.501   1.196  -6.876
  212    HA   VAL 670           HA       VAL 670  -2.899  -0.327  -6.343
  213    HB   VAL 670           HB       VAL 670  -2.268   2.385  -5.196
  214   HG11  VAL 670          1HG1      VAL 670  -3.440   0.905  -3.242
  215   HG12  VAL 670          2HG1      VAL 670  -4.309   1.971  -4.347
  216   HG13  VAL 670          3HG1      VAL 670  -4.209   0.243  -4.685
  217   HG21  VAL 670          3HG2      VAL 670  -0.378   0.618  -4.992
  218   HG22  VAL 670          1HG2      VAL 670  -0.898   1.488  -3.548
  219   HG23  VAL 670          2HG2      VAL 670  -1.460  -0.159  -3.837
  220    H    THR 671           H        THR 671  -4.432  -0.202  -7.808
  221    HA   THR 671           HA       THR 671  -5.134   2.350  -9.022
  222    HB   THR 671           HB       THR 671  -6.741  -0.161  -9.425
  223    HG1  THR 671           1HG      THR 671  -4.177  -0.229  -9.670
  224   HG21  THR 671          3HG2      THR 671  -7.265   0.770 -11.497
  225   HG22  THR 671          1HG2      THR 671  -5.851   1.823 -11.496
  226   HG23  THR 671          2HG2      THR 671  -7.213   2.176 -10.432
  227    H    VAL 672           H        VAL 672  -6.407   3.690  -7.892
  228    HA   VAL 672           HA       VAL 672  -8.070   2.590  -5.760
  229    HB   VAL 672           HB       VAL 672  -7.724   5.512  -6.412
  230   HG11  VAL 672          1HG1      VAL 672  -9.018   3.969  -4.317
  231   HG12  VAL 672          2HG1      VAL 672  -7.893   5.168  -3.678
  232   HG13  VAL 672          3HG1      VAL 672  -9.204   5.670  -4.750
  233   HG21  VAL 672          3HG2      VAL 672  -5.636   5.557  -5.628
  234   HG22  VAL 672          1HG2      VAL 672  -6.070   4.574  -4.229
  235   HG23  VAL 672          2HG2      VAL 672  -5.635   3.799  -5.753
  236    H    ILE 673           H        ILE 673 -10.077   2.023  -6.240
  237    HA   ILE 673           HA       ILE 673 -11.420   3.116  -8.563
  238    HB   ILE 673           HB       ILE 673 -12.219   0.982  -6.584
  239   HG12  ILE 673          2HG1      ILE 673 -12.175  -0.078  -9.142
  240   HG13  ILE 673          1HG1      ILE 673 -10.808   1.032  -9.145
  241   HG21  ILE 673          1HG2      ILE 673 -14.043   2.512  -7.798
  242   HG22  ILE 673          2HG2      ILE 673 -13.754   1.340  -9.084
  243   HG23  ILE 673          3HG2      ILE 673 -14.286   0.791  -7.494
  244   HD11  ILE 673          3HD1      ILE 673 -10.590  -1.488  -8.376
  245   HD12  ILE 673          1HD1      ILE 673  -9.632  -0.198  -7.647
  246   HD13  ILE 673          2HD1      ILE 673 -11.077  -0.794  -6.831
  247    H    ASP 674           H        ASP 674 -12.829   4.731  -8.525
  248    HA   ASP 674           HA       ASP 674 -13.574   5.816  -5.931
  249    HB2  ASP 674           2HB      ASP 674 -13.669   7.874  -6.892
  250    HB3  ASP 674           1HB      ASP 674 -12.598   7.109  -8.050
  251    H    THR 675           H        THR 675 -15.431   5.386  -5.044
  252    HA   THR 675           HA       THR 675 -17.420   3.902  -6.528
  253    HB   THR 675           HB       THR 675 -18.352   4.325  -3.921
  254    HG1  THR 675           1HG      THR 675 -16.181   3.431  -2.972
  255   HG21  THR 675          3HG2      THR 675 -17.735   2.205  -5.630
  256   HG22  THR 675          1HG2      THR 675 -18.518   2.101  -4.052
  257   HG23  THR 675          2HG2      THR 675 -16.769   1.918  -4.181
  258    H    LYS 676           H        LYS 676 -17.831   5.958  -7.812
  259    HA   LYS 676           HA       LYS 676 -19.403   8.010  -6.573
  260    HB2  LYS 676           2HB      LYS 676 -19.977   8.177  -9.251
  261    HB3  LYS 676           1HB      LYS 676 -18.633   8.979  -8.451
  262    HG2  LYS 676           2HG      LYS 676 -17.093   7.603  -9.354
  263    HG3  LYS 676           1HG      LYS 676 -18.165   6.203  -9.323
  264    HD2  LYS 676           2HD      LYS 676 -19.297   6.933 -11.286
  265    HD3  LYS 676           1HD      LYS 676 -18.485   8.500 -11.242
  266    HE2  LYS 676           2HE      LYS 676 -17.674   6.508 -12.820
  267    HE3  LYS 676           1HE      LYS 676 -16.557   7.676 -12.118
  268    HZ1  LYS 676           3HZ      LYS 676 -17.196   5.154 -10.714
  269    HZ2  LYS 676           1HZ      LYS 676 -15.841   6.164 -10.523
  270    HZ3  LYS 676           2HZ      LYS 676 -16.001   5.203 -11.915
  271    H    ASP 677           H        ASP 677 -20.025   4.885  -7.756
  272    HA   ASP 677           HA       ASP 677 -22.808   5.333  -8.354
  273    HB2  ASP 677           2HB      ASP 677 -21.091   3.633  -9.439
  274    HB3  ASP 677           1HB      ASP 677 -21.598   2.609  -8.101
  275    H    GLY 678           H        GLY 678 -24.178   3.396  -7.406
  276    HA2  GLY 678           1HA      GLY 678 -25.009   2.260  -5.543
  277    HA3  GLY 678           2HA      GLY 678 -23.644   2.852  -4.610
  278    H    SER 679           H        SER 679 -23.776   5.492  -4.718
  279    HA   SER 679           HA       SER 679 -26.095   6.065  -3.107
  280    HB2  SER 679           2HB      SER 679 -24.504   8.392  -3.582
  281    HB3  SER 679           1HB      SER 679 -24.636   7.434  -2.107
  282    HG   SER 679           HG       SER 679 -22.483   7.672  -3.278
  283    H    GLN 680           H        GLN 680 -25.679   6.034  -6.350
  284    HA   GLN 680           HA       GLN 680 -26.919   8.599  -6.943
  285    HB2  GLN 680           2HB      GLN 680 -25.759   6.395  -8.626
  286    HB3  GLN 680           1HB      GLN 680 -26.730   7.672  -9.348
  287    HG2  GLN 680           2HG      GLN 680 -25.157   9.335  -8.403
  288    HG3  GLN 680           1HG      GLN 680 -24.163   8.004  -7.813
  289   HE21  GLN 680          1HE2      GLN 680 -22.384   8.379  -9.021
  290   HE22  GLN 680          2HE2      GLN 680 -22.341   8.280 -10.753
  291    H    SER 681           H        SER 681 -28.505   6.818  -5.428
  292    HA   SER 681           HA       SER 681 -30.310   5.339  -7.023
  293    HB2  SER 681           2HB      SER 681 -31.278   6.375  -4.433
  294    HB3  SER 681           1HB      SER 681 -31.223   4.721  -5.042
  295    HG   SER 681           HG       SER 681 -29.191   4.498  -4.351
  296    H    LYS 682           H        LYS 682 -30.076   8.707  -6.304
  297    HA   LYS 682           HA       LYS 682 -32.854   9.313  -6.715
  298    HB2  LYS 682           2HB      LYS 682 -30.361  10.975  -6.474
  299    HB3  LYS 682           1HB      LYS 682 -31.894  11.702  -6.935
  300    HG2  LYS 682           2HG      LYS 682 -32.247  10.047  -4.619
  301    HG3  LYS 682           1HG      LYS 682 -30.942  11.206  -4.355
  302    HD2  LYS 682           2HD      LYS 682 -32.400  12.871  -4.124
  303    HD3  LYS 682           1HD      LYS 682 -33.149  12.485  -5.675
  304    HE2  LYS 682           2HE      LYS 682 -34.400  10.654  -4.468
  305    HE3  LYS 682           1HE      LYS 682 -33.815  11.361  -2.962
  306    HZ1  LYS 682           3HZ      LYS 682 -35.750  12.431  -4.896
  307    HZ2  LYS 682           1HZ      LYS 682 -34.814  13.520  -3.994
  308    HZ3  LYS 682           2HZ      LYS 682 -35.816  12.406  -3.199
  309    H    LEU 683           H        LEU 683 -30.303   8.527  -8.759
  310    HA   LEU 683           HA       LEU 683 -31.163  10.094 -11.020
  311    HB2  LEU 683           2HB      LEU 683 -28.879   8.563 -10.332
  312    HB3  LEU 683           1HB      LEU 683 -29.556   7.849 -11.781
  313    HG   LEU 683           HG       LEU 683 -28.842   9.528 -13.085
  314   HD11  LEU 683          1HD1      LEU 683 -28.943  11.939 -12.400
  315   HD12  LEU 683          2HD1      LEU 683 -30.498  11.103 -12.423
  316   HD13  LEU 683          3HD1      LEU 683 -29.681  11.408 -10.889
  317   HD21  LEU 683          3HD2      LEU 683 -27.069  11.008 -11.688
  318   HD22  LEU 683          1HD2      LEU 683 -27.236   9.610 -10.627
  319   HD23  LEU 683          2HD2      LEU 683 -26.739   9.388 -12.306
  320    H    GLY 684           H        GLY 684 -31.149   6.632 -10.203
  321    HA2  GLY 684           1HA      GLY 684 -32.874   5.096 -10.605
  322    HA3  GLY 684           2HA      GLY 684 -33.681   6.298 -11.606
  323    H    GLY 685           H        GLY 685 -32.872   6.664 -13.752
  324    HA2  GLY 685           1HA      GLY 685 -31.202   5.964 -15.444
  325    HA3  GLY 685           2HA      GLY 685 -31.389   4.338 -14.807
  326    H    GLY 901           H        GLY 901 -31.857   5.596 -17.508
  327    HA2  GLY 901           1HA      GLY 901 -34.658   5.536 -18.013
  328    HA3  GLY 901           2HA      GLY 901 -33.386   5.465 -19.226
  329    H    GLY 902           H        GLY 902 -35.771   3.723 -17.547
  330    HA2  GLY 902           1HA      GLY 902 -36.539   1.620 -18.417
  331    HA3  GLY 902           2HA      GLY 902 -34.880   1.243 -18.864
  332    H    SER 903           H        SER 903 -34.641   2.651 -15.944
  333    HA   SER 903           HA       SER 903 -34.649   0.054 -14.578
  334    HB2  SER 903           2HB      SER 903 -33.331   2.536 -13.506
  335    HB3  SER 903           1HB      SER 903 -32.933   0.847 -13.191
  336    HG   SER 903           HG       SER 903 -32.646   1.133 -15.760
  337    H    GLY 904           H        GLY 904 -37.046   0.413 -14.509
  338    HA2  GLY 904           1HA      GLY 904 -37.785   2.185 -12.266
  339    HA3  GLY 904           2HA      GLY 904 -38.875   1.718 -13.562
  340    H    GLY 905           H        GLY 905 -36.848  -0.778 -12.467
  341    HA2  GLY 905           1HA      GLY 905 -39.082  -1.921 -10.913
  342    HA3  GLY 905           2HA      GLY 905 -37.848  -2.858 -11.749
  343    H    HIS 906           H        HIS 906 -36.867  -3.957 -10.149
  344    HA   HIS 906           HA       HIS 906 -35.625  -2.335  -8.025
  345    HB2  HIS 906           2HB      HIS 906 -37.528  -4.001  -7.364
  346    HB3  HIS 906           1HB      HIS 906 -36.294  -5.231  -7.615
  347    HD1  HIS 906           1HD      HIS 906 -37.256  -2.451  -5.302
  348    HD2  HIS 906           2HD      HIS 906 -34.235  -5.277  -5.715
  349    HE1  HIS 906           1HE      HIS 906 -35.959  -2.430  -3.128
  350    H    MET 907           H        MET 907 -33.475  -2.563  -7.784
  351    HA   MET 907           HA       MET 907 -32.109  -4.417  -9.573
  352    HB2  MET 907           2HB      MET 907 -31.541  -1.838  -8.733
  353    HB3  MET 907           1HB      MET 907 -30.419  -2.821  -7.801
  354    HG2  MET 907           2HG      MET 907 -30.508  -3.636 -10.571
  355    HG3  MET 907           1HG      MET 907 -30.095  -1.932 -10.402
  356    HE1  MET 907           3HE      MET 907 -27.458  -5.401 -10.164
  357    HE2  MET 907           1HE      MET 907 -29.067  -5.166 -10.851
  358    HE3  MET 907           2HE      MET 907 -27.687  -4.290 -11.514
  359    H    GLY 908           H        GLY 908 -32.707  -6.338  -8.505
  360    HA2  GLY 908           1HA      GLY 908 -32.360  -6.812  -5.750
  361    HA3  GLY 908           2HA      GLY 908 -32.539  -8.042  -6.990
  362    H    SER 909           H        SER 909 -30.752  -7.628  -4.559
  363    HA   SER 909           HA       SER 909 -28.094  -7.451  -5.545
  364    HB2  SER 909           2HB      SER 909 -28.304  -8.917  -3.066
  365    HB3  SER 909           1HB      SER 909 -27.646  -7.303  -3.346
  366    HG   SER 909           HG       SER 909 -29.469  -7.308  -1.910
  367    H    GLY 910           H        GLY 910 -27.613  -8.915  -7.112
  368    HA2  GLY 910           1HA      GLY 910 -28.214 -11.731  -6.767
  369    HA3  GLY 910           2HA      GLY 910 -27.368 -10.996  -8.124
  370    H    GLY 911           H        GLY 911 -27.052 -12.100  -4.813
  371    HA2  GLY 911           1HA      GLY 911 -25.108 -13.346  -4.128
  372    HA3  GLY 911           2HA      GLY 911 -24.153 -12.385  -5.253
  373    H    LEU  18           H        LEU  18 -25.147 -12.743  -2.063
  374    HA   LEU  18           HA       LEU  18 -24.929  -9.970  -1.300
  375    HB2  LEU  18           2HB      LEU  18 -26.045 -12.271  -0.193
  376    HB3  LEU  18           1HB      LEU  18 -24.723 -11.856   0.882
  377    HG   LEU  18           HG       LEU  18 -25.940  -9.426   0.529
  378   HD11  LEU  18          1HD1      LEU  18 -28.173  -9.567   0.266
  379   HD12  LEU  18          2HD1      LEU  18 -27.763 -11.059  -0.583
  380   HD13  LEU  18          3HD1      LEU  18 -28.280 -11.116   1.101
  381   HD21  LEU  18          3HD2      LEU  18 -25.140 -10.509   2.617
  382   HD22  LEU  18          1HD2      LEU  18 -26.696  -9.694   2.788
  383   HD23  LEU  18          2HD2      LEU  18 -26.629 -11.450   2.647
  384    H    SER  19           H        SER  19 -22.623 -11.792  -2.404
  385    HA   SER  19           HA       SER  19 -20.633 -11.223  -0.351
  386    HB2  SER  19           2HB      SER  19 -19.558 -12.227  -2.852
  387    HB3  SER  19           1HB      SER  19 -19.496 -12.947  -1.243
  388    HG   SER  19           HG       SER  19 -20.732 -14.373  -2.218
  389    H    TRP  20           H        TRP  20 -21.809 -10.081  -3.399
  390    HA   TRP  20           HA       TRP  20 -21.035  -8.609  -4.959
  391    HB2  TRP  20           2HB      TRP  20 -20.138  -6.551  -3.136
  392    HB3  TRP  20           1HB      TRP  20 -21.525  -6.565  -4.209
  393    HD1  TRP  20           HD       TRP  20 -23.735  -8.016  -3.079
  394    HE1  TRP  20           1HE      TRP  20 -24.626  -7.791  -0.675
  395    HE3  TRP  20           3HE      TRP  20 -19.597  -6.001  -0.863
  396    HZ2  TRP  20           2HZ      TRP  20 -23.701  -6.873   1.830
  397    HZ3  TRP  20           3HZ      TRP  20 -19.682  -5.471   1.532
  398    HH2  TRP  20           HH       TRP  20 -21.693  -5.897   2.852
  399    H    LYS  21           H        LYS  21 -18.812  -7.062  -2.869
  400    HA   LYS  21           HA       LYS  21 -16.575  -8.224  -4.380
  401    HB2  LYS  21           2HB      LYS  21 -16.472  -5.647  -2.814
  402    HB3  LYS  21           1HB      LYS  21 -15.358  -6.209  -4.052
  403    HG2  LYS  21           2HG      LYS  21 -18.147  -5.856  -4.920
  404    HG3  LYS  21           1HG      LYS  21 -17.289  -4.382  -4.469
  405    HD2  LYS  21           2HD      LYS  21 -15.728  -4.617  -6.157
  406    HD3  LYS  21           1HD      LYS  21 -15.970  -6.361  -6.279
  407    HE2  LYS  21           2HE      LYS  21 -18.272  -4.612  -6.940
  408    HE3  LYS  21           1HE      LYS  21 -16.926  -4.643  -8.079
  409    HZ1  LYS  21           3HZ      LYS  21 -17.960  -6.434  -8.896
  410    HZ2  LYS  21           1HZ      LYS  21 -18.899  -6.671  -7.501
  411    HZ3  LYS  21           2HZ      LYS  21 -17.311  -7.259  -7.566
  412    H    ARG  22           H        ARG  22 -16.155 -10.001  -3.107
  413    HA   ARG  22           HA       ARG  22 -15.921  -9.849  -0.268
  414    HB2  ARG  22           2HB      ARG  22 -15.828 -11.899  -2.265
  415    HB3  ARG  22           1HB      ARG  22 -14.407 -12.047  -1.240
  416    HG2  ARG  22           2HG      ARG  22 -16.773 -11.589   0.343
  417    HG3  ARG  22           1HG      ARG  22 -16.976 -12.986  -0.714
  418    HD2  ARG  22           2HD      ARG  22 -15.739 -12.996   1.732
  419    HD3  ARG  22           1HD      ARG  22 -15.556 -14.227   0.485
  420    HE   ARG  22           HE       ARG  22 -13.703 -11.949   0.832
  421   HH11  ARG  22          2HH1      ARG  22 -14.331 -15.324   0.180
  422   HH12  ARG  22          1HH1      ARG  22 -12.666 -15.704  -0.153
  423   HH21  ARG  22          2HH2      ARG  22 -11.520 -12.432   0.406
  424   HH22  ARG  22          1HH2      ARG  22 -11.070 -14.045  -0.075
  425    H    CYS  23           H        CYS  23 -14.174  -9.477   0.977
  426    HA   CYS  23           HA       CYS  23 -11.940  -8.251  -0.399
  427    HB2  CYS  23           2HB      CYS  23 -11.617  -7.001   1.497
  428    HB3  CYS  23           1HB      CYS  23 -13.342  -7.300   1.581
  429    H    ALA  24           H        ALA  24  -9.711  -8.650   0.356
  430    HA   ALA  24           HA       ALA  24  -9.365 -11.504   0.061
  431    HB1  ALA  24           1HB      ALA  24  -8.157  -9.427  -1.117
  432    HB2  ALA  24           2HB      ALA  24  -6.987  -9.770   0.158
  433    HB3  ALA  24           3HB      ALA  24  -7.434 -11.031  -0.993
  434    H    GLY  25           H        GLY  25  -7.902  -9.041   2.224
  435    HA2  GLY  25           1HA      GLY  25  -6.297 -10.918   3.606
  436    HA3  GLY  25           2HA      GLY  25  -6.665  -9.287   4.142
  437    H    CYS  26           H        CYS  26  -8.999  -9.070   4.988
  438    HA   CYS  26           HA       CYS  26  -9.336 -10.742   7.205
  439    HB2  CYS  26           2HB      CYS  26 -11.732  -9.334   6.181
  440    HB3  CYS  26           1HB      CYS  26 -11.016  -9.319   7.788
  441    H    GLY  27           H        GLY  27 -10.814 -10.770   4.005
  442    HA2  GLY  27           1HA      GLY  27 -11.663 -12.637   2.890
  443    HA3  GLY  27           2HA      GLY  27 -11.597 -13.540   4.398
  444    H    GLY  28           H        GLY  28 -13.067 -10.392   4.091
  445    HA2  GLY  28           1HA      GLY  28 -15.686 -11.668   4.584
  446    HA3  GLY  28           2HA      GLY  28 -15.206 -10.117   5.265
  447    H    LYS  29           H        LYS  29 -16.898  -8.980   4.341
  448    HA   LYS  29           HA       LYS  29 -16.773  -8.740   1.408
  449    HB2  LYS  29           2HB      LYS  29 -19.022  -8.554   3.366
  450    HB3  LYS  29           1HB      LYS  29 -19.093  -7.562   1.916
  451    HG2  LYS  29           2HG      LYS  29 -20.161  -9.390   1.127
  452    HG3  LYS  29           1HG      LYS  29 -18.505  -9.877   0.767
  453    HD2  LYS  29           2HD      LYS  29 -19.216 -11.758   1.836
  454    HD3  LYS  29           1HD      LYS  29 -18.645 -10.838   3.229
  455    HE2  LYS  29           2HE      LYS  29 -20.814 -10.242   3.870
  456    HE3  LYS  29           1HE      LYS  29 -21.488 -10.651   2.292
  457    HZ1  LYS  29           3HZ      LYS  29 -22.070 -12.553   3.272
  458    HZ2  LYS  29           1HZ      LYS  29 -21.007 -12.333   4.578
  459    HZ3  LYS  29           2HZ      LYS  29 -20.438 -12.998   3.125
  460    H    ILE  30           H        ILE  30 -16.194  -6.780   0.566
  461    HA   ILE  30           HA       ILE  30 -15.239  -4.766   2.330
  462    HB   ILE  30           HB       ILE  30 -15.773  -4.653  -0.646
  463   HG12  ILE  30          2HG1      ILE  30 -13.031  -4.510   0.443
  464   HG13  ILE  30          1HG1      ILE  30 -13.849  -6.056   0.657
  465   HG21  ILE  30          1HG2      ILE  30 -15.732  -2.437   0.784
  466   HG22  ILE  30          2HG2      ILE  30 -13.988  -2.697   0.714
  467   HG23  ILE  30          3HG2      ILE  30 -14.917  -2.535  -0.778
  468   HD11  ILE  30          3HD1      ILE  30 -13.286  -6.581  -1.411
  469   HD12  ILE  30          1HD1      ILE  30 -14.312  -5.271  -1.999
  470   HD13  ILE  30          2HD1      ILE  30 -12.604  -4.975  -1.670
  471    H    ALA  31           H        ALA  31 -16.643  -3.782   3.604
  472    HA   ALA  31           HA       ALA  31 -19.110  -2.739   2.416
  473    HB1  ALA  31           1HB      ALA  31 -19.016  -2.477   5.277
  474    HB2  ALA  31           2HB      ALA  31 -20.166  -3.363   4.274
  475    HB3  ALA  31           3HB      ALA  31 -18.673  -4.139   4.801
  476    H    ASP  32           H        ASP  32 -16.171  -1.788   2.649
  477    HA   ASP  32           HA       ASP  32 -16.556   0.803   3.892
  478    HB2  ASP  32           2HB      ASP  32 -14.345  -0.773   3.513
  479    HB3  ASP  32           1HB      ASP  32 -14.152   0.438   2.247
  480    H    ARG  33           H        ARG  33 -15.375   2.606   2.328
  481    HA   ARG  33           HA       ARG  33 -17.347   2.869   0.218
  482    HB2  ARG  33           2HB      ARG  33 -16.930   4.773   1.677
  483    HB3  ARG  33           1HB      ARG  33 -15.234   4.791   1.210
  484    HG2  ARG  33           2HG      ARG  33 -15.869   6.340  -0.266
  485    HG3  ARG  33           1HG      ARG  33 -16.466   4.975  -1.212
  486    HD2  ARG  33           2HD      ARG  33 -18.505   5.516   0.593
  487    HD3  ARG  33           1HD      ARG  33 -17.923   7.105   0.093
  488    HE   ARG  33           HE       ARG  33 -18.179   5.926  -2.267
  489   HH11  ARG  33          2HH1      ARG  33 -20.364   5.934   0.476
  490   HH12  ARG  33          1HH1      ARG  33 -21.793   5.781  -0.506
  491   HH21  ARG  33          2HH2      ARG  33 -20.051   5.730  -3.554
  492   HH22  ARG  33          1HH2      ARG  33 -21.614   5.669  -2.795
  493    H    PHE  34           H        PHE  34 -13.798   3.312   0.368
  494    HA   PHE  34           HA       PHE  34 -13.754   3.021  -2.545
  495    HB2  PHE  34           2HB      PHE  34 -12.116   4.438  -0.546
  496    HB3  PHE  34           1HB      PHE  34 -11.216   3.712  -1.873
  497    HD1  PHE  34           2HD      PHE  34 -14.512   5.468  -1.654
  498    HD2  PHE  34           1HD      PHE  34 -10.641   5.292  -3.421
  499    HE1  PHE  34           2HE      PHE  34 -15.087   7.372  -3.100
  500    HE2  PHE  34           1HE      PHE  34 -11.214   7.195  -4.870
  501    HZ   PHE  34           HZ       PHE  34 -13.441   8.233  -4.713
  502    H    LEU  35           H        LEU  35 -13.078   1.211  -3.470
  503    HA   LEU  35           HA       LEU  35 -11.659  -0.764  -1.852
  504    HB2  LEU  35           2HB      LEU  35 -11.972  -2.061  -4.163
  505    HB3  LEU  35           1HB      LEU  35 -13.203  -2.020  -2.918
  506    HG   LEU  35           HG       LEU  35 -13.392   0.160  -4.885
  507   HD11  LEU  35          1HD1      LEU  35 -14.212  -2.581  -5.781
  508   HD12  LEU  35          2HD1      LEU  35 -14.064  -1.100  -6.727
  509   HD13  LEU  35          3HD1      LEU  35 -12.616  -1.937  -6.162
  510   HD21  LEU  35          3HD2      LEU  35 -15.066  -0.245  -3.151
  511   HD22  LEU  35          1HD2      LEU  35 -15.753  -0.436  -4.761
  512   HD23  LEU  35          2HD2      LEU  35 -15.352  -1.860  -3.801
  513    H    LEU  36           H        LEU  36  -9.685  -1.615  -2.420
  514    HA   LEU  36           HA       LEU  36  -8.099   0.163  -4.143
  515    HB2  LEU  36           2HB      LEU  36  -7.411  -1.428  -1.683
  516    HB3  LEU  36           1HB      LEU  36  -6.172  -0.800  -2.750
  517    HG   LEU  36           HG       LEU  36  -6.284   0.775  -1.057
  518   HD11  LEU  36          1HD1      LEU  36  -8.122   1.766  -3.226
  519   HD12  LEU  36          2HD1      LEU  36  -7.315   2.785  -2.035
  520   HD13  LEU  36          3HD1      LEU  36  -6.361   1.871  -3.203
  521   HD21  LEU  36          3HD2      LEU  36  -8.635  -0.268  -0.361
  522   HD22  LEU  36          1HD2      LEU  36  -8.071   1.296   0.232
  523   HD23  LEU  36          2HD2      LEU  36  -9.207   1.220  -1.117
  524    H    TYR  37           H        TYR  37  -6.848  -0.649  -5.718
  525    HA   TYR  37           HA       TYR  37  -6.886  -3.552  -6.178
  526    HB2  TYR  37           2HB      TYR  37  -7.025  -1.229  -7.884
  527    HB3  TYR  37           1HB      TYR  37  -5.634  -2.212  -8.327
  528    HD1  TYR  37           2HD      TYR  37  -7.066  -4.861  -7.406
  529    HD2  TYR  37           1HD      TYR  37  -8.134  -1.645  -9.974
  530    HE1  TYR  37           2HE      TYR  37  -8.527  -6.372  -8.669
  531    HE2  TYR  37           1HE      TYR  37  -9.600  -3.134 -11.247
  532    HH   TYR  37           HH       TYR  37  -9.511  -6.501 -10.956
  533    H    ALA  38           H        ALA  38  -5.229  -4.386  -5.028
  534    HA   ALA  38           HA       ALA  38  -2.613  -3.079  -5.213
  535    HB1  ALA  38           1HB      ALA  38  -3.557  -5.281  -3.379
  536    HB2  ALA  38           2HB      ALA  38  -1.950  -4.553  -3.361
  537    HB3  ALA  38           3HB      ALA  38  -3.364  -3.579  -2.958
  538    H    MET  39           H        MET  39  -2.865  -6.450  -4.523
  539    HA   MET  39           HA       MET  39  -1.014  -7.197  -6.503
  540    HB2  MET  39           2HB      MET  39  -2.719  -8.567  -4.513
  541    HB3  MET  39           1HB      MET  39  -2.199  -9.547  -5.875
  542    HG2  MET  39           2HG      MET  39   0.131  -9.017  -5.361
  543    HG3  MET  39           1HG      MET  39  -0.400  -8.035  -3.997
  544    HE1  MET  39           3HE      MET  39   0.087 -10.443  -1.277
  545    HE2  MET  39           1HE      MET  39   1.015  -9.271  -2.211
  546    HE3  MET  39           2HE      MET  39  -0.621  -8.880  -1.683
  547    H    ASP  40           H        ASP  40  -4.522  -7.609  -6.295
  548    HA   ASP  40           HA       ASP  40  -5.200  -7.344  -8.942
  549    HB2  ASP  40           2HB      ASP  40  -3.697  -9.606  -8.830
  550    HB3  ASP  40           1HB      ASP  40  -5.292 -10.280  -8.509
  551    H    SER  41           H        SER  41  -5.687  -8.379  -5.788
  552    HA   SER  41           HA       SER  41  -8.406  -9.302  -6.128
  553    HB2  SER  41           2HB      SER  41  -7.697  -8.896  -3.390
  554    HB3  SER  41           1HB      SER  41  -7.870 -10.424  -4.259
  555    HG   SER  41           HG       SER  41  -5.721 -10.381  -4.793
  556    H    TYR  42           H        TYR  42 -10.068  -8.331  -4.559
  557    HA   TYR  42           HA       TYR  42  -9.966  -5.424  -4.774
  558    HB2  TYR  42           2HB      TYR  42 -12.204  -7.334  -4.068
  559    HB3  TYR  42           1HB      TYR  42 -12.366  -5.586  -3.960
  560    HD1  TYR  42           2HD      TYR  42 -11.154  -4.538  -6.314
  561    HD2  TYR  42           1HD      TYR  42 -13.392  -8.126  -5.871
  562    HE1  TYR  42           2HE      TYR  42 -11.763  -4.443  -8.691
  563    HE2  TYR  42           1HE      TYR  42 -14.006  -8.042  -8.251
  564    HH   TYR  42           HH       TYR  42 -12.657  -6.744 -10.450
  565    H    TRP  43           H        TRP  43  -9.174  -4.306  -3.144
  566    HA   TRP  43           HA       TRP  43  -9.342  -5.460  -0.439
  567    HB2  TRP  43           2HB      TRP  43  -7.347  -3.372  -1.336
  568    HB3  TRP  43           1HB      TRP  43  -7.306  -4.339   0.132
  569    HD1  TRP  43           HD       TRP  43  -6.973  -4.849  -3.691
  570    HE1  TRP  43           1HE      TRP  43  -5.362  -6.806  -4.093
  571    HE3  TRP  43           3HE      TRP  43  -6.117  -6.207   1.159
  572    HZ2  TRP  43           2HZ      TRP  43  -3.912  -8.679  -2.571
  573    HZ3  TRP  43           3HZ      TRP  43  -4.603  -8.102   1.598
  574    HH2  TRP  43           HH       TRP  43  -3.524  -9.307  -0.233
  575    H    HIS  44           H        HIS  44  -9.208  -3.729   1.277
  576    HA   HIS  44           HA       HIS  44 -10.410  -1.172   0.516
  577    HB2  HIS  44           2HB      HIS  44 -11.798  -1.241   2.652
  578    HB3  HIS  44           1HB      HIS  44 -12.344  -2.332   1.383
  579    HD1  HIS  44           1HD      HIS  44 -11.994  -2.361   4.907
  580    HD2  HIS  44           2HD      HIS  44 -10.943  -4.995   1.870
  581    HE1  HIS  44           1HE      HIS  44 -11.521  -4.609   6.020
  582    H    SER  45           H        SER  45 -10.327   0.123   2.895
  583    HA   SER  45           HA       SER  45  -7.630   0.692   3.188
  584    HB2  SER  45           2HB      SER  45  -9.107   1.288   5.608
  585    HB3  SER  45           1HB      SER  45  -8.436   2.392   4.403
  586    HG   SER  45           HG       SER  45 -10.360   2.632   3.596
  587    H    ARG  46           H        ARG  46  -9.683  -1.410   5.190
  588    HA   ARG  46           HA       ARG  46  -7.556  -1.937   7.055
  589    HB2  ARG  46           2HB      ARG  46 -10.298  -1.989   7.183
  590    HB3  ARG  46           1HB      ARG  46  -9.883  -3.698   7.187
  591    HG2  ARG  46           2HG      ARG  46  -8.427  -1.843   9.006
  592    HG3  ARG  46           1HG      ARG  46 -10.063  -2.361   9.422
  593    HD2  ARG  46           2HD      ARG  46  -9.160  -4.742   8.920
  594    HD3  ARG  46           1HD      ARG  46  -7.574  -3.999   9.117
  595    HE   ARG  46           HE       ARG  46  -7.965  -3.777  11.383
  596   HH11  ARG  46          2HH1      ARG  46 -10.873  -4.854   9.744
  597   HH12  ARG  46          1HH1      ARG  46 -11.695  -5.293  11.213
  598   HH21  ARG  46          2HH2      ARG  46  -9.021  -4.398  13.316
  599   HH22  ARG  46          1HH2      ARG  46 -10.644  -5.030  13.247
  600    H    CYS  47           H        CYS  47  -8.244  -3.253   4.029
  601    HA   CYS  47           HA       CYS  47  -7.278  -5.914   4.759
  602    HB2  CYS  47           2HB      CYS  47  -8.886  -4.924   2.649
  603    HB3  CYS  47           1HB      CYS  47  -7.409  -5.553   1.922
  604    H    LEU  48           H        LEU  48  -6.342  -3.183   2.744
  605    HA   LEU  48           HA       LEU  48  -3.768  -4.282   2.140
  606    HB2  LEU  48           2HB      LEU  48  -5.288  -1.843   1.489
  607    HB3  LEU  48           1HB      LEU  48  -3.554  -1.629   1.571
  608    HG   LEU  48           HG       LEU  48  -5.148  -3.295  -0.337
  609   HD11  LEU  48          1HD1      LEU  48  -3.611  -2.189  -1.951
  610   HD12  LEU  48          2HD1      LEU  48  -4.644  -1.074  -1.058
  611   HD13  LEU  48          3HD1      LEU  48  -2.948  -1.258  -0.607
  612   HD21  LEU  48          3HD2      LEU  48  -3.322  -4.586  -0.987
  613   HD22  LEU  48          1HD2      LEU  48  -2.174  -3.581  -0.101
  614   HD23  LEU  48          2HD2      LEU  48  -3.270  -4.647   0.777
  615    H    LYS  49           H        LYS  49  -3.252  -4.719   4.396
  616    HA   LYS  49           HA       LYS  49  -2.084  -2.365   5.726
  617    HB2  LYS  49           2HB      LYS  49  -2.452  -3.844   7.860
  618    HB3  LYS  49           1HB      LYS  49  -3.771  -2.873   7.227
  619    HG2  LYS  49           2HG      LYS  49  -4.962  -4.749   7.365
  620    HG3  LYS  49           1HG      LYS  49  -4.121  -5.225   5.889
  621    HD2  LYS  49           2HD      LYS  49  -2.324  -6.178   7.455
  622    HD3  LYS  49           1HD      LYS  49  -3.538  -6.016   8.729
  623    HE2  LYS  49           2HE      LYS  49  -4.995  -7.255   6.830
  624    HE3  LYS  49           1HE      LYS  49  -3.397  -7.901   6.465
  625    HZ1  LYS  49           3HZ      LYS  49  -3.877  -7.971   9.260
  626    HZ2  LYS  49           1HZ      LYS  49  -3.521  -9.246   8.201
  627    HZ3  LYS  49           2HZ      LYS  49  -5.127  -8.761   8.437
  628    H    CYS  50           H        CYS  50  -0.095  -2.718   6.806
  629    HA   CYS  50           HA       CYS  50   1.662  -4.609   5.698
  630    HB2  CYS  50           2HB      CYS  50   2.473  -2.557   6.776
  631    HB3  CYS  50           1HB      CYS  50   1.860  -3.110   8.327
  632    H    SER  51           H        SER  51   2.163  -6.686   6.279
  633    HA   SER  51           HA       SER  51   0.420  -7.981   8.175
  634    HB2  SER  51           2HB      SER  51   2.790  -9.436   7.120
  635    HB3  SER  51           1HB      SER  51   1.107  -9.950   7.229
  636    HG   SER  51           HG       SER  51   1.089  -7.997   5.517
  637    H    SER  52           H        SER  52   3.076  -6.121   8.578
  638    HA   SER  52           HA       SER  52   3.913  -7.611  10.973
  639    HB2  SER  52           2HB      SER  52   5.623  -5.537   9.638
  640    HB3  SER  52           1HB      SER  52   6.112  -6.855  10.705
  641    HG   SER  52           HG       SER  52   5.261  -6.991   8.010
  642    H    CYS  53           H        CYS  53   3.043  -4.440   9.669
  643    HA   CYS  53           HA       CYS  53   3.102  -3.260  12.345
  644    HB2  CYS  53           2HB      CYS  53   2.376  -2.119   9.640
  645    HB3  CYS  53           1HB      CYS  53   2.293  -1.204  11.139
  646    H    GLN  54           H        GLN  54   0.875  -4.469   9.972
  647    HA   GLN  54           HA       GLN  54  -1.356  -4.667   9.821
  648    HB2  GLN  54           2HB      GLN  54  -0.932  -4.614  12.732
  649    HB3  GLN  54           1HB      GLN  54  -2.552  -4.161  12.209
  650    HG2  GLN  54           2HG      GLN  54  -1.318  -6.590  11.033
  651    HG3  GLN  54           1HG      GLN  54  -1.899  -6.661  12.694
  652   HE21  GLN  54          1HE2      GLN  54  -3.663  -4.419  10.945
  653   HE22  GLN  54          2HE2      GLN  54  -5.025  -5.411  10.563
  654    H    ALA  55           H        ALA  55   0.156  -2.072   9.772
  655    HA   ALA  55           HA       ALA  55  -1.846  -0.080  10.374
  656    HB1  ALA  55           1HB      ALA  55   0.681   0.273   8.765
  657    HB2  ALA  55           2HB      ALA  55  -0.250   1.516   9.605
  658    HB3  ALA  55           3HB      ALA  55   0.641   0.309  10.530
  659    H    GLN  56           H        GLN  56  -3.321   0.704   9.005
  660    HA   GLN  56           HA       GLN  56  -3.756  -0.688   6.547
  661    HB2  GLN  56           2HB      GLN  56  -5.199   1.548   7.955
  662    HB3  GLN  56           1HB      GLN  56  -5.734   0.889   6.417
  663    HG2  GLN  56           2HG      GLN  56  -6.904  -0.583   7.585
  664    HG3  GLN  56           1HG      GLN  56  -5.372  -1.344   7.998
  665   HE21  GLN  56          1HE2      GLN  56  -7.359   1.410   9.023
  666   HE22  GLN  56          2HE2      GLN  56  -7.135   1.146  10.722
  667    H    LEU  57           H        LEU  57  -2.573  -0.208   4.815
  668    HA   LEU  57           HA       LEU  57  -1.752   2.545   4.290
  669    HB2  LEU  57           2HB      LEU  57  -1.188   0.208   2.490
  670    HB3  LEU  57           1HB      LEU  57  -0.278   1.693   2.673
  671    HG   LEU  57           HG       LEU  57  -0.144   0.467   5.184
  672   HD11  LEU  57          1HD1      LEU  57   0.217  -1.760   4.945
  673   HD12  LEU  57          2HD1      LEU  57  -0.939  -1.542   3.627
  674   HD13  LEU  57          3HD1      LEU  57   0.790  -1.600   3.283
  675   HD21  LEU  57          3HD2      LEU  57   1.543   1.744   3.640
  676   HD22  LEU  57          1HD2      LEU  57   2.127   0.591   4.840
  677   HD23  LEU  57          2HD2      LEU  57   2.004   0.114   3.145
  678    H    GLY  58           H        GLY  58  -4.446   0.800   3.799
  679    HA2  GLY  58           1HA      GLY  58  -4.990   0.964   1.059
  680    HA3  GLY  58           2HA      GLY  58  -6.193   0.819   2.325
  681    H    ASP  59           H        ASP  59  -5.205   3.448   3.502
  682    HA   ASP  59           HA       ASP  59  -6.755   5.115   1.656
  683    HB2  ASP  59           2HB      ASP  59  -7.302   4.843   4.195
  684    HB3  ASP  59           1HB      ASP  59  -5.988   5.994   4.419
  685    H    ILE  60           H        ILE  60  -3.760   4.369   1.746
  686    HA   ILE  60           HA       ILE  60  -2.780   7.136   1.490
  687    HB   ILE  60           HB       ILE  60  -0.815   4.939   1.862
  688   HG12  ILE  60          2HG1      ILE  60  -2.368   6.109   4.184
  689   HG13  ILE  60          1HG1      ILE  60  -2.551   4.465   3.583
  690   HG21  ILE  60          1HG2      ILE  60   0.510   6.619   2.810
  691   HG22  ILE  60          2HG2      ILE  60  -0.342   7.418   1.490
  692   HG23  ILE  60          3HG2      ILE  60  -0.882   7.646   3.154
  693   HD11  ILE  60          3HD1      ILE  60  -1.174   4.350   5.494
  694   HD12  ILE  60          1HD1      ILE  60  -0.115   4.123   4.101
  695   HD13  ILE  60          2HD1      ILE  60  -0.157   5.678   4.930
  696    H    GLY  61           H        GLY  61  -1.666   7.679  -0.336
  697    HA2  GLY  61           1HA      GLY  61  -2.064   5.959  -2.624
  698    HA3  GLY  61           2HA      GLY  61  -1.411   7.588  -2.643
  699    H    THR  62           H        THR  62   0.109   5.545  -0.401
  700    HA   THR  62           HA       THR  62   2.444   5.335  -2.149
  701    HB   THR  62           HB       THR  62   2.640   4.480   0.675
  702    HG1  THR  62           1HG      THR  62   1.639   6.952  -0.073
  703   HG21  THR  62          3HG2      THR  62   4.444   6.541  -0.295
  704   HG22  THR  62          1HG2      THR  62   4.383   5.142  -1.368
  705   HG23  THR  62          2HG2      THR  62   4.802   4.931   0.333
  706    H    SER  63           H        SER  63   3.023   3.435  -2.997
  707    HA   SER  63           HA       SER  63   1.315   1.163  -2.537
  708    HB2  SER  63           2HB      SER  63   3.749   1.090  -4.285
  709    HB3  SER  63           1HB      SER  63   2.191   0.293  -4.508
  710    HG   SER  63           HG       SER  63   1.610   2.811  -4.496
  711    H    SER  64           H        SER  64   1.719  -0.538  -1.301
  712    HA   SER  64           HA       SER  64   4.179  -0.717   0.193
  713    HB2  SER  64           2HB      SER  64   2.598  -3.000   0.669
  714    HB3  SER  64           1HB      SER  64   2.713  -1.557   1.671
  715    HG   SER  64           HG       SER  64   0.648  -1.458   1.198
  716    H    TYR  65           H        TYR  65   5.046  -3.105   0.435
  717    HA   TYR  65           HA       TYR  65   5.564  -4.021  -2.319
  718    HB2  TYR  65           2HB      TYR  65   7.426  -4.035   0.066
  719    HB3  TYR  65           1HB      TYR  65   7.809  -4.682  -1.524
  720    HD1  TYR  65           1HD      TYR  65   7.635  -3.003  -3.500
  721    HD2  TYR  65           2HD      TYR  65   7.987  -1.838   0.573
  722    HE1  TYR  65           1HE      TYR  65   8.454  -0.799  -4.210
  723    HE2  TYR  65           2HE      TYR  65   8.806   0.375  -0.124
  724    HH   TYR  65           HH       TYR  65  10.084   1.225  -2.412
  725    H    THR  66           H        THR  66   6.089  -6.295  -2.560
  726    HA   THR  66           HA       THR  66   5.178  -7.996  -0.369
  727    HB   THR  66           HB       THR  66   3.284  -7.448  -2.043
  728    HG1  THR  66           1HG      THR  66   3.411  -9.226  -0.457
  729   HG21  THR  66          3HG2      THR  66   3.252  -9.164  -3.932
  730   HG22  THR  66          1HG2      THR  66   4.991  -9.309  -3.675
  731   HG23  THR  66          2HG2      THR  66   4.297  -7.759  -4.153
  732    H    LYS  67           H        LYS  67   5.739 -10.268  -0.696
  733    HA   LYS  67           HA       LYS  67   7.638 -10.953  -2.739
  734    HB2  LYS  67           2HB      LYS  67   8.694  -9.653  -0.571
  735    HB3  LYS  67           1HB      LYS  67   8.865 -11.340  -0.098
  736    HG2  LYS  67           2HG      LYS  67   9.925 -11.676  -2.409
  737    HG3  LYS  67           1HG      LYS  67  10.067  -9.914  -2.441
  738    HD2  LYS  67           2HD      LYS  67  11.279 -10.043  -0.265
  739    HD3  LYS  67           1HD      LYS  67  11.243 -11.803  -0.402
  740    HE2  LYS  67           2HE      LYS  67  12.327 -10.224  -2.680
  741    HE3  LYS  67           1HE      LYS  67  13.316 -10.394  -1.229
  742    HZ1  LYS  67           3HZ      LYS  67  13.870 -12.426  -1.861
  743    HZ2  LYS  67           1HZ      LYS  67  12.976 -12.235  -3.290
  744    HZ3  LYS  67           2HZ      LYS  67  12.241 -12.905  -1.916
  745    H    SER  68           H        SER  68   7.818 -12.256   0.494
  746    HA   SER  68           HA       SER  68   7.144 -14.868  -0.489
  747    HB2  SER  68           2HB      SER  68   7.471 -14.548   2.405
  748    HB3  SER  68           1HB      SER  68   8.364 -15.567   1.271
  749    HG   SER  68           HG       SER  68   9.894 -14.141   1.348
  750    H    GLY  69           H        GLY  69   4.895 -13.723  -0.968
  751    HA2  GLY  69           1HA      GLY  69   2.635 -13.899  -0.636
  752    HA3  GLY  69           2HA      GLY  69   3.003 -15.142   0.548
  753    H    MET  70           H        MET  70   4.178 -11.868   0.881
  754    HA   MET  70           HA       MET  70   2.110 -11.273   2.863
  755    HB2  MET  70           2HB      MET  70   5.047 -11.518   3.375
  756    HB3  MET  70           1HB      MET  70   4.153 -10.270   4.228
  757    HG2  MET  70           2HG      MET  70   2.570 -12.063   4.988
  758    HG3  MET  70           1HG      MET  70   3.710 -13.237   4.333
  759    HE1  MET  70           3HE      MET  70   6.726 -12.494   5.358
  760    HE2  MET  70           1HE      MET  70   6.441 -13.577   6.721
  761    HE3  MET  70           2HE      MET  70   5.713 -13.922   5.150
  762    H    ILE  71           H        ILE  71   1.535  -9.166   2.959
  763    HA   ILE  71           HA       ILE  71   2.919  -7.312   1.152
  764    HB   ILE  71           HB       ILE  71   0.649  -6.046   2.255
  765   HG12  ILE  71          2HG1      ILE  71  -1.007  -7.803   1.140
  766   HG13  ILE  71          1HG1      ILE  71   0.225  -8.940   1.682
  767   HG21  ILE  71          1HG2      ILE  71   1.373  -5.484   0.111
  768   HG22  ILE  71          2HG2      ILE  71   1.350  -7.162  -0.432
  769   HG23  ILE  71          3HG2      ILE  71  -0.166  -6.310  -0.143
  770   HD11  ILE  71          3HD1      ILE  71  -0.026  -7.678   3.953
  771   HD12  ILE  71          1HD1      ILE  71  -1.591  -7.213   3.280
  772   HD13  ILE  71          2HD1      ILE  71  -1.189  -8.918   3.478
  773    H    LEU  72           H        LEU  72   4.389  -6.061   2.042
  774    HA   LEU  72           HA       LEU  72   4.096  -5.390   4.892
  775    HB2  LEU  72           2HB      LEU  72   6.331  -6.473   3.325
  776    HB3  LEU  72           1HB      LEU  72   6.766  -5.136   4.371
  777    HG   LEU  72           HG       LEU  72   5.970  -6.341   6.313
  778   HD11  LEU  72          1HD1      LEU  72   4.967  -8.437   6.294
  779   HD12  LEU  72          2HD1      LEU  72   4.154  -7.553   5.003
  780   HD13  LEU  72          3HD1      LEU  72   5.405  -8.734   4.610
  781   HD21  LEU  72          3HD2      LEU  72   8.182  -7.011   4.767
  782   HD22  LEU  72          1HD2      LEU  72   7.929  -7.379   6.475
  783   HD23  LEU  72          2HD2      LEU  72   7.473  -8.558   5.242
  784    H    CYS  73           H        CYS  73   4.952  -3.352   5.564
  785    HA   CYS  73           HA       CYS  73   4.363  -1.237   3.781
  786    HB2  CYS  73           2HB      CYS  73   5.075   0.234   5.601
  787    HB3  CYS  73           1HB      CYS  73   4.043  -1.051   6.219
  788    H    ARG  74           H        ARG  74   6.052   0.662   3.739
  789    HA   ARG  74           HA       ARG  74   8.062  -0.088   1.939
  790    HB2  ARG  74           2HB      ARG  74   6.929   2.290   2.792
  791    HB3  ARG  74           1HB      ARG  74   8.594   2.420   3.335
  792    HG2  ARG  74           2HG      ARG  74   9.169   3.047   1.301
  793    HG3  ARG  74           1HG      ARG  74   8.706   1.451   0.708
  794    HD2  ARG  74           2HD      ARG  74   6.647   2.164  -0.012
  795    HD3  ARG  74           1HD      ARG  74   6.583   3.491   1.146
  796    HE   ARG  74           HE       ARG  74   8.378   4.532  -0.308
  797   HH11  ARG  74          2HH1      ARG  74   5.943   2.335  -1.576
  798   HH12  ARG  74          1HH1      ARG  74   5.979   3.024  -3.166
  799   HH21  ARG  74          2HH2      ARG  74   8.430   5.410  -2.426
  800   HH22  ARG  74          1HH2      ARG  74   7.428   4.718  -3.665
  801    H    ASN  75           H        ASN  75   8.224   0.782   5.363
  802    HA   ASN  75           HA       ASN  75  11.071   0.610   5.503
  803    HB2  ASN  75           2HB      ASN  75   9.551   2.016   6.978
  804    HB3  ASN  75           1HB      ASN  75   9.140   0.526   7.820
  805   HD21  ASN  75          1HD2      ASN  75  10.162   0.405   9.663
  806   HD22  ASN  75          2HD2      ASN  75  11.807   0.867   9.955
  807    H    ASP  76           H        ASP  76   8.395  -1.550   6.306
  808    HA   ASP  76           HA       ASP  76   9.974  -3.398   7.782
  809    HB2  ASP  76           2HB      ASP  76   7.209  -3.143   7.024
  810    HB3  ASP  76           1HB      ASP  76   7.761  -4.797   6.771
  811    H    TYR  77           H        TYR  77   8.868  -3.312   4.417
  812    HA   TYR  77           HA       TYR  77   9.670  -5.898   3.742
  813    HB2  TYR  77           2HB      TYR  77   8.274  -4.635   2.222
  814    HB3  TYR  77           1HB      TYR  77   9.548  -3.435   1.993
  815    HD1  TYR  77           2HD      TYR  77   9.407  -7.166   1.904
  816    HD2  TYR  77           1HD      TYR  77  10.510  -3.580  -0.101
  817    HE1  TYR  77           2HE      TYR  77  10.338  -8.491   0.057
  818    HE2  TYR  77           1HE      TYR  77  11.455  -4.895  -1.948
  819    HH   TYR  77           HH       TYR  77  12.462  -7.378  -2.080
  820    H    ILE  78           H        ILE  78  11.471  -2.842   3.558
  821    HA   ILE  78           HA       ILE  78  13.847  -3.978   2.525
  822    HB   ILE  78           HB       ILE  78  13.447  -1.449   4.142
  823   HG12  ILE  78          2HG1      ILE  78  14.025  -1.562   1.204
  824   HG13  ILE  78          1HG1      ILE  78  12.383  -1.857   1.767
  825   HG21  ILE  78          1HG2      ILE  78  15.840  -2.672   3.802
  826   HG22  ILE  78          2HG2      ILE  78  15.779  -1.663   2.356
  827   HG23  ILE  78          3HG2      ILE  78  15.635  -0.928   3.955
  828   HD11  ILE  78          3HD1      ILE  78  13.816   0.625   1.464
  829   HD12  ILE  78          1HD1      ILE  78  12.092   0.337   1.702
  830   HD13  ILE  78          2HD1      ILE  78  13.168   0.446   3.096
  831    H    ARG  79           H        ARG  79  12.625  -3.454   5.772
  832    HA   ARG  79           HA       ARG  79  14.943  -4.114   7.226
  833    HB2  ARG  79           2HB      ARG  79  12.343  -3.313   7.812
  834    HB3  ARG  79           1HB      ARG  79  12.459  -4.919   8.519
  835    HG2  ARG  79           2HG      ARG  79  14.817  -3.658   9.270
  836    HG3  ARG  79           1HG      ARG  79  13.570  -2.417   9.426
  837    HD2  ARG  79           2HD      ARG  79  13.805  -5.056  10.814
  838    HD3  ARG  79           1HD      ARG  79  13.535  -3.457  11.499
  839    HE   ARG  79           HE       ARG  79  11.404  -4.511   9.826
  840   HH11  ARG  79          2HH1      ARG  79  12.655  -4.040  13.061
  841   HH12  ARG  79          1HH1      ARG  79  11.107  -4.218  13.825
  842   HH21  ARG  79          2HH2      ARG  79   9.365  -4.795  10.827
  843   HH22  ARG  79          1HH2      ARG  79   9.250  -4.694  12.571
  844    H    LEU  80           H        LEU  80  12.257  -6.090   6.040
  845    HA   LEU  80           HA       LEU  80  13.282  -8.472   7.292
  846    HB2  LEU  80           2HB      LEU  80  10.865  -7.692   5.803
  847    HB3  LEU  80           1HB      LEU  80  11.384  -9.349   5.551
  848    HG   LEU  80           HG       LEU  80  11.505  -9.376   8.189
  849   HD11  LEU  80          1HD1      LEU  80   9.564  -7.159   7.575
  850   HD12  LEU  80          2HD1      LEU  80   9.565  -8.064   9.090
  851   HD13  LEU  80          3HD1      LEU  80  10.973  -7.104   8.636
  852   HD21  LEU  80          3HD2      LEU  80   9.724 -10.287   6.252
  853   HD22  LEU  80          1HD2      LEU  80   9.845 -10.826   7.927
  854   HD23  LEU  80          2HD2      LEU  80   8.713  -9.545   7.493
  855    H    PHE  81           H        PHE  81  12.768  -7.458   3.905
  856    HA   PHE  81           HA       PHE  81  14.743  -9.505   3.133
  857    HB2  PHE  81           2HB      PHE  81  12.520  -8.514   1.357
  858    HB3  PHE  81           1HB      PHE  81  13.539  -9.928   1.127
  859    HD1  PHE  81           2HD      PHE  81  13.232 -11.908   2.614
  860    HD2  PHE  81           1HD      PHE  81  10.524  -8.627   2.608
  861    HE1  PHE  81           2HE      PHE  81  11.540 -13.305   3.729
  862    HE2  PHE  81           1HE      PHE  81   8.827 -10.022   3.720
  863    HZ   PHE  81           HZ       PHE  81   9.336 -12.359   4.284
  864    H    GLY  82           H        GLY  82  13.189  -6.726   1.523
  865    HA2  GLY  82           1HA      GLY  82  14.266  -4.741   0.837
  866    HA3  GLY  82           2HA      GLY  82  15.819  -5.509   1.141
  Start of MODEL   16
    1    H    SER 641           1H       SER 641  16.019 -15.700 -45.938
    2    HA   SER 641           HA       SER 641  14.940 -17.592 -44.818
    3    HB2  SER 641           2HB      SER 641  17.887 -17.553 -44.205
    4    HB3  SER 641           1HB      SER 641  16.906 -18.880 -44.827
    5    HG   SER 641           HG       SER 641  17.027 -18.087 -46.807
    6    H    LEU 642           H        LEU 642  14.682 -15.391 -42.885
    7    HA   LEU 642           HA       LEU 642  15.440 -16.826 -40.422
    8    HB2  LEU 642           2HB      LEU 642  16.527 -14.638 -40.668
    9    HB3  LEU 642           1HB      LEU 642  14.961 -13.873 -40.849
   10    HG   LEU 642           HG       LEU 642  14.585 -15.024 -38.458
   11   HD11  LEU 642          1HD1      LEU 642  17.138 -14.178 -37.619
   12   HD12  LEU 642          2HD1      LEU 642  16.436 -15.794 -37.527
   13   HD13  LEU 642          3HD1      LEU 642  17.378 -15.323 -38.943
   14   HD21  LEU 642          3HD2      LEU 642  14.723 -12.898 -37.580
   15   HD22  LEU 642          1HD2      LEU 642  16.155 -12.485 -38.527
   16   HD23  LEU 642          2HD2      LEU 642  14.573 -12.555 -39.304
   17    H    GLN 643           H        GLN 643  13.554 -18.106 -40.385
   18    HA   GLN 643           HA       GLN 643  11.055 -16.586 -40.060
   19    HB2  GLN 643           2HB      GLN 643   9.855 -18.593 -40.860
   20    HB3  GLN 643           1HB      GLN 643  10.934 -17.910 -42.065
   21    HG2  GLN 643           2HG      GLN 643  12.207 -19.974 -40.459
   22    HG3  GLN 643           1HG      GLN 643  10.784 -20.553 -41.323
   23   HE21  GLN 643          1HE2      GLN 643  10.737 -19.573 -43.671
   24   HE22  GLN 643          2HE2      GLN 643  12.212 -19.787 -44.551
   25    H    ASN 644           H        ASN 644   9.874 -16.852 -38.336
   26    HA   ASN 644           HA       ASN 644   9.198 -17.432 -36.266
   27    HB2  ASN 644           2HB      ASN 644   8.851 -19.612 -37.696
   28    HB3  ASN 644           1HB      ASN 644  10.120 -20.246 -36.651
   29   HD21  ASN 644          1HD2      ASN 644   8.756 -21.687 -35.649
   30   HD22  ASN 644          2HD2      ASN 644   7.545 -21.184 -34.517
   31    H    ASN 645           H        ASN 645  11.821 -16.390 -36.392
   32    HA   ASN 645           HA       ASN 645  13.065 -17.834 -34.146
   33    HB2  ASN 645           2HB      ASN 645  14.244 -16.890 -36.479
   34    HB3  ASN 645           1HB      ASN 645  14.665 -15.674 -35.277
   35   HD21  ASN 645          1HD2      ASN 645  16.380 -16.061 -34.040
   36   HD22  ASN 645          2HD2      ASN 645  17.132 -17.612 -33.829
   37    H    GLN 646           H        GLN 646  13.311 -14.463 -35.178
   38    HA   GLN 646           HA       GLN 646  13.013 -12.494 -34.104
   39    HB2  GLN 646           2HB      GLN 646  10.614 -13.743 -34.145
   40    HB3  GLN 646           1HB      GLN 646  10.808 -13.484 -32.414
   41    HG2  GLN 646           2HG      GLN 646  11.076 -11.115 -32.757
   42    HG3  GLN 646           1HG      GLN 646  11.025 -11.332 -34.506
   43   HE21  GLN 646          1HE2      GLN 646   9.106 -12.174 -31.641
   44   HE22  GLN 646          2HE2      GLN 646   7.570 -11.786 -32.354
   45    H    ASP 647           H        ASP 647  15.015 -13.903 -32.979
   46    HA   ASP 647           HA       ASP 647  14.756 -14.041 -30.137
   47    HB2  ASP 647           2HB      ASP 647  17.332 -14.070 -30.248
   48    HB3  ASP 647           1HB      ASP 647  16.471 -15.419 -30.974
   49    H    VAL 648           H        VAL 648  14.387 -12.324 -28.967
   50    HA   VAL 648           HA       VAL 648  14.771  -9.675 -29.880
   51    HB   VAL 648           HB       VAL 648  14.260 -10.564 -27.034
   52   HG11  VAL 648          1HG1      VAL 648  14.784  -8.310 -26.901
   53   HG12  VAL 648          2HG1      VAL 648  14.058  -7.942 -28.464
   54   HG13  VAL 648          3HG1      VAL 648  13.028  -8.280 -27.072
   55   HG21  VAL 648          3HG2      VAL 648  12.684 -11.331 -28.999
   56   HG22  VAL 648          1HG2      VAL 648  12.020 -10.761 -27.470
   57   HG23  VAL 648          2HG2      VAL 648  12.080  -9.681 -28.861
   58    H    SER 649           H        SER 649  16.582  -8.562 -29.962
   59    HA   SER 649           HA       SER 649  18.967  -9.326 -28.602
   60    HB2  SER 649           2HB      SER 649  19.183  -6.665 -29.561
   61    HB3  SER 649           1HB      SER 649  19.795  -8.138 -30.316
   62    HG   SER 649           HG       SER 649  18.345  -6.945 -31.680
   63    H    PHE 650           H        PHE 650  18.387  -9.282 -26.388
   64    HA   PHE 650           HA       PHE 650  17.221  -7.015 -25.130
   65    HB2  PHE 650           2HB      PHE 650  17.849  -9.671 -24.419
   66    HB3  PHE 650           1HB      PHE 650  18.705  -8.641 -23.276
   67    HD1  PHE 650           1HD      PHE 650  17.454  -7.053 -21.866
   68    HD2  PHE 650           2HD      PHE 650  15.485  -9.880 -24.361
   69    HE1  PHE 650           1HE      PHE 650  15.375  -6.729 -20.587
   70    HE2  PHE 650           2HE      PHE 650  13.404  -9.563 -23.091
   71    HZ   PHE 650           HZ       PHE 650  13.349  -7.990 -21.200
   72    H    GLU 651           H        GLU 651  20.343  -7.613 -26.210
   73    HA   GLU 651           HA       GLU 651  21.681  -6.035 -24.189
   74    HB2  GLU 651           2HB      GLU 651  22.822  -7.089 -26.773
   75    HB3  GLU 651           1HB      GLU 651  23.712  -6.558 -25.351
   76    HG2  GLU 651           2HG      GLU 651  22.046  -9.030 -25.685
   77    HG3  GLU 651           1HG      GLU 651  23.770  -8.916 -25.341
   78    H    ASN 652           H        ASN 652  19.976  -5.433 -27.029
   79    HA   ASN 652           HA       ASN 652  21.494  -3.282 -28.093
   80    HB2  ASN 652           2HB      ASN 652  19.507  -4.687 -29.122
   81    HB3  ASN 652           1HB      ASN 652  18.524  -3.401 -28.435
   82   HD21  ASN 652          1HD2      ASN 652  17.942  -2.937 -30.641
   83   HD22  ASN 652          2HD2      ASN 652  19.005  -1.978 -31.620
   84    H    ILE 653           H        ILE 653  18.710  -3.445 -25.920
   85    HA   ILE 653           HA       ILE 653  18.717  -0.597 -25.460
   86    HB   ILE 653           HB       ILE 653  17.208  -1.657 -23.425
   87   HG12  ILE 653          2HG1      ILE 653  16.111  -3.258 -25.609
   88   HG13  ILE 653          1HG1      ILE 653  17.684  -3.835 -25.072
   89   HG21  ILE 653          1HG2      ILE 653  16.733  -0.434 -26.041
   90   HG22  ILE 653          2HG2      ILE 653  15.361  -1.334 -25.392
   91   HG23  ILE 653          3HG2      ILE 653  16.078  -0.024 -24.455
   92   HD11  ILE 653          3HD1      ILE 653  15.105  -3.716 -23.599
   93   HD12  ILE 653          1HD1      ILE 653  16.284  -5.021 -23.718
   94   HD13  ILE 653          2HD1      ILE 653  16.619  -3.622 -22.697
   95    H    GLN 654           H        GLN 654  20.696  -0.068 -24.576
   96    HA   GLN 654           HA       GLN 654  21.477  -1.435 -22.101
   97    HB2  GLN 654           2HB      GLN 654  22.975   0.094 -24.188
   98    HB3  GLN 654           1HB      GLN 654  23.621   0.033 -22.554
   99    HG2  GLN 654           2HG      GLN 654  23.096  -2.261 -24.419
  100    HG3  GLN 654           1HG      GLN 654  24.648  -1.707 -23.792
  101   HE21  GLN 654          1HE2      GLN 654  22.512  -4.099 -23.555
  102   HE22  GLN 654          2HE2      GLN 654  22.745  -4.593 -21.908
  103    H    TRP 655           H        TRP 655  20.066  -0.422 -20.692
  104    HA   TRP 655           HA       TRP 655  19.794   2.397 -20.468
  105    HB2  TRP 655           2HB      TRP 655  18.783   0.035 -19.121
  106    HB3  TRP 655           1HB      TRP 655  19.207   1.293 -17.964
  107    HD1  TRP 655           HD       TRP 655  16.356   0.157 -19.838
  108    HE1  TRP 655           1HE      TRP 655  14.588   2.007 -20.132
  109    HE3  TRP 655           3HE      TRP 655  19.205   4.200 -18.581
  110    HZ2  TRP 655           2HZ      TRP 655  14.429   4.811 -19.859
  111    HZ3  TRP 655           3HZ      TRP 655  18.176   6.427 -18.619
  112    HH2  TRP 655           HH       TRP 655  15.834   6.731 -19.246
  113    H    SER 656           H        SER 656  21.249   3.789 -19.722
  114    HA   SER 656           HA       SER 656  23.578   2.862 -18.289
  115    HB2  SER 656           2HB      SER 656  23.398   5.735 -18.510
  116    HB3  SER 656           1HB      SER 656  24.550   4.629 -19.263
  117    HG   SER 656           HG       SER 656  23.445   4.683 -21.064
  118    H    ILE 657           H        ILE 657  21.494   2.349 -16.685
  119    HA   ILE 657           HA       ILE 657  21.807   4.332 -14.532
  120    HB   ILE 657           HB       ILE 657  19.422   3.828 -13.850
  121   HG12  ILE 657          2HG1      ILE 657  18.852   3.103 -16.687
  122   HG13  ILE 657          1HG1      ILE 657  19.448   1.840 -15.616
  123   HG21  ILE 657          1HG2      ILE 657  18.926   5.800 -14.738
  124   HG22  ILE 657          2HG2      ILE 657  20.445   5.706 -15.624
  125   HG23  ILE 657          3HG2      ILE 657  18.954   5.144 -16.373
  126   HD11  ILE 657          3HD1      ILE 657  17.511   2.816 -14.069
  127   HD12  ILE 657          1HD1      ILE 657  16.847   3.235 -15.647
  128   HD13  ILE 657          2HD1      ILE 657  17.232   1.556 -15.273
  129    H    ASP 658           H        ASP 658  20.148   2.913 -12.695
  130    HA   ASP 658           HA       ASP 658  21.846   0.617 -12.121
  131    HB2  ASP 658           2HB      ASP 658  20.564   2.521 -10.512
  132    HB3  ASP 658           1HB      ASP 658  19.689   1.021 -10.224
  133    HA   PRO 659           HA       PRO 659  18.682  -1.781 -14.175
  134    HB2  PRO 659           2HB      PRO 659  20.524  -4.008 -14.066
  135    HB3  PRO 659           1HB      PRO 659  20.023  -3.056 -15.464
  136    HG2  PRO 659           2HG      PRO 659  22.544  -2.998 -14.425
  137    HG3  PRO 659           1HG      PRO 659  21.811  -1.637 -15.295
  138    HD2  PRO 659           2HD      PRO 659  22.087  -2.074 -12.339
  139    HD3  PRO 659           1HD      PRO 659  22.335  -0.589 -13.287
  140    H    GLY 660           H        GLY 660  17.598  -1.641 -11.948
  141    HA2  GLY 660           1HA      GLY 660  16.087  -2.971 -10.778
  142    HA3  GLY 660           2HA      GLY 660  16.977  -4.397 -11.287
  143    H    ALA 661           H        ALA 661  18.708  -1.779  -9.829
  144    HA   ALA 661           HA       ALA 661  19.347  -3.519  -7.583
  145    HB1  ALA 661           1HB      ALA 661  20.506  -0.820  -8.259
  146    HB2  ALA 661           2HB      ALA 661  21.146  -1.995  -7.111
  147    HB3  ALA 661           3HB      ALA 661  21.143  -2.361  -8.835
  148    H    ASP 662           H        ASP 662  17.146  -1.110  -8.278
  149    HA   ASP 662           HA       ASP 662  16.942  -0.304  -5.457
  150    HB2  ASP 662           2HB      ASP 662  16.425   1.778  -6.126
  151    HB3  ASP 662           1HB      ASP 662  17.026   1.285  -7.701
  152    H    LEU 663           H        LEU 663  14.489   0.248  -4.915
  153    HA   LEU 663           HA       LEU 663  13.313  -2.383  -4.979
  154    HB2  LEU 663           2HB      LEU 663  12.951   0.087  -3.382
  155    HB3  LEU 663           1HB      LEU 663  11.577  -0.994  -3.494
  156    HG   LEU 663           HG       LEU 663  14.185  -1.377  -2.116
  157   HD11  LEU 663          1HD1      LEU 663  11.813  -2.733  -1.131
  158   HD12  LEU 663          2HD1      LEU 663  12.885  -1.588  -0.325
  159   HD13  LEU 663          3HD1      LEU 663  11.572  -0.998  -1.343
  160   HD21  LEU 663          3HD2      LEU 663  12.538  -3.676  -3.157
  161   HD22  LEU 663          1HD2      LEU 663  14.142  -3.221  -3.729
  162   HD23  LEU 663          2HD2      LEU 663  13.924  -3.788  -2.072
  163    H    SER 664           H        SER 664  13.084  -0.118  -7.244
  164    HA   SER 664           HA       SER 664  10.302   0.358  -7.465
  165    HB2  SER 664           2HB      SER 664  12.463   0.418  -9.577
  166    HB3  SER 664           1HB      SER 664  10.823   1.028  -9.802
  167    HG   SER 664           HG       SER 664  12.785   1.961  -7.955
  168    H    GLN 665           H        GLN 665  12.249  -2.374  -8.240
  169    HA   GLN 665           HA       GLN 665  10.464  -3.508 -10.174
  170    HB2  GLN 665           2HB      GLN 665  11.826  -5.653  -9.494
  171    HB3  GLN 665           1HB      GLN 665  12.577  -4.382 -10.447
  172    HG2  GLN 665           2HG      GLN 665  14.035  -3.860  -8.836
  173    HG3  GLN 665           1HG      GLN 665  12.835  -4.026  -7.555
  174   HE21  GLN 665          1HE2      GLN 665  15.644  -4.976  -7.842
  175   HE22  GLN 665          2HE2      GLN 665  15.572  -6.675  -7.525
  176    H    TYR 666           H        TYR 666  10.585  -3.395  -6.737
  177    HA   TYR 666           HA       TYR 666   8.704  -5.635  -6.490
  178    HB2  TYR 666           2HB      TYR 666  10.417  -4.169  -4.491
  179    HB3  TYR 666           1HB      TYR 666   9.118  -5.251  -3.995
  180    HD1  TYR 666           2HD      TYR 666   9.246  -7.584  -5.465
  181    HD2  TYR 666           1HD      TYR 666  12.511  -5.096  -4.355
  182    HE1  TYR 666           2HE      TYR 666  10.765  -9.511  -5.643
  183    HE2  TYR 666           1HE      TYR 666  14.040  -7.011  -4.527
  184    HH   TYR 666           HH       TYR 666  14.041  -9.369  -4.507
  185    H    LYS 667           H        LYS 667   8.372  -2.631  -7.292
  186    HA   LYS 667           HA       LYS 667   6.716  -1.503  -5.264
  187    HB2  LYS 667           2HB      LYS 667   7.291  -0.812  -8.117
  188    HB3  LYS 667           1HB      LYS 667   6.069   0.051  -7.210
  189    HG2  LYS 667           2HG      LYS 667   8.112   0.241  -5.486
  190    HG3  LYS 667           1HG      LYS 667   9.001   0.159  -7.009
  191    HD2  LYS 667           2HD      LYS 667   6.868   2.147  -6.237
  192    HD3  LYS 667           1HD      LYS 667   8.582   2.465  -6.503
  193    HE2  LYS 667           2HE      LYS 667   7.970   3.042  -8.579
  194    HE3  LYS 667           1HE      LYS 667   7.832   1.307  -8.867
  195    HZ1  LYS 667           3HZ      LYS 667   5.445   1.927  -7.756
  196    HZ2  LYS 667           1HZ      LYS 667   5.736   1.778  -9.419
  197    HZ3  LYS 667           2HZ      LYS 667   5.767   3.307  -8.684
  198    H    MET 668           H        MET 668   4.606  -1.616  -4.987
  199    HA   MET 668           HA       MET 668   2.997  -2.810  -7.137
  200    HB2  MET 668           2HB      MET 668   2.825  -4.337  -5.378
  201    HB3  MET 668           1HB      MET 668   2.801  -3.074  -4.154
  202    HG2  MET 668           2HG      MET 668   0.556  -2.414  -4.918
  203    HG3  MET 668           1HG      MET 668   0.585  -3.741  -6.078
  204    HE1  MET 668           3HE      MET 668   0.631  -2.961  -2.086
  205    HE2  MET 668           1HE      MET 668   1.016  -4.606  -1.580
  206    HE3  MET 668           2HE      MET 668   2.150  -3.705  -2.591
  207    H    ASP 669           H        ASP 669   1.701  -1.463  -8.079
  208    HA   ASP 669           HA       ASP 669   1.187   1.124  -6.848
  209    HB2  ASP 669           2HB      ASP 669   0.205   1.560  -9.230
  210    HB3  ASP 669           1HB      ASP 669   1.950   1.470  -9.012
  211    H    VAL 670           H        VAL 670  -0.708   1.686  -6.044
  212    HA   VAL 670           HA       VAL 670  -2.771  -0.343  -5.930
  213    HB   VAL 670           HB       VAL 670  -2.971   2.382  -4.672
  214   HG11  VAL 670          1HG1      VAL 670  -4.966   1.316  -4.311
  215   HG12  VAL 670          2HG1      VAL 670  -4.234  -0.288  -4.300
  216   HG13  VAL 670          3HG1      VAL 670  -4.061   0.770  -2.900
  217   HG21  VAL 670          3HG2      VAL 670  -1.861   0.193  -3.035
  218   HG22  VAL 670          1HG2      VAL 670  -0.773   0.881  -4.241
  219   HG23  VAL 670          2HG2      VAL 670  -1.501   1.920  -3.016
  220    H    THR 671           H        THR 671  -4.348  -0.445  -7.347
  221    HA   THR 671           HA       THR 671  -5.042   1.920  -8.921
  222    HB   THR 671           HB       THR 671  -6.369  -0.725  -9.390
  223    HG1  THR 671           1HG      THR 671  -3.724  -0.482  -9.178
  224   HG21  THR 671          3HG2      THR 671  -6.946   1.145 -10.822
  225   HG22  THR 671          1HG2      THR 671  -6.015  -0.028 -11.753
  226   HG23  THR 671          2HG2      THR 671  -5.246   1.448 -11.173
  227    H    VAL 672           H        VAL 672  -7.095   2.849  -8.885
  228    HA   VAL 672           HA       VAL 672  -8.629   2.165  -6.483
  229    HB   VAL 672           HB       VAL 672  -9.027   4.670  -8.094
  230   HG11  VAL 672          1HG1      VAL 672  -9.885   3.612  -5.492
  231   HG12  VAL 672          2HG1      VAL 672  -9.342   5.291  -5.461
  232   HG13  VAL 672          3HG1      VAL 672 -10.649   4.806  -6.543
  233   HG21  VAL 672          3HG2      VAL 672  -7.431   5.773  -6.502
  234   HG22  VAL 672          1HG2      VAL 672  -6.914   4.162  -6.004
  235   HG23  VAL 672          2HG2      VAL 672  -6.678   4.688  -7.670
  236    H    ILE 673           H        ILE 673 -10.437   1.046  -6.719
  237    HA   ILE 673           HA       ILE 673 -11.760   0.907  -9.300
  238    HB   ILE 673           HB       ILE 673 -12.054  -0.546  -6.700
  239   HG12  ILE 673          2HG1      ILE 673 -11.090  -2.175  -7.895
  240   HG13  ILE 673          1HG1      ILE 673 -12.476  -2.199  -8.975
  241   HG21  ILE 673          1HG2      ILE 673 -14.198  -1.322  -7.052
  242   HG22  ILE 673          2HG2      ILE 673 -14.334   0.366  -7.555
  243   HG23  ILE 673          3HG2      ILE 673 -14.180  -0.910  -8.767
  244   HD11  ILE 673          3HD1      ILE 673 -11.404  -0.519 -10.384
  245   HD12  ILE 673          1HD1      ILE 673 -10.022  -0.484  -9.290
  246   HD13  ILE 673          2HD1      ILE 673 -10.390  -1.949 -10.195
  247    H    ASP 674           H        ASP 674 -13.464   2.078  -9.870
  248    HA   ASP 674           HA       ASP 674 -14.280   4.218  -8.142
  249    HB2  ASP 674           2HB      ASP 674 -13.937   4.754 -10.449
  250    HB3  ASP 674           1HB      ASP 674 -15.024   3.470 -10.969
  251    H    THR 675           H        THR 675 -15.678   3.759  -6.564
  252    HA   THR 675           HA       THR 675 -18.175   2.382  -7.264
  253    HB   THR 675           HB       THR 675 -18.010   3.199  -4.495
  254    HG1  THR 675           1HG      THR 675 -16.220   1.914  -3.916
  255   HG21  THR 675          3HG2      THR 675 -19.235   1.247  -5.855
  256   HG22  THR 675          1HG2      THR 675 -18.891   1.130  -4.129
  257   HG23  THR 675          2HG2      THR 675 -17.822   0.349  -5.297
  258    H    LYS 676           H        LYS 676 -18.643   4.316  -8.567
  259    HA   LYS 676           HA       LYS 676 -18.667   6.925  -7.659
  260    HB2  LYS 676           2HB      LYS 676 -19.306   5.635 -10.013
  261    HB3  LYS 676           1HB      LYS 676 -20.834   6.351  -9.524
  262    HG2  LYS 676           2HG      LYS 676 -19.889   8.538  -9.493
  263    HG3  LYS 676           1HG      LYS 676 -18.260   7.895  -9.726
  264    HD2  LYS 676           2HD      LYS 676 -20.161   7.041 -11.774
  265    HD3  LYS 676           1HD      LYS 676 -19.923   8.790 -11.715
  266    HE2  LYS 676           2HE      LYS 676 -18.130   8.398 -12.995
  267    HE3  LYS 676           1HE      LYS 676 -17.367   7.862 -11.499
  268    HZ1  LYS 676           3HZ      LYS 676 -17.454   5.713 -12.111
  269    HZ2  LYS 676           1HZ      LYS 676 -17.503   6.364 -13.680
  270    HZ3  LYS 676           2HZ      LYS 676 -18.937   5.866 -12.920
  271    H    ASP 677           H        ASP 677 -21.339   4.572  -7.575
  272    HA   ASP 677           HA       ASP 677 -23.116   6.588  -6.524
  273    HB2  ASP 677           2HB      ASP 677 -23.605   4.465  -8.109
  274    HB3  ASP 677           1HB      ASP 677 -24.019   3.771  -6.542
  275    H    GLY 678           H        GLY 678 -20.798   5.645  -5.014
  276    HA2  GLY 678           1HA      GLY 678 -22.109   4.597  -2.605
  277    HA3  GLY 678           2HA      GLY 678 -20.373   4.728  -2.855
  278    H    SER 679           H        SER 679 -20.671   7.447  -3.948
  279    HA   SER 679           HA       SER 679 -20.771   8.867  -1.409
  280    HB2  SER 679           2HB      SER 679 -20.097  10.595  -3.572
  281    HB3  SER 679           1HB      SER 679 -19.041   9.970  -2.303
  282    HG   SER 679           HG       SER 679 -18.728   9.462  -4.760
  283    H    GLN 680           H        GLN 680 -22.700   8.381  -4.192
  284    HA   GLN 680           HA       GLN 680 -24.341  10.718  -3.474
  285    HB2  GLN 680           2HB      GLN 680 -25.165  10.410  -5.953
  286    HB3  GLN 680           1HB      GLN 680 -23.701  11.314  -5.593
  287    HG2  GLN 680           2HG      GLN 680 -22.314   9.563  -6.298
  288    HG3  GLN 680           1HG      GLN 680 -23.636   8.395  -6.270
  289   HE21  GLN 680          1HE2      GLN 680 -24.528   7.916  -8.145
  290   HE22  GLN 680          2HE2      GLN 680 -24.446   8.886  -9.581
  291    H    SER 681           H        SER 681 -24.476   7.419  -4.796
  292    HA   SER 681           HA       SER 681 -26.101   5.848  -4.852
  293    HB2  SER 681           2HB      SER 681 -26.883   7.283  -2.310
  294    HB3  SER 681           1HB      SER 681 -27.680   5.811  -2.864
  295    HG   SER 681           HG       SER 681 -25.073   5.381  -2.993
  296    H    LYS 682           H        LYS 682 -26.460   7.847  -6.575
  297    HA   LYS 682           HA       LYS 682 -29.258   8.719  -6.372
  298    HB2  LYS 682           2HB      LYS 682 -27.175  10.290  -6.789
  299    HB3  LYS 682           1HB      LYS 682 -27.374   9.752  -8.450
  300    HG2  LYS 682           2HG      LYS 682 -29.932  10.466  -7.624
  301    HG3  LYS 682           1HG      LYS 682 -28.867  11.707  -6.960
  302    HD2  LYS 682           2HD      LYS 682 -27.820  11.609  -9.381
  303    HD3  LYS 682           1HD      LYS 682 -29.418  10.990  -9.796
  304    HE2  LYS 682           2HE      LYS 682 -30.164  13.078  -9.848
  305    HE3  LYS 682           1HE      LYS 682 -29.839  13.198  -8.117
  306    HZ1  LYS 682           3HZ      LYS 682 -27.833  14.224  -8.471
  307    HZ2  LYS 682           1HZ      LYS 682 -28.756  14.867  -9.740
  308    HZ3  LYS 682           2HZ      LYS 682 -27.654  13.616 -10.044
  309    H    LEU 683           H        LEU 683 -27.117   6.638  -8.033
  310    HA   LEU 683           HA       LEU 683 -28.842   6.322 -10.348
  311    HB2  LEU 683           2HB      LEU 683 -26.407   4.734  -9.515
  312    HB3  LEU 683           1HB      LEU 683 -27.226   4.625 -11.061
  313    HG   LEU 683           HG       LEU 683 -26.125   7.262 -10.194
  314   HD11  LEU 683          1HD1      LEU 683 -24.536   4.946 -10.361
  315   HD12  LEU 683          2HD1      LEU 683 -24.232   5.880 -11.826
  316   HD13  LEU 683          3HD1      LEU 683 -24.006   6.623 -10.242
  317   HD21  LEU 683          3HD2      LEU 683 -25.607   6.837 -12.859
  318   HD22  LEU 683          1HD2      LEU 683 -27.145   6.006 -12.614
  319   HD23  LEU 683          2HD2      LEU 683 -26.989   7.715 -12.201
  320    H    GLY 684           H        GLY 684 -27.860   4.512  -7.474
  321    HA2  GLY 684           1HA      GLY 684 -30.435   3.365  -7.149
  322    HA3  GLY 684           2HA      GLY 684 -29.347   2.192  -7.879
  323    H    GLY 685           H        GLY 685 -27.074   2.264  -6.707
  324    HA2  GLY 685           1HA      GLY 685 -25.932   1.623  -4.827
  325    HA3  GLY 685           2HA      GLY 685 -27.045   2.628  -3.905
  326    H    GLY 901           H        GLY 901 -28.446   1.643  -2.598
  327    HA2  GLY 901           1HA      GLY 901 -28.891  -1.248  -2.969
  328    HA3  GLY 901           2HA      GLY 901 -29.056  -0.394  -1.437
  329    H    GLY 902           H        GLY 902 -30.956   0.605  -0.932
  330    HA2  GLY 902           1HA      GLY 902 -33.018   1.618  -1.319
  331    HA3  GLY 902           2HA      GLY 902 -32.877   1.202  -3.018
  332    H    SER 903           H        SER 903 -33.898   0.131   0.127
  333    HA   SER 903           HA       SER 903 -35.611  -1.850  -1.184
  334    HB2  SER 903           2HB      SER 903 -33.815  -2.325   1.198
  335    HB3  SER 903           1HB      SER 903 -35.200  -3.352   0.842
  336    HG   SER 903           HG       SER 903 -34.072  -3.368  -1.393
  337    H    GLY 904           H        GLY 904 -37.674  -1.709  -0.532
  338    HA2  GLY 904           1HA      GLY 904 -38.399   0.256   1.449
  339    HA3  GLY 904           2HA      GLY 904 -39.501  -0.747   0.514
  340    H    GLY 905           H        GLY 905 -38.306  -3.245   1.217
  341    HA2  GLY 905           1HA      GLY 905 -39.480  -3.606   3.839
  342    HA3  GLY 905           2HA      GLY 905 -38.838  -4.869   2.797
  343    H    HIS 906           H        HIS 906 -36.801  -5.597   3.112
  344    HA   HIS 906           HA       HIS 906 -35.083  -4.110   4.962
  345    HB2  HIS 906           2HB      HIS 906 -36.323  -6.693   5.470
  346    HB3  HIS 906           1HB      HIS 906 -34.568  -6.777   5.565
  347    HD1  HIS 906           1HD      HIS 906 -33.411  -5.457   7.484
  348    HD2  HIS 906           2HD      HIS 906 -37.565  -5.194   7.458
  349    HE1  HIS 906           1HE      HIS 906 -34.080  -4.465   9.715
  350    H    MET 907           H        MET 907 -32.849  -4.485   4.703
  351    HA   MET 907           HA       MET 907 -32.133  -5.240   2.004
  352    HB2  MET 907           2HB      MET 907 -31.193  -3.293   3.529
  353    HB3  MET 907           1HB      MET 907 -30.090  -4.549   4.074
  354    HG2  MET 907           2HG      MET 907 -29.000  -4.660   2.087
  355    HG3  MET 907           1HG      MET 907 -30.426  -4.206   1.154
  356    HE1  MET 907           3HE      MET 907 -26.939  -2.418   2.532
  357    HE2  MET 907           1HE      MET 907 -27.864  -1.468   3.695
  358    HE3  MET 907           2HE      MET 907 -27.962  -3.231   3.715
  359    H    GLY 908           H        GLY 908 -32.963  -7.511   2.694
  360    HA2  GLY 908           1HA      GLY 908 -30.681  -9.046   3.780
  361    HA3  GLY 908           2HA      GLY 908 -32.360  -9.510   4.006
  362    H    SER 909           H        SER 909 -29.640  -9.571   1.901
  363    HA   SER 909           HA       SER 909 -31.153 -11.012  -0.149
  364    HB2  SER 909           2HB      SER 909 -28.371 -10.769  -0.780
  365    HB3  SER 909           1HB      SER 909 -29.747 -10.004  -1.576
  366    HG   SER 909           HG       SER 909 -27.911  -8.760  -0.305
  367    H    GLY 910           H        GLY 910 -29.728 -12.884  -1.164
  368    HA2  GLY 910           1HA      GLY 910 -29.048 -14.661   1.073
  369    HA3  GLY 910           2HA      GLY 910 -29.405 -15.163  -0.573
  370    H    GLY 911           H        GLY 911 -27.128 -15.810   1.189
  371    HA2  GLY 911           1HA      GLY 911 -24.856 -16.108   0.998
  372    HA3  GLY 911           2HA      GLY 911 -25.023 -15.628  -0.685
  373    H    LEU  18           H        LEU  18 -24.202 -13.752  -1.297
  374    HA   LEU  18           HA       LEU  18 -24.032 -11.545   0.585
  375    HB2  LEU  18           2HB      LEU  18 -21.834 -12.795   0.632
  376    HB3  LEU  18           1HB      LEU  18 -21.635 -12.352  -1.054
  377    HG   LEU  18           HG       LEU  18 -21.580  -9.995  -0.478
  378   HD11  LEU  18          1HD1      LEU  18 -21.491 -10.459   2.429
  379   HD12  LEU  18          2HD1      LEU  18 -22.164  -9.113   1.512
  380   HD13  LEU  18          3HD1      LEU  18 -23.077 -10.612   1.674
  381   HD21  LEU  18          3HD2      LEU  18 -19.463  -9.921   0.481
  382   HD22  LEU  18          1HD2      LEU  18 -19.771 -11.332   1.494
  383   HD23  LEU  18          2HD2      LEU  18 -19.537 -11.527  -0.242
  384    H    SER  19           H        SER  19 -24.226  -9.569  -0.405
  385    HA   SER  19           HA       SER  19 -25.269  -9.694  -3.105
  386    HB2  SER  19           2HB      SER  19 -25.217  -7.113  -1.679
  387    HB3  SER  19           1HB      SER  19 -26.555  -7.922  -2.499
  388    HG   SER  19           HG       SER  19 -26.133  -7.774   0.093
  389    H    TRP  20           H        TRP  20 -22.525  -8.412  -1.384
  390    HA   TRP  20           HA       TRP  20 -21.678  -7.024  -3.831
  391    HB2  TRP  20           2HB      TRP  20 -20.150  -6.002  -1.699
  392    HB3  TRP  20           1HB      TRP  20 -21.413  -5.186  -2.600
  393    HD1  TRP  20           HD       TRP  20 -24.036  -5.786  -1.506
  394    HE1  TRP  20           1HE      TRP  20 -24.688  -5.716   0.983
  395    HE3  TRP  20           3HE      TRP  20 -19.387  -6.136   0.555
  396    HZ2  TRP  20           2HZ      TRP  20 -23.396  -5.751   3.488
  397    HZ3  TRP  20           3HZ      TRP  20 -19.174  -6.094   3.007
  398    HH2  TRP  20           HH       TRP  20 -21.139  -5.907   4.444
  399    H    LYS  21           H        LYS  21 -19.120  -6.946  -1.717
  400    HA   LYS  21           HA       LYS  21 -17.967  -9.320  -3.020
  401    HB2  LYS  21           2HB      LYS  21 -16.359  -6.862  -2.370
  402    HB3  LYS  21           1HB      LYS  21 -15.952  -8.181  -3.457
  403    HG2  LYS  21           2HG      LYS  21 -18.372  -6.650  -4.145
  404    HG3  LYS  21           1HG      LYS  21 -16.837  -5.786  -4.275
  405    HD2  LYS  21           2HD      LYS  21 -15.980  -7.697  -5.648
  406    HD3  LYS  21           1HD      LYS  21 -17.620  -8.358  -5.642
  407    HE2  LYS  21           2HE      LYS  21 -18.068  -5.788  -6.417
  408    HE3  LYS  21           1HE      LYS  21 -16.491  -6.104  -7.143
  409    HZ1  LYS  21           3HZ      LYS  21 -18.243  -8.297  -7.563
  410    HZ2  LYS  21           1HZ      LYS  21 -17.441  -7.326  -8.705
  411    HZ3  LYS  21           2HZ      LYS  21 -18.961  -6.862  -8.115
  412    H    ARG  22           H        ARG  22 -16.728 -10.646  -1.845
  413    HA   ARG  22           HA       ARG  22 -16.442 -10.155   1.009
  414    HB2  ARG  22           2HB      ARG  22 -17.151 -12.362   0.508
  415    HB3  ARG  22           1HB      ARG  22 -15.979 -12.530  -0.790
  416    HG2  ARG  22           2HG      ARG  22 -14.761 -12.057   1.819
  417    HG3  ARG  22           1HG      ARG  22 -15.716 -13.540   1.734
  418    HD2  ARG  22           2HD      ARG  22 -14.378 -14.466   0.101
  419    HD3  ARG  22           1HD      ARG  22 -13.832 -12.888  -0.475
  420    HE   ARG  22           HE       ARG  22 -12.298 -12.781   1.322
  421   HH11  ARG  22          2HH1      ARG  22 -14.019 -15.836   1.190
  422   HH12  ARG  22          1HH1      ARG  22 -12.848 -16.674   2.163
  423   HH21  ARG  22          2HH2      ARG  22 -10.738 -13.907   2.564
  424   HH22  ARG  22          1HH2      ARG  22 -10.983 -15.584   2.925
  425    H    CYS  23           H        CYS  23 -14.453  -9.872   2.014
  426    HA   CYS  23           HA       CYS  23 -12.482  -8.753   0.200
  427    HB2  CYS  23           2HB      CYS  23 -11.774  -7.409   1.966
  428    HB3  CYS  23           1HB      CYS  23 -13.517  -7.502   2.145
  429    H    ALA  24           H        ALA  24 -10.183  -9.005   0.623
  430    HA   ALA  24           HA       ALA  24  -9.664 -11.818   0.494
  431    HB1  ALA  24           1HB      ALA  24  -7.825 -11.270  -0.683
  432    HB2  ALA  24           2HB      ALA  24  -8.656  -9.720  -0.824
  433    HB3  ALA  24           3HB      ALA  24  -7.397  -9.938   0.390
  434    H    GLY  25           H        GLY  25  -8.332  -9.195   2.545
  435    HA2  GLY  25           1HA      GLY  25  -6.525 -10.943   3.884
  436    HA3  GLY  25           2HA      GLY  25  -6.904  -9.294   4.342
  437    H    CYS  26           H        CYS  26  -9.057  -9.004   5.469
  438    HA   CYS  26           HA       CYS  26  -9.217 -10.515   7.777
  439    HB2  CYS  26           2HB      CYS  26 -11.768  -9.358   6.789
  440    HB3  CYS  26           1HB      CYS  26 -11.004  -9.216   8.367
  441    H    GLY  27           H        GLY  27 -11.033 -10.874   4.769
  442    HA2  GLY  27           1HA      GLY  27 -11.824 -12.877   3.873
  443    HA3  GLY  27           2HA      GLY  27 -11.488 -13.670   5.407
  444    H    GLY  28           H        GLY  28 -13.361 -10.734   4.865
  445    HA2  GLY  28           1HA      GLY  28 -15.762 -12.230   5.723
  446    HA3  GLY  28           2HA      GLY  28 -15.388 -10.626   6.342
  447    H    LYS  29           H        LYS  29 -15.275  -8.875   4.785
  448    HA   LYS  29           HA       LYS  29 -16.233  -9.041   2.168
  449    HB2  LYS  29           2HB      LYS  29 -18.485  -7.903   2.602
  450    HB3  LYS  29           1HB      LYS  29 -18.396  -9.631   2.912
  451    HG2  LYS  29           2HG      LYS  29 -17.733  -8.486   5.341
  452    HG3  LYS  29           1HG      LYS  29 -19.015  -7.450   4.709
  453    HD2  LYS  29           2HD      LYS  29 -19.649 -10.226   4.279
  454    HD3  LYS  29           1HD      LYS  29 -19.302  -9.926   5.983
  455    HE2  LYS  29           2HE      LYS  29 -21.023  -7.946   4.626
  456    HE3  LYS  29           1HE      LYS  29 -21.719  -9.547   4.863
  457    HZ1  LYS  29           3HZ      LYS  29 -20.384  -8.384   7.171
  458    HZ2  LYS  29           1HZ      LYS  29 -21.832  -9.268   7.078
  459    HZ3  LYS  29           2HZ      LYS  29 -21.816  -7.616   6.688
  460    H    ILE  30           H        ILE  30 -16.062  -7.065   1.150
  461    HA   ILE  30           HA       ILE  30 -14.650  -5.029   2.576
  462    HB   ILE  30           HB       ILE  30 -15.797  -5.030  -0.223
  463   HG12  ILE  30          2HG1      ILE  30 -12.884  -5.077   0.376
  464   HG13  ILE  30          1HG1      ILE  30 -13.796  -6.555   0.661
  465   HG21  ILE  30          1HG2      ILE  30 -14.738  -3.010  -0.671
  466   HG22  ILE  30          2HG2      ILE  30 -15.408  -2.755   0.940
  467   HG23  ILE  30          3HG2      ILE  30 -13.697  -3.128   0.748
  468   HD11  ILE  30          3HD1      ILE  30 -14.593  -6.456  -1.677
  469   HD12  ILE  30          1HD1      ILE  30 -13.541  -5.063  -1.936
  470   HD13  ILE  30          2HD1      ILE  30 -12.846  -6.633  -1.530
  471    H    ALA  31           H        ALA  31 -15.670  -3.803   4.013
  472    HA   ALA  31           HA       ALA  31 -18.285  -2.669   3.273
  473    HB1  ALA  31           1HB      ALA  31 -18.144  -2.348   5.981
  474    HB2  ALA  31           2HB      ALA  31 -18.966  -3.671   5.157
  475    HB3  ALA  31           3HB      ALA  31 -17.321  -3.890   5.751
  476    H    ASP  32           H        ASP  32 -15.728  -1.606   2.521
  477    HA   ASP  32           HA       ASP  32 -15.402   0.777   4.170
  478    HB2  ASP  32           2HB      ASP  32 -13.860  -0.579   2.056
  479    HB3  ASP  32           1HB      ASP  32 -13.802   1.178   1.999
  480    H    ARG  33           H        ARG  33 -14.776   1.418   0.943
  481    HA   ARG  33           HA       ARG  33 -17.426   2.247   0.155
  482    HB2  ARG  33           2HB      ARG  33 -16.144   4.096   1.630
  483    HB3  ARG  33           1HB      ARG  33 -15.464   4.472   0.052
  484    HG2  ARG  33           2HG      ARG  33 -18.268   4.147  -0.249
  485    HG3  ARG  33           1HG      ARG  33 -17.975   5.218   1.121
  486    HD2  ARG  33           2HD      ARG  33 -17.245   5.571  -1.755
  487    HD3  ARG  33           1HD      ARG  33 -18.063   6.685  -0.664
  488    HE   ARG  33           HE       ARG  33 -15.227   6.378  -1.043
  489   HH11  ARG  33          2HH1      ARG  33 -17.701   7.459   1.222
  490   HH12  ARG  33          1HH1      ARG  33 -16.637   8.597   2.000
  491   HH21  ARG  33          2HH2      ARG  33 -13.865   7.871  -0.010
  492   HH22  ARG  33          1HH2      ARG  33 -14.480   8.828   1.311
  493    H    PHE  34           H        PHE  34 -14.115   3.267  -0.641
  494    HA   PHE  34           HA       PHE  34 -14.568   2.365  -3.380
  495    HB2  PHE  34           2HB      PHE  34 -12.831   4.372  -2.100
  496    HB3  PHE  34           1HB      PHE  34 -12.066   3.457  -3.399
  497    HD1  PHE  34           1HD      PHE  34 -15.510   4.786  -2.878
  498    HD2  PHE  34           2HD      PHE  34 -12.047   4.667  -5.345
  499    HE1  PHE  34           1HE      PHE  34 -16.669   6.148  -4.556
  500    HE2  PHE  34           2HE      PHE  34 -13.200   6.035  -7.034
  501    HZ   PHE  34           HZ       PHE  34 -15.515   6.772  -6.644
  502    H    LEU  35           H        LEU  35 -13.236   0.871  -4.383
  503    HA   LEU  35           HA       LEU  35 -12.040  -1.016  -2.510
  504    HB2  LEU  35           2HB      LEU  35 -12.864  -1.227  -5.396
  505    HB3  LEU  35           1HB      LEU  35 -11.951  -2.485  -4.587
  506    HG   LEU  35           HG       LEU  35 -13.951  -2.346  -2.850
  507   HD11  LEU  35          1HD1      LEU  35 -14.947  -0.432  -4.215
  508   HD12  LEU  35          2HD1      LEU  35 -15.396  -1.667  -5.390
  509   HD13  LEU  35          3HD1      LEU  35 -16.027  -1.743  -3.746
  510   HD21  LEU  35          3HD2      LEU  35 -13.162  -4.097  -4.793
  511   HD22  LEU  35          1HD2      LEU  35 -14.472  -4.374  -3.643
  512   HD23  LEU  35          2HD2      LEU  35 -14.830  -3.756  -5.256
  513    H    LEU  36           H        LEU  36  -9.934  -1.608  -2.551
  514    HA   LEU  36           HA       LEU  36  -8.187   0.109  -4.176
  515    HB2  LEU  36           2HB      LEU  36  -7.673  -1.289  -1.547
  516    HB3  LEU  36           1HB      LEU  36  -6.475  -0.369  -2.436
  517    HG   LEU  36           HG       LEU  36  -8.952   1.106  -1.841
  518   HD11  LEU  36          1HD1      LEU  36  -7.068   0.721   0.445
  519   HD12  LEU  36          2HD1      LEU  36  -8.737   1.295   0.447
  520   HD13  LEU  36          3HD1      LEU  36  -8.392  -0.418   0.196
  521   HD21  LEU  36          3HD2      LEU  36  -6.398   2.164  -0.940
  522   HD22  LEU  36          1HD2      LEU  36  -6.384   1.694  -2.639
  523   HD23  LEU  36          2HD2      LEU  36  -7.580   2.853  -2.052
  524    H    TYR  37           H        TYR  37  -7.063  -0.806  -5.718
  525    HA   TYR  37           HA       TYR  37  -7.056  -3.708  -5.964
  526    HB2  TYR  37           2HB      TYR  37  -7.287  -1.579  -7.754
  527    HB3  TYR  37           1HB      TYR  37  -5.686  -2.242  -8.060
  528    HD1  TYR  37           1HD      TYR  37  -7.109  -5.034  -6.965
  529    HD2  TYR  37           2HD      TYR  37  -7.581  -2.296 -10.179
  530    HE1  TYR  37           1HE      TYR  37  -8.094  -6.820  -8.324
  531    HE2  TYR  37           2HE      TYR  37  -8.574  -4.057 -11.551
  532    HH   TYR  37           HH       TYR  37  -8.250  -7.163 -11.071
  533    H    ALA  38           H        ALA  38  -5.480  -4.705  -4.940
  534    HA   ALA  38           HA       ALA  38  -2.737  -3.745  -5.373
  535    HB1  ALA  38           1HB      ALA  38  -2.116  -4.068  -3.154
  536    HB2  ALA  38           2HB      ALA  38  -3.697  -3.297  -3.032
  537    HB3  ALA  38           3HB      ALA  38  -3.546  -5.039  -2.802
  538    H    MET  39           H        MET  39  -1.391  -5.247  -6.079
  539    HA   MET  39           HA       MET  39  -0.476  -7.209  -6.707
  540    HB2  MET  39           2HB      MET  39  -2.349  -8.575  -4.772
  541    HB3  MET  39           1HB      MET  39  -0.854  -9.211  -5.441
  542    HG2  MET  39           2HG      MET  39   0.202  -7.118  -4.280
  543    HG3  MET  39           1HG      MET  39  -1.257  -7.190  -3.295
  544    HE1  MET  39           3HE      MET  39  -0.907  -7.824  -1.168
  545    HE2  MET  39           1HE      MET  39  -1.728  -9.355  -1.490
  546    HE3  MET  39           2HE      MET  39  -0.221  -9.338  -0.573
  547    H    ASP  40           H        ASP  40  -3.936  -7.878  -6.147
  548    HA   ASP  40           HA       ASP  40  -4.566  -8.192  -8.879
  549    HB2  ASP  40           2HB      ASP  40  -4.167 -10.367  -9.312
  550    HB3  ASP  40           1HB      ASP  40  -3.266 -10.438  -7.802
  551    H    SER  41           H        SER  41  -5.303  -8.308  -5.530
  552    HA   SER  41           HA       SER  41  -8.082  -9.088  -6.056
  553    HB2  SER  41           2HB      SER  41  -7.217  -8.804  -3.259
  554    HB3  SER  41           1HB      SER  41  -8.060 -10.137  -4.053
  555    HG   SER  41           HG       SER  41  -5.908 -10.572  -5.059
  556    H    TYR  42           H        TYR  42  -9.698  -8.010  -4.567
  557    HA   TYR  42           HA       TYR  42  -9.252  -5.116  -4.620
  558    HB2  TYR  42           2HB      TYR  42 -11.916  -5.560  -3.919
  559    HB3  TYR  42           1HB      TYR  42 -11.317  -5.112  -5.510
  560    HD1  TYR  42           2HD      TYR  42 -10.957  -6.864  -7.228
  561    HD2  TYR  42           1HD      TYR  42 -12.763  -7.743  -3.483
  562    HE1  TYR  42           2HE      TYR  42 -11.815  -8.977  -8.146
  563    HE2  TYR  42           1HE      TYR  42 -13.631  -9.856  -4.390
  564    HH   TYR  42           HH       TYR  42 -14.082 -10.585  -7.293
  565    H    TRP  43           H        TRP  43  -8.700  -4.173  -2.794
  566    HA   TRP  43           HA       TRP  43  -9.397  -5.508  -0.256
  567    HB2  TRP  43           2HB      TRP  43  -7.117  -3.567  -0.630
  568    HB3  TRP  43           1HB      TRP  43  -7.366  -4.699   0.691
  569    HD1  TRP  43           HD       TRP  43  -6.546  -4.792  -3.096
  570    HE1  TRP  43           1HE      TRP  43  -5.033  -6.820  -3.544
  571    HE3  TRP  43           3HE      TRP  43  -6.455  -6.797   1.605
  572    HZ2  TRP  43           2HZ      TRP  43  -3.942  -8.971  -2.111
  573    HZ3  TRP  43           3HZ      TRP  43  -5.140  -8.849   1.978
  574    HH2  TRP  43           HH       TRP  43  -3.911  -9.908   0.151
  575    H    HIS  44           H        HIS  44  -9.356  -3.942   1.612
  576    HA   HIS  44           HA       HIS  44 -10.313  -1.256   0.917
  577    HB2  HIS  44           2HB      HIS  44 -11.943  -1.373   2.805
  578    HB3  HIS  44           1HB      HIS  44 -12.321  -2.505   1.513
  579    HD1  HIS  44           1HD      HIS  44 -12.664  -2.521   4.952
  580    HD2  HIS  44           2HD      HIS  44 -10.679  -5.055   2.323
  581    HE1  HIS  44           1HE      HIS  44 -12.321  -4.736   6.184
  582    H    SER  45           H        SER  45 -10.462  -0.149   3.439
  583    HA   SER  45           HA       SER  45  -7.815   0.475   3.953
  584    HB2  SER  45           2HB      SER  45  -8.703   1.345   6.183
  585    HB3  SER  45           1HB      SER  45  -9.475   1.976   4.724
  586    HG   SER  45           HG       SER  45 -11.262   0.853   5.140
  587    H    ARG  46           H        ARG  46  -9.856  -1.876   5.634
  588    HA   ARG  46           HA       ARG  46  -7.816  -2.415   7.596
  589    HB2  ARG  46           2HB      ARG  46 -10.479  -3.770   7.155
  590    HB3  ARG  46           1HB      ARG  46  -9.442  -3.959   8.564
  591    HG2  ARG  46           2HG      ARG  46  -9.990  -1.915   9.418
  592    HG3  ARG  46           1HG      ARG  46 -10.310  -1.215   7.831
  593    HD2  ARG  46           2HD      ARG  46 -12.116  -3.393   8.587
  594    HD3  ARG  46           1HD      ARG  46 -12.215  -1.970   9.624
  595    HE   ARG  46           HE       ARG  46 -12.257  -1.219   6.889
  596   HH11  ARG  46          2HH1      ARG  46 -14.240  -2.581   9.427
  597   HH12  ARG  46          1HH1      ARG  46 -15.735  -2.080   8.706
  598   HH21  ARG  46          2HH2      ARG  46 -14.198  -0.573   5.913
  599   HH22  ARG  46          1HH2      ARG  46 -15.717  -0.937   6.687
  600    H    CYS  47           H        CYS  47  -8.355  -3.496   4.491
  601    HA   CYS  47           HA       CYS  47  -7.180  -6.132   5.010
  602    HB2  CYS  47           2HB      CYS  47  -8.992  -5.083   3.027
  603    HB3  CYS  47           1HB      CYS  47  -7.587  -5.801   2.248
  604    H    LEU  48           H        LEU  48  -6.742  -3.254   3.001
  605    HA   LEU  48           HA       LEU  48  -4.137  -4.072   2.124
  606    HB2  LEU  48           2HB      LEU  48  -6.051  -2.030   1.451
  607    HB3  LEU  48           1HB      LEU  48  -4.465  -1.320   1.654
  608    HG   LEU  48           HG       LEU  48  -5.450  -3.184  -0.427
  609   HD11  LEU  48          1HD1      LEU  48  -3.430  -1.701  -1.462
  610   HD12  LEU  48          2HD1      LEU  48  -5.127  -1.223  -1.448
  611   HD13  LEU  48          3HD1      LEU  48  -4.034  -0.635  -0.194
  612   HD21  LEU  48          3HD2      LEU  48  -3.778  -4.635  -0.235
  613   HD22  LEU  48          1HD2      LEU  48  -2.671  -3.318  -0.627
  614   HD23  LEU  48          2HD2      LEU  48  -3.033  -3.693   1.057
  615    H    LYS  49           H        LYS  49  -3.526  -4.394   4.419
  616    HA   LYS  49           HA       LYS  49  -1.943  -2.098   5.276
  617    HB2  LYS  49           2HB      LYS  49  -2.503  -2.902   7.705
  618    HB3  LYS  49           1HB      LYS  49  -3.615  -1.823   6.878
  619    HG2  LYS  49           2HG      LYS  49  -5.122  -3.329   7.619
  620    HG3  LYS  49           1HG      LYS  49  -4.669  -4.160   6.130
  621    HD2  LYS  49           2HD      LYS  49  -2.776  -5.073   7.867
  622    HD3  LYS  49           1HD      LYS  49  -4.175  -4.890   8.928
  623    HE2  LYS  49           2HE      LYS  49  -4.356  -7.077   8.129
  624    HE3  LYS  49           1HE      LYS  49  -5.469  -6.159   7.114
  625    HZ1  LYS  49           3HZ      LYS  49  -3.521  -7.814   6.212
  626    HZ2  LYS  49           1HZ      LYS  49  -2.797  -6.286   6.056
  627    HZ3  LYS  49           2HZ      LYS  49  -4.277  -6.601   5.298
  628    H    CYS  50           H        CYS  50  -0.083  -2.786   6.585
  629    HA   CYS  50           HA       CYS  50   0.919  -5.314   5.731
  630    HB2  CYS  50           2HB      CYS  50   2.912  -4.736   6.956
  631    HB3  CYS  50           1HB      CYS  50   2.356  -3.331   6.073
  632    H    SER  51           H        SER  51   1.350  -7.164   6.988
  633    HA   SER  51           HA       SER  51  -0.685  -7.629   8.960
  634    HB2  SER  51           2HB      SER  51   0.947  -9.876   8.914
  635    HB3  SER  51           1HB      SER  51  -0.496  -9.617   7.930
  636    HG   SER  51           HG       SER  51   2.194  -9.470   7.238
  637    H    SER  52           H        SER  52   2.418  -6.379   9.177
  638    HA   SER  52           HA       SER  52   3.016  -7.682  11.714
  639    HB2  SER  52           2HB      SER  52   4.867  -5.687  10.510
  640    HB3  SER  52           1HB      SER  52   5.222  -7.195  11.352
  641    HG   SER  52           HG       SER  52   5.037  -6.746   8.729
  642    H    CYS  53           H        CYS  53   2.683  -4.331  10.446
  643    HA   CYS  53           HA       CYS  53   2.354  -3.482  13.247
  644    HB2  CYS  53           2HB      CYS  53   2.688  -1.368  11.222
  645    HB3  CYS  53           1HB      CYS  53   3.405  -1.520  12.818
  646    H    GLN  54           H        GLN  54   0.700  -4.133  10.441
  647    HA   GLN  54           HA       GLN  54  -1.406  -3.802   9.713
  648    HB2  GLN  54           2HB      GLN  54  -1.634  -3.201  12.597
  649    HB3  GLN  54           1HB      GLN  54  -2.898  -2.514  11.585
  650    HG2  GLN  54           2HG      GLN  54  -2.498  -5.208  10.796
  651    HG3  GLN  54           1HG      GLN  54  -2.645  -5.159  12.552
  652   HE21  GLN  54          1HE2      GLN  54  -4.487  -6.312  10.690
  653   HE22  GLN  54          2HE2      GLN  54  -5.985  -5.462  10.865
  654    H    ALA  55           H        ALA  55   0.581  -2.016   9.039
  655    HA   ALA  55           HA       ALA  55  -0.426   0.683   9.313
  656    HB1  ALA  55           1HB      ALA  55   1.686   1.154   8.776
  657    HB2  ALA  55           2HB      ALA  55   1.997  -0.543   8.414
  658    HB3  ALA  55           3HB      ALA  55   1.395   0.531   7.152
  659    H    GLN  56           H        GLN  56  -2.301   1.124   8.357
  660    HA   GLN  56           HA       GLN  56  -3.384  -0.272   6.191
  661    HB2  GLN  56           2HB      GLN  56  -4.166   2.554   6.833
  662    HB3  GLN  56           1HB      GLN  56  -5.178   1.224   6.291
  663    HG2  GLN  56           2HG      GLN  56  -3.874   0.773   8.873
  664    HG3  GLN  56           1HG      GLN  56  -5.010   2.118   8.852
  665   HE21  GLN  56          1HE2      GLN  56  -7.182   1.717   8.465
  666   HE22  GLN  56          2HE2      GLN  56  -7.861   0.134   8.592
  667    H    LEU  57           H        LEU  57  -1.916  -0.366   4.533
  668    HA   LEU  57           HA       LEU  57  -0.656   1.879   3.358
  669    HB2  LEU  57           2HB      LEU  57  -1.198  -0.830   2.140
  670    HB3  LEU  57           1HB      LEU  57  -0.009   0.335   1.588
  671    HG   LEU  57           HG       LEU  57   0.234  -0.585   4.399
  672   HD11  LEU  57          1HD1      LEU  57  -0.299  -2.621   2.946
  673   HD12  LEU  57          2HD1      LEU  57   1.268  -2.327   2.189
  674   HD13  LEU  57          3HD1      LEU  57   1.174  -2.671   3.920
  675   HD21  LEU  57          3HD2      LEU  57   1.749   1.061   3.346
  676   HD22  LEU  57          1HD2      LEU  57   2.581  -0.383   3.924
  677   HD23  LEU  57          2HD2      LEU  57   2.254  -0.184   2.203
  678    H    GLY  58           H        GLY  58  -3.808   0.585   3.133
  679    HA2  GLY  58           1HA      GLY  58  -4.525   1.584   0.569
  680    HA3  GLY  58           2HA      GLY  58  -5.635   1.177   1.872
  681    H    ASP  59           H        ASP  59  -3.807   3.169   3.483
  682    HA   ASP  59           HA       ASP  59  -5.310   5.559   2.717
  683    HB2  ASP  59           2HB      ASP  59  -5.626   5.170   5.015
  684    HB3  ASP  59           1HB      ASP  59  -3.960   4.660   5.249
  685    H    ILE  60           H        ILE  60  -2.487   4.139   2.129
  686    HA   ILE  60           HA       ILE  60  -0.909   6.619   2.056
  687    HB   ILE  60           HB       ILE  60   0.179   3.813   1.811
  688   HG12  ILE  60          2HG1      ILE  60   0.115   5.521   4.305
  689   HG13  ILE  60          1HG1      ILE  60  -1.010   4.202   3.996
  690   HG21  ILE  60          1HG2      ILE  60   1.495   6.440   2.499
  691   HG22  ILE  60          2HG2      ILE  60   2.300   4.874   2.385
  692   HG23  ILE  60          3HG2      ILE  60   1.597   5.609   0.945
  693   HD11  ILE  60          3HD1      ILE  60   0.613   2.589   4.268
  694   HD12  ILE  60          1HD1      ILE  60   1.931   3.707   3.924
  695   HD13  ILE  60          2HD1      ILE  60   1.078   3.800   5.463
  696    H    GLY  61           H        GLY  61  -1.062   7.557   0.112
  697    HA2  GLY  61           1HA      GLY  61  -1.601   6.050  -2.281
  698    HA3  GLY  61           2HA      GLY  61  -1.309   7.780  -2.179
  699    H    THR  62           H        THR  62   1.185   6.536  -0.561
  700    HA   THR  62           HA       THR  62   3.007   6.917  -2.736
  701    HB   THR  62           HB       THR  62   4.000   5.775  -0.189
  702    HG1  THR  62           1HG      THR  62   2.726   8.330  -0.384
  703   HG21  THR  62          3HG2      THR  62   5.057   8.340  -0.950
  704   HG22  THR  62          1HG2      THR  62   5.018   7.266  -2.348
  705   HG23  THR  62          2HG2      THR  62   5.872   6.777  -0.883
  706    H    SER  63           H        SER  63   4.653   5.378  -3.330
  707    HA   SER  63           HA       SER  63   3.593   2.976  -4.231
  708    HB2  SER  63           2HB      SER  63   6.502   3.018  -4.037
  709    HB3  SER  63           1HB      SER  63   5.464   2.982  -5.467
  710    HG   SER  63           HG       SER  63   6.832   4.949  -5.058
  711    H    SER  64           H        SER  64   3.098   1.220  -3.108
  712    HA   SER  64           HA       SER  64   4.571   0.507  -0.700
  713    HB2  SER  64           2HB      SER  64   2.603  -1.444  -1.336
  714    HB3  SER  64           1HB      SER  64   2.541  -0.226  -0.059
  715    HG   SER  64           HG       SER  64   1.419   1.110  -1.371
  716    H    TYR  65           H        TYR  65   4.917  -2.030  -0.530
  717    HA   TYR  65           HA       TYR  65   6.156  -2.904  -3.050
  718    HB2  TYR  65           2HB      TYR  65   7.362  -3.248  -0.299
  719    HB3  TYR  65           1HB      TYR  65   8.078  -3.745  -1.829
  720    HD1  TYR  65           2HD      TYR  65   8.455  -1.816  -3.568
  721    HD2  TYR  65           1HD      TYR  65   7.942  -1.199   0.611
  722    HE1  TYR  65           2HE      TYR  65   9.538   0.378  -3.764
  723    HE2  TYR  65           1HE      TYR  65   9.020   1.001   0.426
  724    HH   TYR  65           HH       TYR  65   9.759   2.420  -2.671
  725    H    THR  66           H        THR  66   6.487  -5.215  -3.228
  726    HA   THR  66           HA       THR  66   5.098  -6.922  -1.342
  727    HB   THR  66           HB       THR  66   3.322  -6.085  -2.932
  728    HG1  THR  66           1HG      THR  66   2.757  -7.967  -2.007
  729   HG21  THR  66          3HG2      THR  66   4.664  -5.997  -4.971
  730   HG22  THR  66          1HG2      THR  66   3.266  -7.052  -5.187
  731   HG23  THR  66          2HG2      THR  66   4.865  -7.750  -4.925
  732    H    LYS  67           H        LYS  67   5.208  -9.267  -2.176
  733    HA   LYS  67           HA       LYS  67   7.286  -9.884  -4.043
  734    HB2  LYS  67           2HB      LYS  67   8.239  -9.258  -1.578
  735    HB3  LYS  67           1HB      LYS  67   7.971 -10.984  -1.388
  736    HG2  LYS  67           2HG      LYS  67   9.244 -10.944  -3.767
  737    HG3  LYS  67           1HG      LYS  67   9.966  -9.541  -2.984
  738    HD2  LYS  67           2HD      LYS  67   9.957 -11.468  -1.002
  739    HD3  LYS  67           1HD      LYS  67  10.359 -12.368  -2.464
  740    HE2  LYS  67           2HE      LYS  67  11.751  -9.795  -2.122
  741    HE3  LYS  67           1HE      LYS  67  12.166 -11.047  -0.955
  742    HZ1  LYS  67           3HZ      LYS  67  12.133 -11.670  -3.834
  743    HZ2  LYS  67           1HZ      LYS  67  12.996 -12.422  -2.581
  744    HZ3  LYS  67           2HZ      LYS  67  13.476 -10.896  -3.144
  745    H    SER  68           H        SER  68   6.535 -11.694  -1.121
  746    HA   SER  68           HA       SER  68   5.807 -13.988  -2.705
  747    HB2  SER  68           2HB      SER  68   5.395 -14.444   0.071
  748    HB3  SER  68           1HB      SER  68   6.739 -14.995  -0.929
  749    HG   SER  68           HG       SER  68   7.740 -13.758   0.518
  750    H    GLY  69           H        GLY  69   3.917 -11.820  -2.922
  751    HA2  GLY  69           1HA      GLY  69   1.632 -11.542  -2.932
  752    HA3  GLY  69           2HA      GLY  69   1.493 -13.192  -2.335
  753    H    MET  70           H        MET  70   3.365 -10.779  -0.694
  754    HA   MET  70           HA       MET  70   1.384 -10.768   1.478
  755    HB2  MET  70           2HB      MET  70   4.098 -11.583   1.503
  756    HB3  MET  70           1HB      MET  70   4.013 -10.073   2.400
  757    HG2  MET  70           2HG      MET  70   3.453 -11.338   4.139
  758    HG3  MET  70           1HG      MET  70   1.866 -11.446   3.381
  759    HE1  MET  70           3HE      MET  70   5.151 -14.488   3.790
  760    HE2  MET  70           1HE      MET  70   5.297 -13.717   2.210
  761    HE3  MET  70           2HE      MET  70   5.308 -12.734   3.675
  762    H    ILE  71           H        ILE  71   0.917  -8.854   2.462
  763    HA   ILE  71           HA       ILE  71   1.877  -6.437   1.102
  764    HB   ILE  71           HB       ILE  71  -0.143  -5.646   2.831
  765   HG12  ILE  71          2HG1      ILE  71  -2.025  -7.227   2.010
  766   HG13  ILE  71          1HG1      ILE  71  -0.729  -8.376   1.701
  767   HG21  ILE  71          1HG2      ILE  71   0.483  -5.379   0.210
  768   HG22  ILE  71          2HG2      ILE  71  -1.005  -6.322   0.112
  769   HG23  ILE  71          3HG2      ILE  71  -0.997  -4.773   0.955
  770   HD11  ILE  71          3HD1      ILE  71  -0.062  -8.003   4.140
  771   HD12  ILE  71          1HD1      ILE  71  -1.653  -7.258   4.319
  772   HD13  ILE  71          2HD1      ILE  71  -1.521  -8.942   3.813
  773    H    LEU  72           H        LEU  72   3.601  -5.615   2.088
  774    HA   LEU  72           HA       LEU  72   3.484  -5.255   5.003
  775    HB2  LEU  72           2HB      LEU  72   5.760  -6.021   3.210
  776    HB3  LEU  72           1HB      LEU  72   6.078  -5.150   4.697
  777    HG   LEU  72           HG       LEU  72   6.347  -7.278   5.433
  778   HD11  LEU  72          1HD1      LEU  72   4.041  -8.135   6.326
  779   HD12  LEU  72          2HD1      LEU  72   4.788  -6.678   6.986
  780   HD13  LEU  72          3HD1      LEU  72   3.494  -6.544   5.794
  781   HD21  LEU  72          3HD2      LEU  72   5.962  -8.378   3.336
  782   HD22  LEU  72          1HD2      LEU  72   5.095  -9.231   4.616
  783   HD23  LEU  72          2HD2      LEU  72   4.219  -8.169   3.514
  784    H    CYS  73           H        CYS  73   4.495  -3.310   5.797
  785    HA   CYS  73           HA       CYS  73   4.041  -1.068   4.096
  786    HB2  CYS  73           2HB      CYS  73   4.701   0.283   6.048
  787    HB3  CYS  73           1HB      CYS  73   3.511  -0.936   6.481
  788    H    ARG  74           H        ARG  74   5.839   0.734   4.223
  789    HA   ARG  74           HA       ARG  74   7.871  -0.074   2.486
  790    HB2  ARG  74           2HB      ARG  74   8.105   2.370   4.227
  791    HB3  ARG  74           1HB      ARG  74   8.690   2.135   2.586
  792    HG2  ARG  74           2HG      ARG  74   5.814   1.836   2.752
  793    HG3  ARG  74           1HG      ARG  74   6.351   3.406   3.352
  794    HD2  ARG  74           2HD      ARG  74   7.369   2.315   0.753
  795    HD3  ARG  74           1HD      ARG  74   5.818   3.149   0.838
  796    HE   ARG  74           HE       ARG  74   7.666   4.802   2.088
  797   HH11  ARG  74          2HH1      ARG  74   7.127   3.479  -1.121
  798   HH12  ARG  74          1HH1      ARG  74   7.961   4.779  -1.927
  799   HH21  ARG  74          2HH2      ARG  74   8.718   6.513   1.028
  800   HH22  ARG  74          1HH2      ARG  74   8.851   6.509  -0.703
  801    H    ASN  75           H        ASN  75   7.869   0.338   5.975
  802    HA   ASN  75           HA       ASN  75  10.705  -0.159   6.207
  803    HB2  ASN  75           2HB      ASN  75  10.383   0.954   8.122
  804    HB3  ASN  75           1HB      ASN  75   8.646   0.937   7.860
  805   HD21  ASN  75          1HD2      ASN  75   7.418  -0.820   8.744
  806   HD22  ASN  75          2HD2      ASN  75   8.012  -1.688  10.123
  807    H    ASP  76           H        ASP  76   7.758  -1.966   6.346
  808    HA   ASP  76           HA       ASP  76   8.710  -4.137   7.911
  809    HB2  ASP  76           2HB      ASP  76   6.264  -3.348   6.717
  810    HB3  ASP  76           1HB      ASP  76   6.622  -4.983   6.171
  811    H    TYR  77           H        TYR  77   8.172  -3.749   4.410
  812    HA   TYR  77           HA       TYR  77   8.783  -6.361   3.684
  813    HB2  TYR  77           2HB      TYR  77   7.758  -4.915   2.062
  814    HB3  TYR  77           1HB      TYR  77   9.122  -3.799   2.115
  815    HD1  TYR  77           2HD      TYR  77   8.525  -7.443   1.504
  816    HD2  TYR  77           1HD      TYR  77  10.616  -3.914   0.367
  817    HE1  TYR  77           2HE      TYR  77   9.642  -8.691  -0.290
  818    HE2  TYR  77           1HE      TYR  77  11.747  -5.156  -1.428
  819    HH   TYR  77           HH       TYR  77  12.364  -7.719  -1.768
  820    H    ILE  78           H        ILE  78  10.930  -3.571   4.013
  821    HA   ILE  78           HA       ILE  78  13.267  -4.787   3.036
  822    HB   ILE  78           HB       ILE  78  12.757  -2.445   4.847
  823   HG12  ILE  78          2HG1      ILE  78  12.298  -2.189   2.461
  824   HG13  ILE  78          1HG1      ILE  78  13.671  -1.195   2.934
  825   HG21  ILE  78          1HG2      ILE  78  15.517  -3.142   3.897
  826   HG22  ILE  78          2HG2      ILE  78  15.029  -1.947   5.099
  827   HG23  ILE  78          3HG2      ILE  78  14.910  -3.666   5.466
  828   HD11  ILE  78          3HD1      ILE  78  13.638  -2.772   0.763
  829   HD12  ILE  78          1HD1      ILE  78  15.107  -2.339   1.635
  830   HD13  ILE  78          2HD1      ILE  78  14.324  -3.887   1.943
  831    H    ARG  79           H        ARG  79  11.848  -4.648   6.248
  832    HA   ARG  79           HA       ARG  79  14.069  -5.914   7.547
  833    HB2  ARG  79           2HB      ARG  79  12.789  -4.457   8.887
  834    HB3  ARG  79           1HB      ARG  79  11.274  -5.183   8.376
  835    HG2  ARG  79           2HG      ARG  79  12.025  -7.278   9.582
  836    HG3  ARG  79           1HG      ARG  79  13.313  -6.291  10.278
  837    HD2  ARG  79           2HD      ARG  79  11.592  -6.232  11.871
  838    HD3  ARG  79           1HD      ARG  79  11.462  -4.696  11.013
  839    HE   ARG  79           HE       ARG  79   9.584  -5.640   9.793
  840   HH11  ARG  79          2HH1      ARG  79  10.623  -7.374  12.653
  841   HH12  ARG  79          1HH1      ARG  79   9.075  -8.126  12.912
  842   HH21  ARG  79          2HH2      ARG  79   7.550  -6.596  10.131
  843   HH22  ARG  79          1HH2      ARG  79   7.319  -7.656  11.498
  844    H    LEU  80           H        LEU  80  10.919  -6.956   6.342
  845    HA   LEU  80           HA       LEU  80  11.072  -9.592   7.412
  846    HB2  LEU  80           2HB      LEU  80   9.151  -7.998   6.125
  847    HB3  LEU  80           1HB      LEU  80   9.371  -9.396   5.087
  848    HG   LEU  80           HG       LEU  80   9.125 -10.633   7.474
  849   HD11  LEU  80          1HD1      LEU  80   8.325  -9.309   9.060
  850   HD12  LEU  80          2HD1      LEU  80   8.288  -7.944   7.943
  851   HD13  LEU  80          3HD1      LEU  80   6.897  -9.020   8.066
  852   HD21  LEU  80          3HD2      LEU  80   6.491 -10.225   6.626
  853   HD22  LEU  80          1HD2      LEU  80   7.492 -10.104   5.177
  854   HD23  LEU  80          2HD2      LEU  80   7.571 -11.550   6.185
  855    H    PHE  81           H        PHE  81  11.384  -8.358   4.079
  856    HA   PHE  81           HA       PHE  81  12.903 -10.802   3.427
  857    HB2  PHE  81           2HB      PHE  81  10.920  -9.256   1.748
  858    HB3  PHE  81           1HB      PHE  81  12.052 -10.408   1.050
  859    HD1  PHE  81           2HD      PHE  81   9.189 -10.029   3.332
  860    HD2  PHE  81           1HD      PHE  81  11.655 -12.734   1.170
  861    HE1  PHE  81           2HE      PHE  81   7.597 -11.844   3.797
  862    HE2  PHE  81           1HE      PHE  81  10.066 -14.557   1.625
  863    HZ   PHE  81           HZ       PHE  81   8.038 -14.114   2.945
  864    H    GLY  82           H        GLY  82  12.306  -7.841   1.606
  865    HA2  GLY  82           1HA      GLY  82  13.797  -6.167   0.982
  866    HA3  GLY  82           2HA      GLY  82  15.072  -7.014   1.853
  Start of MODEL   17
    1    H    SER 641           1H       SER 641  -1.522  18.917  19.603
    2    HA   SER 641           HA       SER 641  -2.681  20.995  19.089
    3    HB2  SER 641           2HB      SER 641   0.181  21.288  18.246
    4    HB3  SER 641           1HB      SER 641  -0.760  22.285  19.356
    5    HG   SER 641           HG       SER 641  -0.220  21.020  20.950
    6    H    LEU 642           H        LEU 642  -3.107  22.664  17.616
    7    HA   LEU 642           HA       LEU 642  -3.241  21.802  14.870
    8    HB2  LEU 642           2HB      LEU 642  -4.123  24.284  14.665
    9    HB3  LEU 642           1HB      LEU 642  -5.121  23.000  15.313
   10    HG   LEU 642           HG       LEU 642  -3.678  24.162  17.477
   11   HD11  LEU 642          1HD1      LEU 642  -3.392  26.260  16.722
   12   HD12  LEU 642          2HD1      LEU 642  -4.564  26.062  15.420
   13   HD13  LEU 642          3HD1      LEU 642  -5.117  26.415  17.058
   14   HD21  LEU 642          3HD2      LEU 642  -5.690  24.015  18.463
   15   HD22  LEU 642          1HD2      LEU 642  -6.518  24.815  17.126
   16   HD23  LEU 642          2HD2      LEU 642  -6.125  23.099  17.018
   17    H    GLN 643           H        GLN 643  -1.386  24.125  16.733
   18    HA   GLN 643           HA       GLN 643  -0.087  25.201  14.377
   19    HB2  GLN 643           2HB      GLN 643   1.174  25.845  16.930
   20    HB3  GLN 643           1HB      GLN 643   0.534  26.916  15.696
   21    HG2  GLN 643           2HG      GLN 643  -0.802  27.442  17.470
   22    HG3  GLN 643           1HG      GLN 643  -1.776  26.201  16.682
   23   HE21  GLN 643          1HE2      GLN 643   0.095  27.039  19.454
   24   HE22  GLN 643          2HE2      GLN 643  -0.271  25.630  20.392
   25    H    ASN 644           H        ASN 644   0.882  23.307  13.544
   26    HA   ASN 644           HA       ASN 644   3.420  22.705  14.869
   27    HB2  ASN 644           2HB      ASN 644   2.050  20.849  15.546
   28    HB3  ASN 644           1HB      ASN 644   1.434  20.634  13.911
   29   HD21  ASN 644          1HD2      ASN 644   4.576  20.806  15.577
   30   HD22  ASN 644          2HD2      ASN 644   5.288  19.482  14.713
   31    H    ASN 645           H        ASN 645   5.087  22.700  13.497
   32    HA   ASN 645           HA       ASN 645   4.502  22.475  10.616
   33    HB2  ASN 645           2HB      ASN 645   5.959  24.603  12.100
   34    HB3  ASN 645           1HB      ASN 645   6.626  24.108  10.550
   35   HD21  ASN 645          1HD2      ASN 645   5.759  24.901   8.737
   36   HD22  ASN 645          2HD2      ASN 645   4.306  25.855   8.673
   37    H    GLN 646           H        GLN 646   5.981  21.349   9.398
   38    HA   GLN 646           HA       GLN 646   8.183  20.089  10.898
   39    HB2  GLN 646           2HB      GLN 646   7.875  18.449   8.752
   40    HB3  GLN 646           1HB      GLN 646   7.128  18.186  10.318
   41    HG2  GLN 646           2HG      GLN 646   5.467  17.865   8.655
   42    HG3  GLN 646           1HG      GLN 646   5.108  19.383   9.477
   43   HE21  GLN 646          1HE2      GLN 646   4.272  20.731   8.074
   44   HE22  GLN 646          2HE2      GLN 646   4.859  21.035   6.469
   45    H    ASP 647           H        ASP 647   7.583  22.412   8.715
   46    HA   ASP 647           HA       ASP 647   9.873  21.812   6.989
   47    HB2  ASP 647           2HB      ASP 647   8.996  23.800   5.658
   48    HB3  ASP 647           1HB      ASP 647   7.996  22.354   5.657
   49    H    VAL 648           H        VAL 648  10.556  22.427   9.526
   50    HA   VAL 648           HA       VAL 648  10.989  25.118  10.137
   51    HB   VAL 648           HB       VAL 648  13.014  23.042  10.904
   52   HG11  VAL 648          1HG1      VAL 648  11.826  25.490  12.157
   53   HG12  VAL 648          2HG1      VAL 648  12.671  24.281  13.126
   54   HG13  VAL 648          3HG1      VAL 648  13.518  25.117  11.823
   55   HG21  VAL 648          3HG2      VAL 648  10.213  22.705  11.230
   56   HG22  VAL 648          1HG2      VAL 648  11.523  21.692  11.837
   57   HG23  VAL 648          2HG2      VAL 648  10.918  23.032  12.814
   58    H    SER 649           H        SER 649  13.402  22.817   8.863
   59    HA   SER 649           HA       SER 649  14.440  24.980   7.174
   60    HB2  SER 649           2HB      SER 649  16.374  23.040   8.364
   61    HB3  SER 649           1HB      SER 649  16.625  24.718   7.882
   62    HG   SER 649           HG       SER 649  15.518  23.674  10.250
   63    H    PHE 650           H        PHE 650  15.339  24.283   5.191
   64    HA   PHE 650           HA       PHE 650  14.339  21.671   4.352
   65    HB2  PHE 650           2HB      PHE 650  14.868  22.484   2.046
   66    HB3  PHE 650           1HB      PHE 650  13.723  23.502   2.909
   67    HD1  PHE 650           2HD      PHE 650  17.096  23.272   1.518
   68    HD2  PHE 650           1HD      PHE 650  14.319  25.731   3.603
   69    HE1  PHE 650           2HE      PHE 650  18.497  25.241   1.059
   70    HE2  PHE 650           1HE      PHE 650  15.710  27.705   3.141
   71    HZ   PHE 650           HZ       PHE 650  17.804  27.459   1.869
   72    H    GLU 651           H        GLU 651  17.176  23.071   5.419
   73    HA   GLU 651           HA       GLU 651  19.116  21.694   3.892
   74    HB2  GLU 651           2HB      GLU 651  19.272  22.751   6.718
   75    HB3  GLU 651           1HB      GLU 651  20.649  22.259   5.739
   76    HG2  GLU 651           2HG      GLU 651  20.755  24.428   5.223
   77    HG3  GLU 651           1HG      GLU 651  19.470  24.031   4.082
   78    H    ASN 652           H        ASN 652  17.019  20.675   6.420
   79    HA   ASN 652           HA       ASN 652  18.554  18.482   7.369
   80    HB2  ASN 652           2HB      ASN 652  16.176  19.675   8.117
   81    HB3  ASN 652           1HB      ASN 652  15.658  18.103   7.512
   82   HD21  ASN 652          1HD2      ASN 652  17.164  16.257   8.321
   83   HD22  ASN 652          2HD2      ASN 652  17.518  16.298  10.017
   84    H    ILE 653           H        ILE 653  16.375  18.947   4.691
   85    HA   ILE 653           HA       ILE 653  16.626  16.102   3.994
   86    HB   ILE 653           HB       ILE 653  14.794  17.250   2.229
   87   HG12  ILE 653          2HG1      ILE 653  14.801  19.063   4.182
   88   HG13  ILE 653          1HG1      ILE 653  13.313  18.588   3.377
   89   HG21  ILE 653          1HG2      ILE 653  13.563  15.854   4.436
   90   HG22  ILE 653          2HG2      ILE 653  13.754  15.366   2.752
   91   HG23  ILE 653          3HG2      ILE 653  15.053  15.071   3.908
   92   HD11  ILE 653          3HD1      ILE 653  13.235  18.759   5.893
   93   HD12  ILE 653          1HD1      ILE 653  12.643  17.248   5.198
   94   HD13  ILE 653          2HD1      ILE 653  14.244  17.314   5.934
   95    H    GLN 654           H        GLN 654  18.773  17.733   3.579
   96    HA   GLN 654           HA       GLN 654  18.787  18.582   0.808
   97    HB2  GLN 654           2HB      GLN 654  20.705  18.729   3.087
   98    HB3  GLN 654           1HB      GLN 654  21.354  18.821   1.456
   99    HG2  GLN 654           2HG      GLN 654  19.448  20.690   2.818
  100    HG3  GLN 654           1HG      GLN 654  21.024  21.039   2.111
  101   HE21  GLN 654          1HE2      GLN 654  17.672  20.917   1.598
  102   HE22  GLN 654          2HE2      GLN 654  17.678  21.275  -0.098
  103    H    TRP 655           H        TRP 655  19.364  15.755   2.563
  104    HA   TRP 655           HA       TRP 655  21.204  14.587   0.689
  105    HB2  TRP 655           2HB      TRP 655  21.075  12.594   2.009
  106    HB3  TRP 655           1HB      TRP 655  21.165  13.962   3.108
  107    HD1  TRP 655           HD       TRP 655  18.201  14.776   3.490
  108    HE1  TRP 655           1HE      TRP 655  16.510  13.176   4.599
  109    HE3  TRP 655           3HE      TRP 655  20.622  10.350   2.677
  110    HZ2  TRP 655           2HZ      TRP 655  16.251  10.412   5.070
  111    HZ3  TRP 655           3HZ      TRP 655  19.590   8.272   3.492
  112    HH2  TRP 655           HH       TRP 655  17.449   8.302   4.662
  113    H    SER 656           H        SER 656  20.703  12.698  -0.617
  114    HA   SER 656           HA       SER 656  18.249  13.268  -2.045
  115    HB2  SER 656           2HB      SER 656  20.438  11.324  -2.787
  116    HB3  SER 656           1HB      SER 656  19.215  12.017  -3.854
  117    HG   SER 656           HG       SER 656  20.304  14.100  -2.858
  118    H    ILE 657           H        ILE 657  16.500  12.342  -1.274
  119    HA   ILE 657           HA       ILE 657  16.420   9.731  -0.120
  120    HB   ILE 657           HB       ILE 657  14.417  11.825  -0.834
  121   HG12  ILE 657          2HG1      ILE 657  15.485  11.809   1.362
  122   HG13  ILE 657          1HG1      ILE 657  13.757  11.504   1.509
  123   HG21  ILE 657          1HG2      ILE 657  12.553  10.295  -0.186
  124   HG22  ILE 657          2HG2      ILE 657  13.276   9.942  -1.753
  125   HG23  ILE 657          3HG2      ILE 657  13.674   8.945  -0.355
  126   HD11  ILE 657          3HD1      ILE 657  16.055   9.722   2.041
  127   HD12  ILE 657          1HD1      ILE 657  14.533   9.913   2.916
  128   HD13  ILE 657          2HD1      ILE 657  14.577   8.995   1.410
  129    H    ASP 658           H        ASP 658  15.850   7.810  -1.056
  130    HA   ASP 658           HA       ASP 658  16.227   7.494  -3.843
  131    HB2  ASP 658           2HB      ASP 658  16.709   5.731  -2.136
  132    HB3  ASP 658           1HB      ASP 658  14.973   5.524  -1.920
  133    HA   PRO 659           HA       PRO 659  11.977   8.444  -4.853
  134    HB2  PRO 659           2HB      PRO 659  12.643   8.950  -7.515
  135    HB3  PRO 659           1HB      PRO 659  12.643  10.135  -6.209
  136    HG2  PRO 659           2HG      PRO 659  14.883   9.162  -7.649
  137    HG3  PRO 659           1HG      PRO 659  14.898  10.224  -6.233
  138    HD2  PRO 659           2HD      PRO 659  15.349   7.298  -6.411
  139    HD3  PRO 659           1HD      PRO 659  15.979   8.472  -5.236
  140    H    GLY 660           H        GLY 660  13.145   5.655  -4.979
  141    HA2  GLY 660           1HA      GLY 660  11.952   3.713  -5.624
  142    HA3  GLY 660           2HA      GLY 660  11.215   4.630  -6.933
  143    H    ALA 661           H        ALA 661  14.640   4.658  -6.224
  144    HA   ALA 661           HA       ALA 661  15.308   3.997  -8.919
  145    HB1  ALA 661           1HB      ALA 661  17.066   5.184  -8.184
  146    HB2  ALA 661           2HB      ALA 661  16.743   4.787  -6.496
  147    HB3  ALA 661           3HB      ALA 661  17.635   3.656  -7.513
  148    H    ASP 662           H        ASP 662  15.229   2.290  -5.867
  149    HA   ASP 662           HA       ASP 662  15.338  -0.220  -7.387
  150    HB2  ASP 662           2HB      ASP 662  17.366   0.346  -5.810
  151    HB3  ASP 662           1HB      ASP 662  16.250  -0.150  -4.539
  152    H    LEU 663           H        LEU 663  14.336  -2.042  -6.039
  153    HA   LEU 663           HA       LEU 663  12.534  -2.969  -5.023
  154    HB2  LEU 663           2HB      LEU 663  12.762  -0.401  -3.605
  155    HB3  LEU 663           1HB      LEU 663  11.148  -1.086  -3.604
  156    HG   LEU 663           HG       LEU 663  12.298  -3.249  -2.778
  157   HD11  LEU 663          1HD1      LEU 663  14.339  -1.527  -1.537
  158   HD12  LEU 663          2HD1      LEU 663  14.435  -3.210  -2.062
  159   HD13  LEU 663          3HD1      LEU 663  14.583  -1.906  -3.242
  160   HD21  LEU 663          3HD2      LEU 663  12.529  -1.221  -0.663
  161   HD22  LEU 663          1HD2      LEU 663  10.994  -1.238  -1.531
  162   HD23  LEU 663          2HD2      LEU 663  11.567  -2.697  -0.724
  163    H    SER 664           H        SER 664  12.516  -0.883  -7.404
  164    HA   SER 664           HA       SER 664   9.855  -0.012  -7.684
  165    HB2  SER 664           2HB      SER 664  11.285  -0.520 -10.186
  166    HB3  SER 664           1HB      SER 664  10.694   1.003  -9.517
  167    HG   SER 664           HG       SER 664  12.618   1.412  -8.780
  168    H    GLN 665           H        GLN 665  11.523  -2.980  -8.604
  169    HA   GLN 665           HA       GLN 665   9.239  -3.967 -10.096
  170    HB2  GLN 665           2HB      GLN 665  11.789  -5.368  -9.270
  171    HB3  GLN 665           1HB      GLN 665  10.593  -5.997 -10.395
  172    HG2  GLN 665           2HG      GLN 665  12.277  -3.531 -10.787
  173    HG3  GLN 665           1HG      GLN 665  12.513  -5.092 -11.569
  174   HE21  GLN 665          1HE2      GLN 665  11.819  -2.267 -12.473
  175   HE22  GLN 665          2HE2      GLN 665  10.478  -2.506 -13.553
  176    H    TYR 666           H        TYR 666  10.064  -3.744  -6.881
  177    HA   TYR 666           HA       TYR 666   8.814  -6.260  -6.082
  178    HB2  TYR 666           2HB      TYR 666  10.098  -4.085  -4.419
  179    HB3  TYR 666           1HB      TYR 666   9.463  -5.599  -3.786
  180    HD1  TYR 666           1HD      TYR 666  10.640  -7.047  -6.450
  181    HD2  TYR 666           2HD      TYR 666  12.237  -4.661  -3.310
  182    HE1  TYR 666           1HE      TYR 666  12.841  -8.095  -6.778
  183    HE2  TYR 666           2HE      TYR 666  14.441  -5.701  -3.630
  184    HH   TYR 666           HH       TYR 666  15.266  -8.024  -4.604
  185    H    LYS 667           H        LYS 667   7.990  -3.011  -6.584
  186    HA   LYS 667           HA       LYS 667   6.061  -2.781  -4.485
  187    HB2  LYS 667           2HB      LYS 667   5.772  -0.598  -5.176
  188    HB3  LYS 667           1HB      LYS 667   7.417  -0.917  -5.689
  189    HG2  LYS 667           2HG      LYS 667   6.889  -0.334  -7.754
  190    HG3  LYS 667           1HG      LYS 667   5.702  -1.639  -7.826
  191    HD2  LYS 667           2HD      LYS 667   4.254   0.101  -6.446
  192    HD3  LYS 667           1HD      LYS 667   5.324   1.258  -7.242
  193    HE2  LYS 667           2HE      LYS 667   4.627  -0.375  -9.312
  194    HE3  LYS 667           1HE      LYS 667   3.153  -0.384  -8.345
  195    HZ1  LYS 667           3HZ      LYS 667   2.659   1.633  -9.081
  196    HZ2  LYS 667           1HZ      LYS 667   4.011   1.582 -10.107
  197    HZ3  LYS 667           2HZ      LYS 667   4.153   2.255  -8.559
  198    H    MET 668           H        MET 668   3.874  -2.888  -4.581
  199    HA   MET 668           HA       MET 668   2.679  -3.874  -7.085
  200    HB2  MET 668           2HB      MET 668   0.684  -4.394  -5.638
  201    HB3  MET 668           1HB      MET 668   2.124  -5.317  -5.238
  202    HG2  MET 668           2HG      MET 668   2.567  -3.849  -3.358
  203    HG3  MET 668           1HG      MET 668   1.161  -2.870  -3.771
  204    HE1  MET 668           3HE      MET 668   0.862  -7.272  -3.152
  205    HE2  MET 668           1HE      MET 668   2.321  -6.345  -3.500
  206    HE3  MET 668           2HE      MET 668   1.863  -6.674  -1.831
  207    H    ASP 669           H        ASP 669   0.699  -2.828  -7.799
  208    HA   ASP 669           HA       ASP 669   0.925   0.039  -7.360
  209    HB2  ASP 669           2HB      ASP 669   0.593  -1.397  -9.645
  210    HB3  ASP 669           1HB      ASP 669  -1.070  -0.929  -9.299
  211    H    VAL 670           H        VAL 670  -0.310   1.040  -5.962
  212    HA   VAL 670           HA       VAL 670  -2.648  -0.271  -4.870
  213    HB   VAL 670           HB       VAL 670  -1.775   2.524  -4.183
  214   HG11  VAL 670          1HG1      VAL 670  -3.111   2.324  -2.378
  215   HG12  VAL 670          2HG1      VAL 670  -3.900   1.080  -3.346
  216   HG13  VAL 670          3HG1      VAL 670  -2.705   0.627  -2.131
  217   HG21  VAL 670          3HG2      VAL 670  -0.271   1.640  -2.495
  218   HG22  VAL 670          1HG2      VAL 670  -0.637  -0.009  -3.005
  219   HG23  VAL 670          2HG2      VAL 670   0.219   1.080  -4.095
  220    H    THR 671           H        THR 671  -4.219  -0.263  -6.402
  221    HA   THR 671           HA       THR 671  -4.993   2.287  -7.614
  222    HB   THR 671           HB       THR 671  -6.513  -0.163  -8.308
  223    HG1  THR 671           1HG      THR 671  -3.756  -0.075  -8.352
  224   HG21  THR 671          3HG2      THR 671  -5.870   2.379  -9.441
  225   HG22  THR 671          1HG2      THR 671  -6.994   1.160 -10.038
  226   HG23  THR 671          2HG2      THR 671  -5.301   1.118 -10.534
  227    H    VAL 672           H        VAL 672  -7.041   3.190  -7.311
  228    HA   VAL 672           HA       VAL 672  -8.646   1.956  -5.162
  229    HB   VAL 672           HB       VAL 672  -8.686   4.912  -5.686
  230   HG11  VAL 672          1HG1      VAL 672  -8.938   4.228  -2.955
  231   HG12  VAL 672          2HG1      VAL 672 -10.175   4.855  -4.044
  232   HG13  VAL 672          3HG1      VAL 672  -9.950   3.114  -3.872
  233   HG21  VAL 672          3HG2      VAL 672  -6.347   4.451  -5.318
  234   HG22  VAL 672          1HG2      VAL 672  -7.021   5.202  -3.870
  235   HG23  VAL 672          2HG2      VAL 672  -6.725   3.463  -3.907
  236    H    ILE 673           H        ILE 673 -10.724   1.550  -5.634
  237    HA   ILE 673           HA       ILE 673 -11.629   2.134  -8.324
  238    HB   ILE 673           HB       ILE 673 -12.725   0.436  -6.099
  239   HG12  ILE 673          2HG1      ILE 673 -12.643  -1.082  -8.363
  240   HG13  ILE 673          1HG1      ILE 673 -11.321   0.039  -8.670
  241   HG21  ILE 673          1HG2      ILE 673 -14.413   1.843  -7.692
  242   HG22  ILE 673          2HG2      ILE 673 -14.184   0.382  -8.654
  243   HG23  ILE 673          3HG2      ILE 673 -14.785   0.264  -7.000
  244   HD11  ILE 673          3HD1      ILE 673 -10.008  -0.887  -7.102
  245   HD12  ILE 673          1HD1      ILE 673 -11.348  -1.174  -5.992
  246   HD13  ILE 673          2HD1      ILE 673 -11.060  -2.282  -7.336
  247    H    ASP 674           H        ASP 674 -12.826   3.786  -8.863
  248    HA   ASP 674           HA       ASP 674 -13.757   5.642  -6.872
  249    HB2  ASP 674           2HB      ASP 674 -12.797   6.073  -9.273
  250    HB3  ASP 674           1HB      ASP 674 -14.461   5.812  -9.780
  251    H    THR 675           H        THR 675 -15.276   4.112  -5.832
  252    HA   THR 675           HA       THR 675 -17.711   3.531  -7.300
  253    HB   THR 675           HB       THR 675 -18.022   3.018  -4.511
  254    HG1  THR 675           1HG      THR 675 -16.176   2.111  -3.934
  255   HG21  THR 675          3HG2      THR 675 -17.476   1.123  -6.801
  256   HG22  THR 675          1HG2      THR 675 -19.055   1.784  -6.382
  257   HG23  THR 675          2HG2      THR 675 -18.221   0.714  -5.257
  258    H    LYS 676           H        LYS 676 -17.877   6.006  -7.575
  259    HA   LYS 676           HA       LYS 676 -19.034   7.349  -5.278
  260    HB2  LYS 676           2HB      LYS 676 -19.025   9.331  -6.591
  261    HB3  LYS 676           1HB      LYS 676 -17.515   8.500  -6.932
  262    HG2  LYS 676           2HG      LYS 676 -18.429   7.669  -9.030
  263    HG3  LYS 676           1HG      LYS 676 -19.968   8.465  -8.682
  264    HD2  LYS 676           2HD      LYS 676 -18.737  10.637  -8.605
  265    HD3  LYS 676           1HD      LYS 676 -17.293   9.778  -9.154
  266    HE2  LYS 676           2HE      LYS 676 -19.745   9.351 -10.737
  267    HE3  LYS 676           1HE      LYS 676 -19.049  10.970 -10.812
  268    HZ1  LYS 676           3HZ      LYS 676 -18.218   9.430 -12.539
  269    HZ2  LYS 676           1HZ      LYS 676 -17.516   8.476 -11.322
  270    HZ3  LYS 676           2HZ      LYS 676 -16.986  10.071 -11.564
  271    H    ASP 677           H        ASP 677 -20.128   5.233  -7.554
  272    HA   ASP 677           HA       ASP 677 -22.741   6.376  -7.968
  273    HB2  ASP 677           2HB      ASP 677 -21.487   4.736  -9.538
  274    HB3  ASP 677           1HB      ASP 677 -22.068   3.485  -8.441
  275    H    GLY 678           H        GLY 678 -23.521   6.713  -5.927
  276    HA2  GLY 678           1HA      GLY 678 -25.178   4.991  -4.693
  277    HA3  GLY 678           2HA      GLY 678 -23.619   4.570  -3.987
  278    H    SER 679           H        SER 679 -22.572   7.252  -4.154
  279    HA   SER 679           HA       SER 679 -23.754   8.414  -1.814
  280    HB2  SER 679           2HB      SER 679 -21.933  10.194  -3.127
  281    HB3  SER 679           1HB      SER 679 -21.685   9.270  -1.642
  282    HG   SER 679           HG       SER 679 -20.141   8.719  -3.242
  283    H    GLN 680           H        GLN 680 -24.188   8.677  -5.187
  284    HA   GLN 680           HA       GLN 680 -25.468  11.289  -5.004
  285    HB2  GLN 680           2HB      GLN 680 -25.695  11.063  -7.492
  286    HB3  GLN 680           1HB      GLN 680 -24.041  11.077  -6.902
  287    HG2  GLN 680           2HG      GLN 680 -23.648   9.185  -7.975
  288    HG3  GLN 680           1HG      GLN 680 -24.876   8.375  -7.002
  289   HE21  GLN 680          1HE2      GLN 680 -24.560   7.395  -9.434
  290   HE22  GLN 680          2HE2      GLN 680 -25.843   7.873 -10.490
  291    H    SER 681           H        SER 681 -27.540  11.419  -4.554
  292    HA   SER 681           HA       SER 681 -29.269   9.099  -4.988
  293    HB2  SER 681           2HB      SER 681 -30.616  11.179  -3.590
  294    HB3  SER 681           1HB      SER 681 -30.036   9.639  -2.951
  295    HG   SER 681           HG       SER 681 -29.178  11.704  -2.002
  296    H    LYS 682           H        LYS 682 -28.403  11.003  -7.101
  297    HA   LYS 682           HA       LYS 682 -30.924  12.323  -7.783
  298    HB2  LYS 682           2HB      LYS 682 -28.239  13.051  -8.094
  299    HB3  LYS 682           1HB      LYS 682 -28.799  12.675  -9.716
  300    HG2  LYS 682           2HG      LYS 682 -30.354  14.374  -9.724
  301    HG3  LYS 682           1HG      LYS 682 -30.432  14.453  -7.962
  302    HD2  LYS 682           2HD      LYS 682 -28.669  15.858  -7.825
  303    HD3  LYS 682           1HD      LYS 682 -27.795  15.049  -9.128
  304    HE2  LYS 682           2HE      LYS 682 -28.619  16.428 -10.706
  305    HE3  LYS 682           1HE      LYS 682 -30.214  16.498  -9.954
  306    HZ1  LYS 682           3HZ      LYS 682 -27.927  17.865  -8.694
  307    HZ2  LYS 682           1HZ      LYS 682 -29.584  18.212  -8.572
  308    HZ3  LYS 682           2HZ      LYS 682 -28.738  18.597  -9.989
  309    H    LEU 683           H        LEU 683 -29.641   9.379  -8.144
  310    HA   LEU 683           HA       LEU 683 -30.377   9.007 -10.941
  311    HB2  LEU 683           2HB      LEU 683 -28.399   7.898  -9.323
  312    HB3  LEU 683           1HB      LEU 683 -29.578   6.615  -9.491
  313    HG   LEU 683           HG       LEU 683 -27.521   7.166 -11.236
  314   HD11  LEU 683          1HD1      LEU 683 -28.423   5.409 -12.547
  315   HD12  LEU 683          2HD1      LEU 683 -28.842   5.067 -10.870
  316   HD13  LEU 683          3HD1      LEU 683 -30.057   5.722 -11.965
  317   HD21  LEU 683          3HD2      LEU 683 -28.442   7.966 -13.283
  318   HD22  LEU 683          1HD2      LEU 683 -30.068   8.023 -12.601
  319   HD23  LEU 683          2HD2      LEU 683 -28.834   9.149 -12.035
  320    H    GLY 684           H        GLY 684 -32.648   9.495 -10.349
  321    HA2  GLY 684           1HA      GLY 684 -34.192   7.837  -8.685
  322    HA3  GLY 684           2HA      GLY 684 -34.811   8.792 -10.026
  323    H    GLY 685           H        GLY 685 -33.827   7.740 -12.216
  324    HA2  GLY 685           1HA      GLY 685 -35.086   5.153 -12.385
  325    HA3  GLY 685           2HA      GLY 685 -34.353   6.053 -13.707
  326    H    GLY 901           H        GLY 901 -33.938   3.596 -11.357
  327    HA2  GLY 901           1HA      GLY 901 -31.080   3.385 -11.595
  328    HA3  GLY 901           2HA      GLY 901 -32.156   2.228 -10.823
  329    H    GLY 902           H        GLY 902 -33.740   2.373 -13.476
  330    HA2  GLY 902           1HA      GLY 902 -31.930   1.169 -15.379
  331    HA3  GLY 902           2HA      GLY 902 -33.082   0.044 -14.672
  332    H    SER 903           H        SER 903 -33.908  -0.244 -16.816
  333    HA   SER 903           HA       SER 903 -35.165   1.879 -18.225
  334    HB2  SER 903           2HB      SER 903 -36.345  -0.563 -18.981
  335    HB3  SER 903           1HB      SER 903 -35.018   0.276 -19.787
  336    HG   SER 903           HG       SER 903 -34.546  -1.932 -19.122
  337    H    GLY 904           H        GLY 904 -36.222  -0.508 -15.869
  338    HA2  GLY 904           1HA      GLY 904 -38.055  -0.146 -14.397
  339    HA3  GLY 904           2HA      GLY 904 -38.758   0.944 -15.585
  340    H    GLY 905           H        GLY 905 -37.599  -2.413 -15.617
  341    HA2  GLY 905           1HA      GLY 905 -40.264  -3.332 -16.371
  342    HA3  GLY 905           2HA      GLY 905 -38.996  -3.556 -17.568
  343    H    HIS 906           H        HIS 906 -36.925  -4.064 -15.582
  344    HA   HIS 906           HA       HIS 906 -37.834  -6.598 -14.419
  345    HB2  HIS 906           2HB      HIS 906 -36.697  -6.974 -16.648
  346    HB3  HIS 906           1HB      HIS 906 -35.225  -6.326 -15.929
  347    HD1  HIS 906           1HD      HIS 906 -33.697  -8.196 -15.280
  348    HD2  HIS 906           2HD      HIS 906 -37.699  -9.183 -14.743
  349    HE1  HIS 906           1HE      HIS 906 -33.729 -10.540 -14.337
  350    H    MET 907           H        MET 907 -37.672  -6.058 -12.316
  351    HA   MET 907           HA       MET 907 -35.201  -4.831 -11.338
  352    HB2  MET 907           2HB      MET 907 -36.349  -4.441  -9.284
  353    HB3  MET 907           1HB      MET 907 -37.462  -4.014 -10.575
  354    HG2  MET 907           2HG      MET 907 -38.963  -5.311  -9.602
  355    HG3  MET 907           1HG      MET 907 -37.977  -6.698 -10.058
  356    HE1  MET 907           3HE      MET 907 -38.410  -8.235  -6.899
  357    HE2  MET 907           1HE      MET 907 -38.368  -8.236  -8.661
  358    HE3  MET 907           2HE      MET 907 -36.868  -8.364  -7.742
  359    H    GLY 908           H        GLY 908 -34.552  -5.821  -9.057
  360    HA2  GLY 908           1HA      GLY 908 -34.517  -7.967  -7.830
  361    HA3  GLY 908           2HA      GLY 908 -34.467  -8.758  -9.400
  362    H    SER 909           H        SER 909 -32.676  -6.325  -7.526
  363    HA   SER 909           HA       SER 909 -30.231  -6.816  -8.901
  364    HB2  SER 909           2HB      SER 909 -30.285  -5.557  -6.188
  365    HB3  SER 909           1HB      SER 909 -29.350  -5.105  -7.613
  366    HG   SER 909           HG       SER 909 -30.942  -3.888  -8.285
  367    H    GLY 910           H        GLY 910 -29.503  -8.870  -8.757
  368    HA2  GLY 910           1HA      GLY 910 -29.354 -10.151  -6.127
  369    HA3  GLY 910           2HA      GLY 910 -29.121 -10.942  -7.678
  370    H    GLY 911           H        GLY 911 -27.253 -11.785  -6.284
  371    HA2  GLY 911           1HA      GLY 911 -24.953 -11.887  -6.107
  372    HA3  GLY 911           2HA      GLY 911 -24.860 -10.433  -7.095
  373    H    LEU  18           H        LEU  18 -26.372 -11.098  -3.961
  374    HA   LEU  18           HA       LEU  18 -25.582  -8.572  -2.898
  375    HB2  LEU  18           2HB      LEU  18 -27.182 -10.878  -2.018
  376    HB3  LEU  18           1HB      LEU  18 -26.373 -10.013  -0.725
  377    HG   LEU  18           HG       LEU  18 -27.554  -8.029  -2.318
  378   HD11  LEU  18          1HD1      LEU  18 -29.996  -9.036  -1.858
  379   HD12  LEU  18          2HD1      LEU  18 -29.163  -9.178  -3.405
  380   HD13  LEU  18          3HD1      LEU  18 -29.133 -10.520  -2.261
  381   HD21  LEU  18          3HD2      LEU  18 -28.855  -7.595  -0.330
  382   HD22  LEU  18          1HD2      LEU  18 -28.524  -9.218   0.278
  383   HD23  LEU  18          2HD2      LEU  18 -27.213  -8.048   0.128
  384    H    SER  19           H        SER  19 -23.767 -11.192  -3.459
  385    HA   SER  19           HA       SER  19 -22.229 -11.262  -1.017
  386    HB2  SER  19           2HB      SER  19 -20.803 -12.507  -3.101
  387    HB3  SER  19           1HB      SER  19 -21.803 -13.299  -1.878
  388    HG   SER  19           HG       SER  19 -22.257 -13.007  -4.527
  389    H    TRP  20           H        TRP  20 -22.229  -9.676  -4.080
  390    HA   TRP  20           HA       TRP  20 -20.779  -8.366  -5.229
  391    HB2  TRP  20           2HB      TRP  20 -19.627  -7.278  -2.709
  392    HB3  TRP  20           1HB      TRP  20 -20.135  -6.435  -4.162
  393    HD1  TRP  20           HD       TRP  20 -23.126  -6.909  -4.389
  394    HE1  TRP  20           1HE      TRP  20 -24.772  -6.174  -2.551
  395    HE3  TRP  20           3HE      TRP  20 -19.884  -6.638  -0.447
  396    HZ2  TRP  20           2HZ      TRP  20 -24.708  -5.572   0.200
  397    HZ3  TRP  20           3HZ      TRP  20 -20.758  -5.977   1.757
  398    HH2  TRP  20           HH       TRP  20 -23.120  -5.455   2.067
  399    H    LYS  21           H        LYS  21 -18.522  -8.227  -2.638
  400    HA   LYS  21           HA       LYS  21 -16.748 -10.138  -3.956
  401    HB2  LYS  21           2HB      LYS  21 -16.454  -7.290  -4.037
  402    HB3  LYS  21           1HB      LYS  21 -15.139  -7.972  -3.092
  403    HG2  LYS  21           2HG      LYS  21 -14.239  -8.011  -5.192
  404    HG3  LYS  21           1HG      LYS  21 -14.946  -9.625  -5.107
  405    HD2  LYS  21           2HD      LYS  21 -17.044  -8.194  -6.050
  406    HD3  LYS  21           1HD      LYS  21 -15.693  -7.310  -6.765
  407    HE2  LYS  21           2HE      LYS  21 -15.662  -8.863  -8.358
  408    HE3  LYS  21           1HE      LYS  21 -15.041  -9.978  -7.142
  409    HZ1  LYS  21           3HZ      LYS  21 -17.623 -10.175  -6.636
  410    HZ2  LYS  21           1HZ      LYS  21 -16.848 -11.139  -7.797
  411    HZ3  LYS  21           2HZ      LYS  21 -17.720  -9.767  -8.278
  412    H    ARG  22           H        ARG  22 -15.522 -11.277  -2.567
  413    HA   ARG  22           HA       ARG  22 -15.771 -10.705   0.286
  414    HB2  ARG  22           2HB      ARG  22 -15.721 -13.093  -1.256
  415    HB3  ARG  22           1HB      ARG  22 -14.272 -13.088  -0.257
  416    HG2  ARG  22           2HG      ARG  22 -15.918 -14.197   0.995
  417    HG3  ARG  22           1HG      ARG  22 -15.778 -12.584   1.698
  418    HD2  ARG  22           2HD      ARG  22 -17.710 -12.006   0.048
  419    HD3  ARG  22           1HD      ARG  22 -17.975 -13.750   0.041
  420    HE   ARG  22           HE       ARG  22 -18.098 -12.051   2.448
  421   HH11  ARG  22          2HH1      ARG  22 -19.091 -14.853   0.617
  422   HH12  ARG  22          1HH1      ARG  22 -20.220 -15.405   1.819
  423   HH21  ARG  22          2HH2      ARG  22 -19.563 -12.769   4.052
  424   HH22  ARG  22          1HH2      ARG  22 -20.494 -14.214   3.768
  425    H    CYS  23           H        CYS  23 -14.070  -9.985   1.462
  426    HA   CYS  23           HA       CYS  23 -11.769  -9.161  -0.054
  427    HB2  CYS  23           2HB      CYS  23 -11.199  -7.790   1.816
  428    HB3  CYS  23           1HB      CYS  23 -12.916  -7.633   1.506
  429    H    ALA  24           H        ALA  24  -9.563  -9.443   0.724
  430    HA   ALA  24           HA       ALA  24  -9.210 -12.301   1.082
  431    HB1  ALA  24           1HB      ALA  24  -6.952 -11.939   0.282
  432    HB2  ALA  24           2HB      ALA  24  -8.114 -11.143  -0.781
  433    HB3  ALA  24           3HB      ALA  24  -7.180 -10.192   0.372
  434    H    GLY  25           H        GLY  25  -8.749  -9.424   2.949
  435    HA2  GLY  25           1HA      GLY  25  -6.796 -10.628   4.717
  436    HA3  GLY  25           2HA      GLY  25  -7.562  -9.056   4.913
  437    H    CYS  26           H        CYS  26  -9.719  -8.986   5.736
  438    HA   CYS  26           HA       CYS  26 -10.214 -10.587   7.954
  439    HB2  CYS  26           2HB      CYS  26 -12.555  -9.320   6.654
  440    HB3  CYS  26           1HB      CYS  26 -11.993  -9.213   8.320
  441    H    GLY  27           H        GLY  27 -11.848 -10.610   4.793
  442    HA2  GLY  27           1HA      GLY  27 -12.398 -12.649   3.674
  443    HA3  GLY  27           2HA      GLY  27 -12.451 -13.454   5.237
  444    H    GLY  28           H        GLY  28 -13.969 -10.426   4.187
  445    HA2  GLY  28           1HA      GLY  28 -16.598 -11.733   4.476
  446    HA3  GLY  28           2HA      GLY  28 -16.268 -10.233   5.338
  447    H    LYS  29           H        LYS  29 -18.370 -10.121   3.689
  448    HA   LYS  29           HA       LYS  29 -17.645  -9.326   1.039
  449    HB2  LYS  29           2HB      LYS  29 -19.980  -8.432   0.930
  450    HB3  LYS  29           1HB      LYS  29 -19.876 -10.129   1.373
  451    HG2  LYS  29           2HG      LYS  29 -19.921  -8.995   3.823
  452    HG3  LYS  29           1HG      LYS  29 -20.871  -7.822   2.902
  453    HD2  LYS  29           2HD      LYS  29 -21.386 -10.796   2.933
  454    HD3  LYS  29           1HD      LYS  29 -22.240  -9.624   3.940
  455    HE2  LYS  29           2HE      LYS  29 -22.585  -8.473   1.553
  456    HE3  LYS  29           1HE      LYS  29 -22.442 -10.151   1.035
  457    HZ1  LYS  29           3HZ      LYS  29 -24.531 -10.466   1.639
  458    HZ2  LYS  29           1HZ      LYS  29 -24.656  -8.861   2.169
  459    HZ3  LYS  29           2HZ      LYS  29 -24.153 -10.072   3.241
  460    H    ILE  30           H        ILE  30 -16.909  -7.420   0.352
  461    HA   ILE  30           HA       ILE  30 -16.060  -5.495   2.240
  462    HB   ILE  30           HB       ILE  30 -16.190  -5.342  -0.772
  463   HG12  ILE  30          2HG1      ILE  30 -13.580  -5.425   0.544
  464   HG13  ILE  30          1HG1      ILE  30 -14.557  -6.853   0.874
  465   HG21  ILE  30          1HG2      ILE  30 -15.685  -3.271   1.151
  466   HG22  ILE  30          2HG2      ILE  30 -14.234  -3.583   0.196
  467   HG23  ILE  30          3HG2      ILE  30 -15.748  -3.169  -0.610
  468   HD11  ILE  30          3HD1      ILE  30 -13.816  -7.647  -1.052
  469   HD12  ILE  30          1HD1      ILE  30 -14.842  -6.454  -1.847
  470   HD13  ILE  30          2HD1      ILE  30 -13.149  -6.085  -1.520
  471    H    ALA  31           H        ALA  31 -17.441  -4.299   3.334
  472    HA   ALA  31           HA       ALA  31 -19.683  -3.067   1.913
  473    HB1  ALA  31           1HB      ALA  31 -20.839  -3.810   3.669
  474    HB2  ALA  31           2HB      ALA  31 -19.368  -4.174   4.572
  475    HB3  ALA  31           3HB      ALA  31 -20.045  -2.545   4.605
  476    H    ASP  32           H        ASP  32 -16.687  -2.307   2.284
  477    HA   ASP  32           HA       ASP  32 -16.928   0.386   3.311
  478    HB2  ASP  32           2HB      ASP  32 -14.766  -1.329   2.347
  479    HB3  ASP  32           1HB      ASP  32 -14.640   0.319   1.745
  480    H    ARG  33           H        ARG  33 -16.626   2.305   1.916
  481    HA   ARG  33           HA       ARG  33 -18.375   2.095  -0.345
  482    HB2  ARG  33           2HB      ARG  33 -18.477   4.102   0.987
  483    HB3  ARG  33           1HB      ARG  33 -16.765   4.414   0.736
  484    HG2  ARG  33           2HG      ARG  33 -17.070   5.171  -1.405
  485    HG3  ARG  33           1HG      ARG  33 -18.550   4.241  -1.637
  486    HD2  ARG  33           2HD      ARG  33 -19.644   6.140  -1.279
  487    HD3  ARG  33           1HD      ARG  33 -19.185   5.977   0.417
  488    HE   ARG  33           HE       ARG  33 -17.363   7.362  -1.413
  489   HH11  ARG  33          2HH1      ARG  33 -19.644   7.529   1.252
  490   HH12  ARG  33          1HH1      ARG  33 -19.178   9.149   1.693
  491   HH21  ARG  33          2HH2      ARG  33 -16.761   9.488  -0.822
  492   HH22  ARG  33          1HH2      ARG  33 -17.554  10.253   0.528
  493    H    PHE  34           H        PHE  34 -14.959   3.032   0.020
  494    HA   PHE  34           HA       PHE  34 -14.631   2.629  -2.862
  495    HB2  PHE  34           2HB      PHE  34 -13.265   4.338  -0.852
  496    HB3  PHE  34           1HB      PHE  34 -12.288   3.723  -2.183
  497    HD1  PHE  34           1HD      PHE  34 -15.786   4.988  -1.920
  498    HD2  PHE  34           2HD      PHE  34 -11.979   5.329  -3.783
  499    HE1  PHE  34           1HE      PHE  34 -16.680   6.736  -3.397
  500    HE2  PHE  34           2HE      PHE  34 -12.859   7.082  -5.267
  501    HZ   PHE  34           HZ       PHE  34 -15.209   7.786  -5.080
  502    H    LEU  35           H        LEU  35 -13.724   0.863  -3.583
  503    HA   LEU  35           HA       LEU  35 -12.314  -0.877  -1.712
  504    HB2  LEU  35           2HB      LEU  35 -12.391  -2.237  -4.099
  505    HB3  LEU  35           1HB      LEU  35 -13.529  -2.424  -2.781
  506    HG   LEU  35           HG       LEU  35 -14.064  -0.333  -4.846
  507   HD11  LEU  35          1HD1      LEU  35 -15.094  -1.902  -6.326
  508   HD12  LEU  35          2HD1      LEU  35 -13.429  -2.416  -6.056
  509   HD13  LEU  35          3HD1      LEU  35 -14.749  -3.241  -5.229
  510   HD21  LEU  35          3HD2      LEU  35 -16.391  -0.987  -4.371
  511   HD22  LEU  35          1HD2      LEU  35 -15.804  -2.176  -3.208
  512   HD23  LEU  35          2HD2      LEU  35 -15.529  -0.455  -2.928
  513    H    LEU  36           H        LEU  36 -10.274  -1.792  -2.253
  514    HA   LEU  36           HA       LEU  36  -8.699  -0.018  -3.999
  515    HB2  LEU  36           2HB      LEU  36  -8.121  -1.096  -1.266
  516    HB3  LEU  36           1HB      LEU  36  -6.805  -0.669  -2.343
  517    HG   LEU  36           HG       LEU  36  -8.508   1.541  -2.403
  518   HD11  LEU  36          1HD1      LEU  36  -9.393   0.295  -0.252
  519   HD12  LEU  36          2HD1      LEU  36  -7.972   1.044   0.475
  520   HD13  LEU  36          3HD1      LEU  36  -9.204   2.046  -0.290
  521   HD21  LEU  36          3HD2      LEU  36  -5.867   1.065  -2.162
  522   HD22  LEU  36          1HD2      LEU  36  -6.607   2.645  -1.901
  523   HD23  LEU  36          2HD2      LEU  36  -6.242   1.603  -0.524
  524    H    TYR  37           H        TYR  37  -6.685  -0.933  -4.768
  525    HA   TYR  37           HA       TYR  37  -6.864  -3.834  -5.281
  526    HB2  TYR  37           2HB      TYR  37  -6.475  -1.532  -7.033
  527    HB3  TYR  37           1HB      TYR  37  -5.201  -2.726  -7.216
  528    HD1  TYR  37           1HD      TYR  37  -6.657  -5.260  -6.883
  529    HD2  TYR  37           2HD      TYR  37  -7.777  -1.697  -8.916
  530    HE1  TYR  37           1HE      TYR  37  -8.094  -6.581  -8.380
  531    HE2  TYR  37           2HE      TYR  37  -9.215  -2.994 -10.418
  532    HH   TYR  37           HH       TYR  37  -9.138  -5.641 -11.222
  533    H    ALA  38           H        ALA  38  -4.935  -5.006  -5.183
  534    HA   ALA  38           HA       ALA  38  -2.494  -3.559  -4.441
  535    HB1  ALA  38           1HB      ALA  38  -3.073  -4.267  -2.317
  536    HB2  ALA  38           2HB      ALA  38  -3.813  -5.757  -2.904
  537    HB3  ALA  38           3HB      ALA  38  -2.056  -5.594  -2.879
  538    H    MET  39           H        MET  39  -3.299  -6.998  -4.595
  539    HA   MET  39           HA       MET  39  -1.299  -7.385  -6.672
  540    HB2  MET  39           2HB      MET  39  -2.590  -9.045  -4.651
  541    HB3  MET  39           1HB      MET  39  -2.537  -9.828  -6.226
  542    HG2  MET  39           2HG      MET  39  -0.267  -9.979  -6.226
  543    HG3  MET  39           1HG      MET  39  -0.061  -8.547  -5.218
  544    HE1  MET  39           3HE      MET  39  -1.955  -8.958  -2.905
  545    HE2  MET  39           1HE      MET  39  -1.163  -9.972  -1.701
  546    HE3  MET  39           2HE      MET  39  -0.285  -8.630  -2.436
  547    H    ASP  40           H        ASP  40  -4.458  -8.920  -6.305
  548    HA   ASP  40           HA       ASP  40  -5.476  -7.704  -8.736
  549    HB2  ASP  40           2HB      ASP  40  -4.164 -10.031  -9.064
  550    HB3  ASP  40           1HB      ASP  40  -5.749 -10.659  -8.628
  551    H    SER  41           H        SER  41  -5.854  -8.625  -5.640
  552    HA   SER  41           HA       SER  41  -8.616  -9.496  -5.788
  553    HB2  SER  41           2HB      SER  41  -7.873  -9.047  -3.120
  554    HB3  SER  41           1HB      SER  41  -7.908 -10.597  -3.963
  555    HG   SER  41           HG       SER  41  -5.802 -10.603  -4.046
  556    H    TYR  42           H        TYR  42 -10.172  -8.390  -4.242
  557    HA   TYR  42           HA       TYR  42  -9.891  -5.483  -4.527
  558    HB2  TYR  42           2HB      TYR  42 -12.317  -7.264  -4.248
  559    HB3  TYR  42           1HB      TYR  42 -12.403  -5.512  -4.083
  560    HD1  TYR  42           2HD      TYR  42 -11.256  -8.151  -6.461
  561    HD2  TYR  42           1HD      TYR  42 -12.745  -4.201  -5.970
  562    HE1  TYR  42           2HE      TYR  42 -11.462  -7.933  -8.897
  563    HE2  TYR  42           1HE      TYR  42 -12.949  -3.967  -8.408
  564    HH   TYR  42           HH       TYR  42 -11.428  -5.845 -10.548
  565    H    TRP  43           H        TRP  43  -9.534  -4.297  -2.777
  566    HA   TRP  43           HA       TRP  43  -9.909  -5.577  -0.147
  567    HB2  TRP  43           2HB      TRP  43  -7.815  -3.492  -0.734
  568    HB3  TRP  43           1HB      TRP  43  -7.905  -4.587   0.638
  569    HD1  TRP  43           HD       TRP  43  -7.313  -4.786  -3.190
  570    HE1  TRP  43           1HE      TRP  43  -5.683  -6.713  -3.642
  571    HE3  TRP  43           3HE      TRP  43  -6.768  -6.528   1.576
  572    HZ2  TRP  43           2HZ      TRP  43  -4.331  -8.701  -2.191
  573    HZ3  TRP  43           3HZ      TRP  43  -5.286  -8.457   1.960
  574    HH2  TRP  43           HH       TRP  43  -4.092  -9.518   0.106
  575    H    HIS  44           H        HIS  44  -9.656  -3.761   1.594
  576    HA   HIS  44           HA       HIS  44 -10.936  -1.257   0.861
  577    HB2  HIS  44           2HB      HIS  44 -12.600  -1.463   2.719
  578    HB3  HIS  44           1HB      HIS  44 -12.871  -2.631   1.433
  579    HD1  HIS  44           1HD      HIS  44 -13.154  -2.574   4.906
  580    HD2  HIS  44           2HD      HIS  44 -11.213  -5.109   2.242
  581    HE1  HIS  44           1HE      HIS  44 -12.679  -4.744   6.172
  582    H    SER  45           H        SER  45 -11.271  -0.182   3.347
  583    HA   SER  45           HA       SER  45  -8.780   0.734   4.022
  584    HB2  SER  45           2HB      SER  45 -10.825   0.595   6.183
  585    HB3  SER  45           1HB      SER  45  -9.855   1.962   5.631
  586    HG   SER  45           HG       SER  45 -12.355   1.269   4.913
  587    H    ARG  46           H        ARG  46 -10.572  -1.855   5.739
  588    HA   ARG  46           HA       ARG  46  -8.469  -2.199   7.648
  589    HB2  ARG  46           2HB      ARG  46 -11.155  -2.866   7.538
  590    HB3  ARG  46           1HB      ARG  46 -10.336  -4.422   7.472
  591    HG2  ARG  46           2HG      ARG  46  -9.899  -4.334   9.642
  592    HG3  ARG  46           1HG      ARG  46  -9.113  -2.766   9.446
  593    HD2  ARG  46           2HD      ARG  46 -12.042  -3.293   9.903
  594    HD3  ARG  46           1HD      ARG  46 -10.909  -2.513  11.008
  595    HE   ARG  46           HE       ARG  46 -10.812  -0.644   9.487
  596   HH11  ARG  46          2HH1      ARG  46 -13.432  -2.929   8.978
  597   HH12  ARG  46          1HH1      ARG  46 -14.365  -1.818   8.009
  598   HH21  ARG  46          2HH2      ARG  46 -12.026   0.791   8.228
  599   HH22  ARG  46          1HH2      ARG  46 -13.576   0.302   7.608
  600    H    CYS  47           H        CYS  47  -8.840  -3.305   4.487
  601    HA   CYS  47           HA       CYS  47  -7.345  -5.762   5.038
  602    HB2  CYS  47           2HB      CYS  47  -9.398  -5.056   3.139
  603    HB3  CYS  47           1HB      CYS  47  -7.988  -5.732   2.328
  604    H    LEU  48           H        LEU  48  -7.238  -2.855   3.041
  605    HA   LEU  48           HA       LEU  48  -4.786  -3.612   1.763
  606    HB2  LEU  48           2HB      LEU  48  -6.783  -1.970   1.062
  607    HB3  LEU  48           1HB      LEU  48  -5.698  -0.783   1.753
  608    HG   LEU  48           HG       LEU  48  -5.527  -1.099  -0.742
  609   HD11  LEU  48          1HD1      LEU  48  -3.485  -0.281  -0.576
  610   HD12  LEU  48          2HD1      LEU  48  -3.527  -0.680   1.144
  611   HD13  LEU  48          3HD1      LEU  48  -2.850  -1.828  -0.011
  612   HD21  LEU  48          3HD2      LEU  48  -4.608  -3.014  -1.684
  613   HD22  LEU  48          1HD2      LEU  48  -4.025  -3.612  -0.129
  614   HD23  LEU  48          2HD2      LEU  48  -5.750  -3.637  -0.494
  615    H    LYS  49           H        LYS  49  -3.708  -4.030   3.853
  616    HA   LYS  49           HA       LYS  49  -2.276  -1.646   4.754
  617    HB2  LYS  49           2HB      LYS  49  -2.476  -2.806   7.133
  618    HB3  LYS  49           1HB      LYS  49  -3.678  -1.658   6.565
  619    HG2  LYS  49           2HG      LYS  49  -5.000  -3.344   7.376
  620    HG3  LYS  49           1HG      LYS  49  -4.888  -3.787   5.671
  621    HD2  LYS  49           2HD      LYS  49  -3.030  -5.334   6.249
  622    HD3  LYS  49           1HD      LYS  49  -3.281  -4.948   7.952
  623    HE2  LYS  49           2HE      LYS  49  -5.260  -6.090   8.061
  624    HE3  LYS  49           1HE      LYS  49  -5.614  -5.855   6.350
  625    HZ1  LYS  49           3HZ      LYS  49  -3.375  -7.589   7.191
  626    HZ2  LYS  49           1HZ      LYS  49  -4.257  -7.610   5.740
  627    HZ3  LYS  49           2HZ      LYS  49  -4.959  -8.183   7.171
  628    H    CYS  50           H        CYS  50  -0.327  -2.182   5.963
  629    HA   CYS  50           HA       CYS  50   1.233  -4.257   4.918
  630    HB2  CYS  50           2HB      CYS  50   2.126  -2.216   5.993
  631    HB3  CYS  50           1HB      CYS  50   1.518  -2.770   7.545
  632    H    SER  51           H        SER  51   1.435  -6.370   5.472
  633    HA   SER  51           HA       SER  51  -0.432  -7.459   7.382
  634    HB2  SER  51           2HB      SER  51   1.758  -9.003   5.995
  635    HB3  SER  51           1HB      SER  51   0.184  -9.585   6.543
  636    HG   SER  51           HG       SER  51  -0.009  -7.529   4.756
  637    H    SER  52           H        SER  52   2.542  -6.056   7.643
  638    HA   SER  52           HA       SER  52   3.499  -7.850   9.746
  639    HB2  SER  52           2HB      SER  52   4.834  -6.669   7.694
  640    HB3  SER  52           1HB      SER  52   5.148  -5.525   8.999
  641    HG   SER  52           HG       SER  52   6.675  -6.898   9.463
  642    H    CYS  53           H        CYS  53   2.928  -4.319   9.272
  643    HA   CYS  53           HA       CYS  53   2.767  -4.151  12.210
  644    HB2  CYS  53           2HB      CYS  53   3.454  -1.831  12.074
  645    HB3  CYS  53           1HB      CYS  53   4.634  -2.858  11.279
  646    H    GLN  54           H        GLN  54   0.917  -4.135   9.502
  647    HA   GLN  54           HA       GLN  54  -1.270  -3.744   9.104
  648    HB2  GLN  54           2HB      GLN  54  -1.327  -3.162  12.064
  649    HB3  GLN  54           1HB      GLN  54  -2.762  -3.179  11.050
  650    HG2  GLN  54           2HG      GLN  54  -0.999  -5.560  11.001
  651    HG3  GLN  54           1HG      GLN  54  -1.989  -5.288  12.434
  652   HE21  GLN  54          1HE2      GLN  54  -4.293  -4.289  11.432
  653   HE22  GLN  54          2HE2      GLN  54  -5.053  -5.459  10.398
  654    H    ALA  55           H        ALA  55   0.641  -1.689   8.640
  655    HA   ALA  55           HA       ALA  55  -0.813   0.770   9.222
  656    HB1  ALA  55           1HB      ALA  55   1.897   0.092   8.344
  657    HB2  ALA  55           2HB      ALA  55   1.202   1.495   7.531
  658    HB3  ALA  55           3HB      ALA  55   1.320   1.463   9.292
  659    H    GLN  56           H        GLN  56  -2.083   1.824   7.782
  660    HA   GLN  56           HA       GLN  56  -3.012   0.444   5.491
  661    HB2  GLN  56           2HB      GLN  56  -3.766   2.725   7.024
  662    HB3  GLN  56           1HB      GLN  56  -3.710   3.195   5.332
  663    HG2  GLN  56           2HG      GLN  56  -5.094   0.677   6.076
  664    HG3  GLN  56           1HG      GLN  56  -5.881   2.219   6.395
  665   HE21  GLN  56          1HE2      GLN  56  -6.690   0.151   4.562
  666   HE22  GLN  56          2HE2      GLN  56  -6.705   0.868   2.986
  667    H    LEU  57           H        LEU  57  -2.254   0.429   3.473
  668    HA   LEU  57           HA       LEU  57  -0.210   2.419   2.756
  669    HB2  LEU  57           2HB      LEU  57  -0.803  -0.299   1.584
  670    HB3  LEU  57           1HB      LEU  57   0.417   0.801   0.970
  671    HG   LEU  57           HG       LEU  57   0.668   0.189   3.835
  672   HD11  LEU  57          1HD1      LEU  57   1.613  -1.965   2.032
  673   HD12  LEU  57          2HD1      LEU  57   1.145  -2.032   3.731
  674   HD13  LEU  57          3HD1      LEU  57  -0.094  -1.958   2.480
  675   HD21  LEU  57          3HD2      LEU  57   2.312   1.486   2.553
  676   HD22  LEU  57          1HD2      LEU  57   3.011   0.016   3.232
  677   HD23  LEU  57          2HD2      LEU  57   2.594   0.086   1.520
  678    H    GLY  58           H        GLY  58  -3.408   2.051   2.430
  679    HA2  GLY  58           1HA      GLY  58  -3.586   2.643  -0.420
  680    HA3  GLY  58           2HA      GLY  58  -4.929   2.326   0.667
  681    H    ASP  59           H        ASP  59  -4.704   4.103   2.629
  682    HA   ASP  59           HA       ASP  59  -5.311   6.585   1.253
  683    HB2  ASP  59           2HB      ASP  59  -6.648   5.508   3.209
  684    HB3  ASP  59           1HB      ASP  59  -5.415   6.231   4.236
  685    H    ILE  60           H        ILE  60  -2.556   5.345   2.041
  686    HA   ILE  60           HA       ILE  60  -1.373   7.942   2.750
  687    HB   ILE  60           HB       ILE  60  -0.138   5.275   3.458
  688   HG12  ILE  60          2HG1      ILE  60  -2.336   5.722   4.651
  689   HG13  ILE  60          1HG1      ILE  60  -0.938   5.474   5.692
  690   HG21  ILE  60          1HG2      ILE  60   1.653   6.588   3.713
  691   HG22  ILE  60          2HG2      ILE  60   0.689   8.064   3.660
  692   HG23  ILE  60          3HG2      ILE  60   0.856   7.176   5.174
  693   HD11  ILE  60          3HD1      ILE  60  -2.710   7.732   5.492
  694   HD12  ILE  60          1HD1      ILE  60  -1.511   7.345   6.726
  695   HD13  ILE  60          2HD1      ILE  60  -1.029   8.219   5.273
  696    H    GLY  61           H        GLY  61   0.444   8.534   1.563
  697    HA2  GLY  61           1HA      GLY  61   0.593   7.384  -1.059
  698    HA3  GLY  61           2HA      GLY  61   1.544   8.734  -0.458
  699    H    THR  62           H        THR  62   1.408   5.462   0.883
  700    HA   THR  62           HA       THR  62   4.278   5.198   0.365
  701    HB   THR  62           HB       THR  62   3.375   3.003   1.895
  702    HG1  THR  62           1HG      THR  62   1.729   3.789   2.962
  703   HG21  THR  62          3HG2      THR  62   5.247   5.195   2.075
  704   HG22  THR  62          1HG2      THR  62   5.347   3.580   2.776
  705   HG23  THR  62          2HG2      THR  62   4.514   4.868   3.646
  706    H    SER  63           H        SER  63   4.949   3.891  -1.234
  707    HA   SER  63           HA       SER  63   3.119   2.166  -2.616
  708    HB2  SER  63           2HB      SER  63   5.882   1.656  -3.265
  709    HB3  SER  63           1HB      SER  63   4.623   2.380  -4.268
  710    HG   SER  63           HG       SER  63   6.568   3.697  -3.730
  711    H    SER  64           H        SER  64   2.610   0.181  -1.964
  712    HA   SER  64           HA       SER  64   4.070  -1.131   0.122
  713    HB2  SER  64           2HB      SER  64   2.193  -2.892  -1.112
  714    HB3  SER  64           1HB      SER  64   2.043  -2.046   0.429
  715    HG   SER  64           HG       SER  64   0.516  -1.653  -1.554
  716    H    TYR  65           H        TYR  65   5.459  -2.797  -0.023
  717    HA   TYR  65           HA       TYR  65   6.176  -3.680  -2.739
  718    HB2  TYR  65           2HB      TYR  65   7.946  -3.558  -0.286
  719    HB3  TYR  65           1HB      TYR  65   8.444  -4.033  -1.907
  720    HD1  TYR  65           2HD      TYR  65   8.232  -2.272  -3.769
  721    HD2  TYR  65           1HD      TYR  65   8.056  -1.313   0.373
  722    HE1  TYR  65           2HE      TYR  65   8.773   0.067  -4.293
  723    HE2  TYR  65           1HE      TYR  65   8.597   1.028  -0.146
  724    HH   TYR  65           HH       TYR  65   8.658   2.223  -3.410
  725    H    THR  66           H        THR  66   6.820  -5.882  -3.009
  726    HA   THR  66           HA       THR  66   6.050  -7.685  -0.848
  727    HB   THR  66           HB       THR  66   4.019  -7.240  -2.289
  728    HG1  THR  66           1HG      THR  66   3.985  -9.101  -1.097
  729   HG21  THR  66          3HG2      THR  66   5.035  -7.108  -4.470
  730   HG22  THR  66          1HG2      THR  66   3.929  -8.482  -4.448
  731   HG23  THR  66          2HG2      THR  66   5.669  -8.747  -4.323
  732    H    LYS  67           H        LYS  67   6.271 -10.039  -1.803
  733    HA   LYS  67           HA       LYS  67   8.379 -10.479  -3.668
  734    HB2  LYS  67           2HB      LYS  67   9.476  -9.622  -1.455
  735    HB3  LYS  67           1HB      LYS  67   9.087 -11.224  -0.842
  736    HG2  LYS  67           2HG      LYS  67  10.386 -12.203  -2.708
  737    HG3  LYS  67           1HG      LYS  67  10.849 -10.569  -3.194
  738    HD2  LYS  67           2HD      LYS  67  11.446 -10.593  -0.518
  739    HD3  LYS  67           1HD      LYS  67  11.846 -12.237  -1.014
  740    HE2  LYS  67           2HE      LYS  67  13.744 -10.628  -1.178
  741    HE3  LYS  67           1HE      LYS  67  13.351 -11.442  -2.691
  742    HZ1  LYS  67           3HZ      LYS  67  12.742  -9.533  -3.660
  743    HZ2  LYS  67           1HZ      LYS  67  13.671  -8.793  -2.442
  744    HZ3  LYS  67           2HZ      LYS  67  11.988  -8.921  -2.271
  745    H    SER  68           H        SER  68   7.155 -11.877  -0.659
  746    HA   SER  68           HA       SER  68   6.560 -14.369  -2.082
  747    HB2  SER  68           2HB      SER  68   6.437 -14.200   0.895
  748    HB3  SER  68           1HB      SER  68   7.035 -15.502  -0.137
  749    HG   SER  68           HG       SER  68   8.903 -14.285  -0.525
  750    H    GLY  69           H        GLY  69   4.838 -12.156  -2.414
  751    HA2  GLY  69           1HA      GLY  69   2.543 -11.997  -2.670
  752    HA3  GLY  69           2HA      GLY  69   2.357 -13.411  -1.646
  753    H    MET  70           H        MET  70   4.039 -12.079   0.457
  754    HA   MET  70           HA       MET  70   1.922 -10.948   1.949
  755    HB2  MET  70           2HB      MET  70   4.236 -12.088   2.643
  756    HB3  MET  70           1HB      MET  70   4.743 -10.407   2.734
  757    HG2  MET  70           2HG      MET  70   2.787 -10.000   4.245
  758    HG3  MET  70           1HG      MET  70   2.535 -11.744   4.272
  759    HE1  MET  70           3HE      MET  70   5.039 -12.987   4.104
  760    HE2  MET  70           1HE      MET  70   6.139 -12.843   5.479
  761    HE3  MET  70           2HE      MET  70   4.515 -13.491   5.712
  762    H    ILE  71           H        ILE  71   1.350  -8.884   2.339
  763    HA   ILE  71           HA       ILE  71   2.624  -6.787   0.757
  764    HB   ILE  71           HB       ILE  71   0.236  -6.363   2.529
  765   HG12  ILE  71          2HG1      ILE  71  -0.634  -6.857  -0.131
  766   HG13  ILE  71          1HG1      ILE  71   0.359  -8.225   0.362
  767   HG21  ILE  71          1HG2      ILE  71   0.186  -5.103  -0.052
  768   HG22  ILE  71          2HG2      ILE  71   0.168  -4.373   1.553
  769   HG23  ILE  71          3HG2      ILE  71   1.703  -4.759   0.778
  770   HD11  ILE  71          3HD1      ILE  71  -1.069  -8.249   2.484
  771   HD12  ILE  71          1HD1      ILE  71  -2.172  -7.207   1.587
  772   HD13  ILE  71          2HD1      ILE  71  -1.797  -8.821   0.983
  773    H    LEU  72           H        LEU  72   4.086  -5.458   1.651
  774    HA   LEU  72           HA       LEU  72   3.959  -4.982   4.549
  775    HB2  LEU  72           2HB      LEU  72   6.400  -5.719   2.943
  776    HB3  LEU  72           1HB      LEU  72   6.480  -5.027   4.551
  777    HG   LEU  72           HG       LEU  72   4.806  -7.160   4.943
  778   HD11  LEU  72          1HD1      LEU  72   6.978  -8.415   3.389
  779   HD12  LEU  72          2HD1      LEU  72   5.322  -8.948   3.667
  780   HD13  LEU  72          3HD1      LEU  72   5.655  -7.697   2.473
  781   HD21  LEU  72          3HD2      LEU  72   6.546  -6.658   6.459
  782   HD22  LEU  72          1HD2      LEU  72   6.870  -8.283   5.854
  783   HD23  LEU  72          2HD2      LEU  72   7.786  -6.911   5.229
  784    H    CYS  73           H        CYS  73   4.961  -3.030   5.246
  785    HA   CYS  73           HA       CYS  73   4.709  -0.869   3.377
  786    HB2  CYS  73           2HB      CYS  73   5.319   0.565   5.284
  787    HB3  CYS  73           1HB      CYS  73   4.046  -0.571   5.717
  788    H    ARG  74           H        ARG  74   6.564   0.865   3.551
  789    HA   ARG  74           HA       ARG  74   8.770  -0.182   2.156
  790    HB2  ARG  74           2HB      ARG  74   7.753   2.267   2.339
  791    HB3  ARG  74           1HB      ARG  74   9.020   2.444   3.547
  792    HG2  ARG  74           2HG      ARG  74  10.608   1.559   1.762
  793    HG3  ARG  74           1HG      ARG  74   9.294   1.850   0.620
  794    HD2  ARG  74           2HD      ARG  74   9.245   4.221   1.631
  795    HD3  ARG  74           1HD      ARG  74  10.839   3.822   2.270
  796    HE   ARG  74           HE       ARG  74  11.616   3.566   0.004
  797   HH11  ARG  74          2HH1      ARG  74   8.493   5.096   0.393
  798   HH12  ARG  74          1HH1      ARG  74   8.491   5.820  -1.182
  799   HH21  ARG  74          2HH2      ARG  74  11.643   4.531  -2.076
  800   HH22  ARG  74          1HH2      ARG  74  10.311   5.536  -2.567
  801    H    ASN  75           H        ASN  75   8.264   0.546   5.540
  802    HA   ASN  75           HA       ASN  75  11.045   0.288   6.248
  803    HB2  ASN  75           2HB      ASN  75   9.018  -0.028   8.380
  804    HB3  ASN  75           1HB      ASN  75  10.441   1.002   8.325
  805   HD21  ASN  75          1HD2      ASN  75   7.076   0.692   7.377
  806   HD22  ASN  75          2HD2      ASN  75   6.808   2.389   7.144
  807    H    ASP  76           H        ASP  76   8.125  -1.674   6.523
  808    HA   ASP  76           HA       ASP  76   9.342  -3.762   8.010
  809    HB2  ASP  76           2HB      ASP  76   6.736  -3.190   6.873
  810    HB3  ASP  76           1HB      ASP  76   7.167  -4.888   6.701
  811    H    TYR  77           H        TYR  77   8.745  -3.268   4.567
  812    HA   TYR  77           HA       TYR  77   9.354  -5.889   3.763
  813    HB2  TYR  77           2HB      TYR  77   8.205  -4.241   2.319
  814    HB3  TYR  77           1HB      TYR  77   9.724  -3.364   2.149
  815    HD1  TYR  77           2HD      TYR  77   8.496  -6.884   1.818
  816    HD2  TYR  77           1HD      TYR  77  10.927  -3.772   0.226
  817    HE1  TYR  77           2HE      TYR  77   9.127  -8.341  -0.059
  818    HE2  TYR  77           1HE      TYR  77  11.569  -5.224  -1.649
  819    HH   TYR  77           HH       TYR  77   9.971  -7.786  -2.614
  820    H    ILE  78           H        ILE  78  11.413  -3.021   4.092
  821    HA   ILE  78           HA       ILE  78  13.750  -4.285   3.079
  822    HB   ILE  78           HB       ILE  78  13.565  -1.915   4.948
  823   HG12  ILE  78          2HG1      ILE  78  12.322  -1.771   2.721
  824   HG13  ILE  78          1HG1      ILE  78  13.500  -0.504   3.049
  825   HG21  ILE  78          1HG2      ILE  78  15.783  -1.327   4.071
  826   HG22  ILE  78          2HG2      ILE  78  15.793  -2.874   4.918
  827   HG23  ILE  78          3HG2      ILE  78  15.808  -2.835   3.154
  828   HD11  ILE  78          3HD1      ILE  78  13.339  -1.827   0.731
  829   HD12  ILE  78          1HD1      ILE  78  14.836  -1.135   1.353
  830   HD13  ILE  78          2HD1      ILE  78  14.501  -2.852   1.577
  831    H    ARG  79           H        ARG  79  12.293  -4.007   6.248
  832    HA   ARG  79           HA       ARG  79  14.462  -5.101   7.723
  833    HB2  ARG  79           2HB      ARG  79  12.358  -3.787   8.538
  834    HB3  ARG  79           1HB      ARG  79  11.594  -5.371   8.569
  835    HG2  ARG  79           2HG      ARG  79  12.967  -6.140  10.269
  836    HG3  ARG  79           1HG      ARG  79  14.195  -4.910   9.969
  837    HD2  ARG  79           2HD      ARG  79  11.491  -3.982  10.761
  838    HD3  ARG  79           1HD      ARG  79  12.480  -4.751  12.003
  839    HE   ARG  79           HE       ARG  79  14.166  -3.032  11.586
  840   HH11  ARG  79          2HH1      ARG  79  10.880  -2.424  10.515
  841   HH12  ARG  79          1HH1      ARG  79  11.115  -0.707  10.382
  842   HH21  ARG  79          2HH2      ARG  79  14.471  -0.768  11.401
  843   HH22  ARG  79          1HH2      ARG  79  13.154   0.234  10.854
  844    H    LEU  80           H        LEU  80  11.643  -6.465   6.125
  845    HA   LEU  80           HA       LEU  80  12.128  -9.115   7.159
  846    HB2  LEU  80           2HB      LEU  80   9.934  -7.732   6.106
  847    HB3  LEU  80           1HB      LEU  80  10.265  -9.008   4.951
  848    HG   LEU  80           HG       LEU  80   8.720  -9.979   6.385
  849   HD11  LEU  80          1HD1      LEU  80   9.985 -11.587   7.823
  850   HD12  LEU  80          2HD1      LEU  80  10.537 -11.506   6.151
  851   HD13  LEU  80          3HD1      LEU  80  11.453 -10.699   7.422
  852   HD21  LEU  80          3HD2      LEU  80   8.228  -8.904   8.266
  853   HD22  LEU  80          1HD2      LEU  80   9.610  -9.710   9.011
  854   HD23  LEU  80          2HD2      LEU  80   9.803  -8.109   8.296
  855    H    PHE  81           H        PHE  81  11.982  -7.754   3.850
  856    HA   PHE  81           HA       PHE  81  13.762  -9.944   3.006
  857    HB2  PHE  81           2HB      PHE  81  11.673  -8.639   1.258
  858    HB3  PHE  81           1HB      PHE  81  12.617 -10.080   0.906
  859    HD1  PHE  81           2HD      PHE  81  12.124 -12.194   2.097
  860    HD2  PHE  81           1HD      PHE  81   9.676  -8.742   2.509
  861    HE1  PHE  81           2HE      PHE  81  10.306 -13.595   2.985
  862    HE2  PHE  81           1HE      PHE  81   7.851 -10.135   3.395
  863    HZ   PHE  81           HZ       PHE  81   8.168 -12.565   3.637
  864    H    GLY  82           H        GLY  82  12.627  -7.358   0.947
  865    HA2  GLY  82           1HA      GLY  82  13.732  -5.474   0.138
  866    HA3  GLY  82           2HA      GLY  82  15.111  -5.875   1.155
  Start of MODEL   18
    1    H    SER 641           1H       SER 641  -6.837 -14.719 -22.724
    2    HA   SER 641           HA       SER 641  -5.255 -14.003 -21.349
    3    HB2  SER 641           2HB      SER 641  -3.298 -15.747 -22.770
    4    HB3  SER 641           1HB      SER 641  -3.739 -15.714 -21.062
    5    HG   SER 641           HG       SER 641  -4.973 -17.344 -21.504
    6    H    LEU 642           H        LEU 642  -4.222 -12.138 -21.208
    7    HA   LEU 642           HA       LEU 642  -3.018 -11.011 -23.591
    8    HB2  LEU 642           2HB      LEU 642  -4.535  -9.874 -21.750
    9    HB3  LEU 642           1HB      LEU 642  -2.988  -9.595 -20.974
   10    HG   LEU 642           HG       LEU 642  -2.274  -8.578 -23.243
   11   HD11  LEU 642          1HD1      LEU 642  -5.001  -7.698 -23.721
   12   HD12  LEU 642          2HD1      LEU 642  -3.778  -8.265 -24.857
   13   HD13  LEU 642          3HD1      LEU 642  -4.787  -9.426 -23.994
   14   HD21  LEU 642          3HD2      LEU 642  -2.336  -6.980 -21.643
   15   HD22  LEU 642          1HD2      LEU 642  -3.759  -6.463 -22.551
   16   HD23  LEU 642          2HD2      LEU 642  -3.949  -7.438 -21.093
   17    H    GLN 643           H        GLN 643  -1.403 -12.934 -23.222
   18    HA   GLN 643           HA       GLN 643   0.855 -12.115 -21.588
   19    HB2  GLN 643           2HB      GLN 643   0.076 -14.529 -23.096
   20    HB3  GLN 643           1HB      GLN 643   1.792 -14.149 -23.164
   21    HG2  GLN 643           2HG      GLN 643   1.854 -15.389 -21.293
   22    HG3  GLN 643           1HG      GLN 643   1.374 -13.874 -20.529
   23   HE21  GLN 643          1HE2      GLN 643   0.887 -16.462 -19.494
   24   HE22  GLN 643          2HE2      GLN 643  -0.833 -16.690 -19.436
   25    H    ASN 644           H        ASN 644   1.751 -10.300 -22.368
   26    HA   ASN 644           HA       ASN 644   1.786  -9.629 -25.134
   27    HB2  ASN 644           2HB      ASN 644   1.911  -8.092 -23.012
   28    HB3  ASN 644           1HB      ASN 644   3.646  -8.360 -23.151
   29   HD21  ASN 644          1HD2      ASN 644   4.548  -6.663 -24.044
   30   HD22  ASN 644          2HD2      ASN 644   3.933  -5.793 -25.412
   31    H    ASN 645           H        ASN 645   4.550 -10.147 -22.940
   32    HA   ASN 645           HA       ASN 645   5.821 -11.950 -24.766
   33    HB2  ASN 645           2HB      ASN 645   6.431  -9.951 -25.952
   34    HB3  ASN 645           1HB      ASN 645   6.900  -9.141 -24.460
   35   HD21  ASN 645          1HD2      ASN 645   9.006  -8.826 -24.551
   36   HD22  ASN 645          2HD2      ASN 645  10.191 -10.015 -24.987
   37    H    GLN 646           H        GLN 646   7.242 -13.221 -23.705
   38    HA   GLN 646           HA       GLN 646   7.675 -12.737 -20.881
   39    HB2  GLN 646           2HB      GLN 646   7.710 -15.023 -22.672
   40    HB3  GLN 646           1HB      GLN 646   9.136 -14.994 -21.645
   41    HG2  GLN 646           2HG      GLN 646   7.897 -15.978 -20.098
   42    HG3  GLN 646           1HG      GLN 646   7.064 -14.439 -19.906
   43   HE21  GLN 646          1HE2      GLN 646   6.493 -17.574 -20.138
   44   HE22  GLN 646          2HE2      GLN 646   4.969 -17.569 -20.968
   45    H    ASP 647           H        ASP 647   9.000 -10.888 -21.024
   46    HA   ASP 647           HA       ASP 647  11.266 -10.465 -22.502
   47    HB2  ASP 647           2HB      ASP 647  10.154  -8.914 -20.794
   48    HB3  ASP 647           1HB      ASP 647  11.148  -9.720 -19.585
   49    H    VAL 648           H        VAL 648  13.181 -11.408 -22.686
   50    HA   VAL 648           HA       VAL 648  13.931 -13.374 -20.626
   51    HB   VAL 648           HB       VAL 648  15.143 -14.420 -22.763
   52   HG11  VAL 648          1HG1      VAL 648  12.225 -14.891 -22.177
   53   HG12  VAL 648          2HG1      VAL 648  13.365 -16.030 -22.893
   54   HG13  VAL 648          3HG1      VAL 648  13.559 -15.528 -21.214
   55   HG21  VAL 648          3HG2      VAL 648  12.600 -13.628 -24.085
   56   HG22  VAL 648          1HG2      VAL 648  13.930 -12.469 -24.082
   57   HG23  VAL 648          2HG2      VAL 648  14.155 -14.067 -24.791
   58    H    SER 649           H        SER 649  15.783 -12.973 -19.656
   59    HA   SER 649           HA       SER 649  17.911 -11.556 -21.065
   60    HB2  SER 649           2HB      SER 649  18.408 -12.691 -18.366
   61    HB3  SER 649           1HB      SER 649  18.813 -11.100 -19.007
   62    HG   SER 649           HG       SER 649  16.788 -10.385 -18.577
   63    H    PHE 650           H        PHE 650  19.516 -12.630 -22.069
   64    HA   PHE 650           HA       PHE 650  19.371 -15.525 -22.081
   65    HB2  PHE 650           2HB      PHE 650  21.321 -13.901 -23.692
   66    HB3  PHE 650           1HB      PHE 650  20.612 -15.466 -24.072
   67    HD1  PHE 650           1HD      PHE 650  18.077 -15.517 -24.502
   68    HD2  PHE 650           2HD      PHE 650  20.423 -11.965 -24.583
   69    HE1  PHE 650           1HE      PHE 650  16.340 -14.405 -25.840
   70    HE2  PHE 650           2HE      PHE 650  18.689 -10.846 -25.924
   71    HZ   PHE 650           HZ       PHE 650  16.646 -12.067 -26.553
   72    H    GLU 651           H        GLU 651  21.599 -16.656 -22.313
   73    HA   GLU 651           HA       GLU 651  22.750 -16.568 -19.749
   74    HB2  GLU 651           2HB      GLU 651  23.146 -18.106 -22.228
   75    HB3  GLU 651           1HB      GLU 651  24.539 -18.033 -21.157
   76    HG2  GLU 651           2HG      GLU 651  21.815 -18.801 -20.179
   77    HG3  GLU 651           1HG      GLU 651  22.934 -19.974 -20.867
   78    H    ASN 652           H        ASN 652  23.487 -14.716 -22.514
   79    HA   ASN 652           HA       ASN 652  26.241 -14.238 -21.846
   80    HB2  ASN 652           2HB      ASN 652  25.835 -12.203 -23.442
   81    HB3  ASN 652           1HB      ASN 652  25.918 -13.830 -24.099
   82   HD21  ASN 652          1HD2      ASN 652  24.789 -13.049 -25.917
   83   HD22  ASN 652          2HD2      ASN 652  23.072 -12.802 -25.871
   84    H    ILE 653           H        ILE 653  23.158 -12.752 -21.158
   85    HA   ILE 653           HA       ILE 653  24.429 -10.518 -19.792
   86    HB   ILE 653           HB       ILE 653  21.484 -10.938 -19.643
   87   HG12  ILE 653          2HG1      ILE 653  22.665  -9.629 -22.072
   88   HG13  ILE 653          1HG1      ILE 653  22.388 -11.366 -22.055
   89   HG21  ILE 653          1HG2      ILE 653  23.420  -8.786 -19.348
   90   HG22  ILE 653          2HG2      ILE 653  22.023  -8.336 -20.326
   91   HG23  ILE 653          3HG2      ILE 653  21.793  -8.947 -18.689
   92   HD11  ILE 653          3HD1      ILE 653  20.190 -11.131 -22.328
   93   HD12  ILE 653          1HD1      ILE 653  20.090  -9.807 -21.166
   94   HD13  ILE 653          2HD1      ILE 653  20.580  -9.485 -22.829
   95    H    GLN 654           H        GLN 654  25.349 -12.471 -18.443
   96    HA   GLN 654           HA       GLN 654  23.631 -13.099 -16.191
   97    HB2  GLN 654           2HB      GLN 654  26.454 -13.816 -16.952
   98    HB3  GLN 654           1HB      GLN 654  25.861 -14.099 -15.321
   99    HG2  GLN 654           2HG      GLN 654  23.878 -15.195 -16.835
  100    HG3  GLN 654           1HG      GLN 654  25.314 -15.553 -17.794
  101   HE21  GLN 654          1HE2      GLN 654  24.921 -17.779 -17.327
  102   HE22  GLN 654          2HE2      GLN 654  25.399 -18.448 -15.792
  103    H    TRP 655           H        TRP 655  23.210 -11.005 -15.440
  104    HA   TRP 655           HA       TRP 655  25.232  -9.098 -14.939
  105    HB2  TRP 655           2HB      TRP 655  23.035  -8.547 -13.237
  106    HB3  TRP 655           1HB      TRP 655  23.449  -7.772 -14.759
  107    HD1  TRP 655           HD       TRP 655  21.813  -8.106 -16.723
  108    HE1  TRP 655           1HE      TRP 655  19.674  -9.490 -17.086
  109    HE3  TRP 655           3HE      TRP 655  21.953 -10.947 -12.474
  110    HZ2  TRP 655           2HZ      TRP 655  18.234 -11.515 -15.744
  111    HZ3  TRP 655           3HZ      TRP 655  20.156 -12.581 -12.090
  112    HH2  TRP 655           HH       TRP 655  18.336 -12.859 -13.690
  113    H    SER 656           H        SER 656  26.460  -8.687 -13.223
  114    HA   SER 656           HA       SER 656  26.285 -10.469 -10.917
  115    HB2  SER 656           2HB      SER 656  28.415  -8.513 -10.781
  116    HB3  SER 656           1HB      SER 656  28.530 -10.270 -10.871
  117    HG   SER 656           HG       SER 656  28.596 -10.182 -13.057
  118    H    ILE 657           H        ILE 657  24.222  -8.602 -11.248
  119    HA   ILE 657           HA       ILE 657  24.693  -6.235  -9.701
  120    HB   ILE 657           HB       ILE 657  22.202  -5.964  -9.832
  121   HG12  ILE 657          2HG1      ILE 657  21.979  -8.051 -11.905
  122   HG13  ILE 657          1HG1      ILE 657  22.154  -8.659 -10.262
  123   HG21  ILE 657          1HG2      ILE 657  24.144  -5.826 -11.914
  124   HG22  ILE 657          2HG2      ILE 657  22.580  -6.250 -12.607
  125   HG23  ILE 657          3HG2      ILE 657  22.745  -4.792 -11.630
  126   HD11  ILE 657          3HD1      ILE 657  19.828  -8.479 -10.806
  127   HD12  ILE 657          1HD1      ILE 657  20.226  -7.266  -9.590
  128   HD13  ILE 657          2HD1      ILE 657  20.025  -6.792 -11.276
  129    H    ASP 658           H        ASP 658  22.874  -5.795  -7.951
  130    HA   ASP 658           HA       ASP 658  23.076  -7.976  -6.002
  131    HB2  ASP 658           2HB      ASP 658  23.865  -5.628  -5.424
  132    HB3  ASP 658           1HB      ASP 658  22.173  -5.143  -5.468
  133    HA   PRO 659           HA       PRO 659  18.865  -8.871  -7.133
  134    HB2  PRO 659           2HB      PRO 659  18.980 -10.785  -4.903
  135    HB3  PRO 659           1HB      PRO 659  18.736 -11.082  -6.626
  136    HG2  PRO 659           2HG      PRO 659  21.022 -11.750  -5.382
  137    HG3  PRO 659           1HG      PRO 659  20.997 -11.187  -7.063
  138    HD2  PRO 659           2HD      PRO 659  21.705  -9.683  -4.570
  139    HD3  PRO 659           1HD      PRO 659  22.498  -9.660  -6.160
  140    H    GLY 660           H        GLY 660  19.939  -7.493  -4.239
  141    HA2  GLY 660           1HA      GLY 660  17.138  -7.147  -3.354
  142    HA3  GLY 660           2HA      GLY 660  18.495  -7.226  -2.237
  143    H    ALA 661           H        ALA 661  19.173  -5.583  -5.128
  144    HA   ALA 661           HA       ALA 661  19.229  -3.051  -3.695
  145    HB1  ALA 661           1HB      ALA 661  21.205  -3.234  -4.821
  146    HB2  ALA 661           2HB      ALA 661  20.481  -4.091  -6.182
  147    HB3  ALA 661           3HB      ALA 661  20.260  -2.349  -6.018
  148    H    ASP 662           H        ASP 662  17.338  -4.649  -6.106
  149    HA   ASP 662           HA       ASP 662  16.095  -2.131  -6.933
  150    HB2  ASP 662           2HB      ASP 662  16.734  -3.591  -8.769
  151    HB3  ASP 662           1HB      ASP 662  15.831  -4.929  -8.061
  152    H    LEU 663           H        LEU 663  14.352  -1.479  -5.909
  153    HA   LEU 663           HA       LEU 663  12.652  -3.465  -4.566
  154    HB2  LEU 663           2HB      LEU 663  13.350  -0.625  -4.024
  155    HB3  LEU 663           1HB      LEU 663  11.734  -1.144  -3.597
  156    HG   LEU 663           HG       LEU 663  14.168  -1.476  -2.143
  157   HD11  LEU 663          1HD1      LEU 663  11.825  -2.759  -1.023
  158   HD12  LEU 663          2HD1      LEU 663  12.731  -1.357  -0.454
  159   HD13  LEU 663          3HD1      LEU 663  11.469  -1.158  -1.670
  160   HD21  LEU 663          3HD2      LEU 663  12.998  -4.079  -1.875
  161   HD22  LEU 663          1HD2      LEU 663  13.540  -3.832  -3.533
  162   HD23  LEU 663          2HD2      LEU 663  14.673  -3.635  -2.199
  163    H    SER 664           H        SER 664  12.828  -1.601  -7.318
  164    HA   SER 664           HA       SER 664  10.209  -0.516  -7.463
  165    HB2  SER 664           2HB      SER 664  11.590  -1.093 -10.009
  166    HB3  SER 664           1HB      SER 664  10.947   0.431  -9.390
  167    HG   SER 664           HG       SER 664  13.451  -0.790  -8.913
  168    H    GLN 665           H        GLN 665  11.649  -3.541  -8.483
  169    HA   GLN 665           HA       GLN 665   9.554  -4.476 -10.109
  170    HB2  GLN 665           2HB      GLN 665  12.016  -5.485  -9.052
  171    HB3  GLN 665           1HB      GLN 665  10.759  -6.684  -8.790
  172    HG2  GLN 665           2HG      GLN 665  12.064  -6.872 -10.935
  173    HG3  GLN 665           1HG      GLN 665  10.307  -6.877 -11.081
  174   HE21  GLN 665          1HE2      GLN 665  12.835  -4.379 -10.845
  175   HE22  GLN 665          2HE2      GLN 665  12.289  -3.485 -12.231
  176    H    TYR 666           H        TYR 666   9.833  -4.188  -6.695
  177    HA   TYR 666           HA       TYR 666   7.710  -6.150  -6.220
  178    HB2  TYR 666           2HB      TYR 666   9.589  -4.758  -4.304
  179    HB3  TYR 666           1HB      TYR 666   8.355  -5.921  -3.831
  180    HD1  TYR 666           2HD      TYR 666   8.507  -8.274  -4.863
  181    HD2  TYR 666           1HD      TYR 666  11.723  -5.483  -4.901
  182    HE1  TYR 666           2HE      TYR 666  10.091 -10.115  -5.237
  183    HE2  TYR 666           1HE      TYR 666  13.318  -7.319  -5.281
  184    HH   TYR 666           HH       TYR 666  12.188 -10.688  -5.634
  185    H    LYS 667           H        LYS 667   7.708  -3.082  -7.066
  186    HA   LYS 667           HA       LYS 667   6.021  -1.965  -5.012
  187    HB2  LYS 667           2HB      LYS 667   7.313  -1.020  -7.463
  188    HB3  LYS 667           1HB      LYS 667   5.719  -0.332  -7.197
  189    HG2  LYS 667           2HG      LYS 667   6.462   1.008  -5.590
  190    HG3  LYS 667           1HG      LYS 667   7.328  -0.305  -4.789
  191    HD2  LYS 667           2HD      LYS 667   9.291   0.256  -5.735
  192    HD3  LYS 667           1HD      LYS 667   8.545   0.595  -7.297
  193    HE2  LYS 667           2HE      LYS 667   7.621   2.703  -6.141
  194    HE3  LYS 667           1HE      LYS 667   8.861   2.396  -4.927
  195    HZ1  LYS 667           3HZ      LYS 667   9.619   3.933  -6.640
  196    HZ2  LYS 667           1HZ      LYS 667   9.359   2.757  -7.833
  197    HZ3  LYS 667           2HZ      LYS 667  10.544   2.509  -6.648
  198    H    MET 668           H        MET 668   3.908  -2.240  -4.854
  199    HA   MET 668           HA       MET 668   2.448  -3.492  -7.044
  200    HB2  MET 668           2HB      MET 668   0.692  -3.896  -5.455
  201    HB3  MET 668           1HB      MET 668   2.217  -4.332  -4.697
  202    HG2  MET 668           2HG      MET 668   2.182  -2.027  -3.645
  203    HG3  MET 668           1HG      MET 668   0.511  -1.917  -4.194
  204    HE1  MET 668           3HE      MET 668   2.469  -4.743  -1.335
  205    HE2  MET 668           1HE      MET 668   1.581  -5.734  -2.494
  206    HE3  MET 668           2HE      MET 668   2.786  -4.576  -3.063
  207    H    ASP 669           H        ASP 669   0.447  -2.640  -7.836
  208    HA   ASP 669           HA       ASP 669   0.431   0.293  -7.813
  209    HB2  ASP 669           2HB      ASP 669   0.566  -0.795 -10.029
  210    HB3  ASP 669           1HB      ASP 669  -0.962  -1.610  -9.711
  211    H    VAL 670           H        VAL 670  -0.908   1.207  -6.445
  212    HA   VAL 670           HA       VAL 670  -3.185  -0.240  -5.397
  213    HB   VAL 670           HB       VAL 670  -2.621   2.629  -4.735
  214   HG11  VAL 670          1HG1      VAL 670  -3.752   0.270  -3.250
  215   HG12  VAL 670          2HG1      VAL 670  -3.333   1.794  -2.464
  216   HG13  VAL 670          3HG1      VAL 670  -4.571   1.760  -3.720
  217   HG21  VAL 670          3HG2      VAL 670  -0.977   0.259  -3.908
  218   HG22  VAL 670          1HG2      VAL 670  -0.441   1.837  -4.482
  219   HG23  VAL 670          2HG2      VAL 670  -1.127   1.675  -2.866
  220    H    THR 671           H        THR 671  -4.663  -0.375  -7.045
  221    HA   THR 671           HA       THR 671  -5.570   2.048  -8.373
  222    HB   THR 671           HB       THR 671  -6.948  -0.590  -8.723
  223    HG1  THR 671           1HG      THR 671  -4.276   0.026  -9.411
  224   HG21  THR 671          3HG2      THR 671  -6.041   1.275 -10.885
  225   HG22  THR 671          1HG2      THR 671  -7.445   1.693  -9.900
  226   HG23  THR 671          2HG2      THR 671  -7.441   0.202 -10.844
  227    H    VAL 672           H        VAL 672  -6.913   3.311  -7.272
  228    HA   VAL 672           HA       VAL 672  -8.745   2.188  -5.310
  229    HB   VAL 672           HB       VAL 672  -8.726   5.097  -6.018
  230   HG11  VAL 672          1HG1      VAL 672 -10.151   3.715  -4.230
  231   HG12  VAL 672          2HG1      VAL 672  -8.747   4.103  -3.236
  232   HG13  VAL 672          3HG1      VAL 672  -9.679   5.397  -3.992
  233   HG21  VAL 672          3HG2      VAL 672  -6.386   3.665  -5.240
  234   HG22  VAL 672          1HG2      VAL 672  -6.586   5.396  -5.511
  235   HG23  VAL 672          2HG2      VAL 672  -6.881   4.715  -3.912
  236    H    ILE 673           H        ILE 673 -10.766   1.654  -5.779
  237    HA   ILE 673           HA       ILE 673 -11.894   2.535  -8.332
  238    HB   ILE 673           HB       ILE 673 -12.673   0.320  -6.440
  239   HG12  ILE 673          2HG1      ILE 673 -12.331  -0.785  -8.911
  240   HG13  ILE 673          1HG1      ILE 673 -11.158   0.526  -8.970
  241   HG21  ILE 673          1HG2      ILE 673 -14.589  -0.143  -7.630
  242   HG22  ILE 673          2HG2      ILE 673 -14.589   1.621  -7.647
  243   HG23  ILE 673          3HG2      ILE 673 -14.041   0.726  -9.063
  244   HD11  ILE 673          3HD1      ILE 673 -10.095  -0.335  -6.946
  245   HD12  ILE 673          1HD1      ILE 673 -11.283  -1.635  -6.876
  246   HD13  ILE 673          2HD1      ILE 673 -10.143  -1.555  -8.218
  247    H    ASP 674           H        ASP 674 -13.325   4.109  -8.415
  248    HA   ASP 674           HA       ASP 674 -14.476   5.210  -6.013
  249    HB2  ASP 674           2HB      ASP 674 -14.672   5.923  -8.937
  250    HB3  ASP 674           1HB      ASP 674 -15.668   6.721  -7.725
  251    H    THR 675           H        THR 675 -15.997   3.956  -5.102
  252    HA   THR 675           HA       THR 675 -17.845   2.371  -6.563
  253    HB   THR 675           HB       THR 675 -18.668   3.029  -3.848
  254    HG1  THR 675           1HG      THR 675 -16.652   1.819  -3.085
  255   HG21  THR 675          3HG2      THR 675 -19.460   0.977  -4.286
  256   HG22  THR 675          1HG2      THR 675 -17.834   0.404  -3.916
  257   HG23  THR 675          2HG2      THR 675 -18.300   0.715  -5.589
  258    H    LYS 676           H        LYS 676 -19.475   3.160  -7.709
  259    HA   LYS 676           HA       LYS 676 -20.679   5.713  -7.045
  260    HB2  LYS 676           2HB      LYS 676 -20.208   4.445  -9.418
  261    HB3  LYS 676           1HB      LYS 676 -21.912   4.092  -9.170
  262    HG2  LYS 676           2HG      LYS 676 -22.250   6.059 -10.170
  263    HG3  LYS 676           1HG      LYS 676 -21.831   6.740  -8.596
  264    HD2  LYS 676           2HD      LYS 676 -19.909   7.597  -9.364
  265    HD3  LYS 676           1HD      LYS 676 -19.501   6.120 -10.237
  266    HE2  LYS 676           2HE      LYS 676 -19.955   7.202 -12.129
  267    HE3  LYS 676           1HE      LYS 676 -21.647   7.239 -11.637
  268    HZ1  LYS 676           3HZ      LYS 676 -21.062   9.447 -12.075
  269    HZ2  LYS 676           1HZ      LYS 676 -19.583   9.326 -11.250
  270    HZ3  LYS 676           2HZ      LYS 676 -21.042   9.328 -10.383
  271    H    ASP 677           H        ASP 677 -21.477   2.296  -6.940
  272    HA   ASP 677           HA       ASP 677 -24.225   2.755  -6.191
  273    HB2  ASP 677           2HB      ASP 677 -23.459   0.119  -5.458
  274    HB3  ASP 677           1HB      ASP 677 -24.461   0.622  -6.809
  275    H    GLY 678           H        GLY 678 -23.127   4.276  -4.513
  276    HA2  GLY 678           1HA      GLY 678 -23.536   2.959  -1.951
  277    HA3  GLY 678           2HA      GLY 678 -21.959   3.706  -2.185
  278    H    SER 679           H        SER 679 -22.669   5.939  -3.647
  279    HA   SER 679           HA       SER 679 -23.801   7.613  -1.612
  280    HB2  SER 679           2HB      SER 679 -23.391   8.798  -4.263
  281    HB3  SER 679           1HB      SER 679 -22.715   9.268  -2.703
  282    HG   SER 679           HG       SER 679 -21.033   7.952  -2.999
  283    H    GLN 680           H        GLN 680 -25.027   5.833  -4.209
  284    HA   GLN 680           HA       GLN 680 -27.406   7.534  -4.448
  285    HB2  GLN 680           2HB      GLN 680 -26.005   5.679  -6.271
  286    HB3  GLN 680           1HB      GLN 680 -27.759   5.603  -6.327
  287    HG2  GLN 680           2HG      GLN 680 -27.154   7.140  -7.981
  288    HG3  GLN 680           1HG      GLN 680 -27.720   8.117  -6.628
  289   HE21  GLN 680          1HE2      GLN 680 -25.015   7.208  -8.582
  290   HE22  GLN 680          2HE2      GLN 680 -23.902   8.370  -7.942
  291    H    SER 681           H        SER 681 -28.497   6.948  -2.599
  292    HA   SER 681           HA       SER 681 -28.838   4.198  -1.835
  293    HB2  SER 681           2HB      SER 681 -30.652   6.004  -0.510
  294    HB3  SER 681           1HB      SER 681 -29.257   5.147   0.153
  295    HG   SER 681           HG       SER 681 -28.357   7.041   0.249
  296    H    LYS 682           H        LYS 682 -30.466   6.372  -3.899
  297    HA   LYS 682           HA       LYS 682 -33.106   5.308  -3.611
  298    HB2  LYS 682           2HB      LYS 682 -32.096   7.583  -4.713
  299    HB3  LYS 682           1HB      LYS 682 -32.425   6.632  -6.155
  300    HG2  LYS 682           2HG      LYS 682 -34.726   6.282  -4.763
  301    HG3  LYS 682           1HG      LYS 682 -34.270   7.917  -4.278
  302    HD2  LYS 682           2HD      LYS 682 -33.966   7.413  -7.141
  303    HD3  LYS 682           1HD      LYS 682 -35.628   7.254  -6.570
  304    HE2  LYS 682           2HE      LYS 682 -34.598   9.553  -5.335
  305    HE3  LYS 682           1HE      LYS 682 -34.063   9.626  -7.013
  306    HZ1  LYS 682           3HZ      LYS 682 -36.710   9.923  -5.917
  307    HZ2  LYS 682           1HZ      LYS 682 -36.645   8.883  -7.255
  308    HZ3  LYS 682           2HZ      LYS 682 -36.076  10.473  -7.390
  309    H    LEU 683           H        LEU 683 -30.330   4.115  -5.051
  310    HA   LEU 683           HA       LEU 683 -31.367   2.904  -7.389
  311    HB2  LEU 683           2HB      LEU 683 -28.876   3.082  -6.045
  312    HB3  LEU 683           1HB      LEU 683 -29.212   1.380  -6.288
  313    HG   LEU 683           HG       LEU 683 -29.548   1.857  -8.720
  314   HD11  LEU 683          1HD1      LEU 683 -29.041   3.917  -9.674
  315   HD12  LEU 683          2HD1      LEU 683 -29.969   4.350  -8.237
  316   HD13  LEU 683          3HD1      LEU 683 -28.211   4.490  -8.229
  317   HD21  LEU 683          3HD2      LEU 683 -26.951   2.631  -8.866
  318   HD22  LEU 683          1HD2      LEU 683 -27.037   2.017  -7.215
  319   HD23  LEU 683          2HD2      LEU 683 -27.491   0.980  -8.569
  320    H    GLY 684           H        GLY 684 -33.033   1.537  -7.299
  321    HA2  GLY 684           1HA      GLY 684 -33.318  -0.933  -6.907
  322    HA3  GLY 684           2HA      GLY 684 -32.961  -0.571  -5.226
  323    H    GLY 685           H        GLY 685 -34.549   2.026  -5.658
  324    HA2  GLY 685           1HA      GLY 685 -37.237   0.811  -5.539
  325    HA3  GLY 685           2HA      GLY 685 -36.688   1.909  -4.283
  326    H    GLY 901           H        GLY 901 -36.537   1.954  -7.844
  327    HA2  GLY 901           1HA      GLY 901 -37.433   4.750  -7.738
  328    HA3  GLY 901           2HA      GLY 901 -36.625   3.978  -9.096
  329    H    GLY 902           H        GLY 902 -39.626   3.640  -7.190
  330    HA2  GLY 902           1HA      GLY 902 -41.515   4.261  -8.956
  331    HA3  GLY 902           2HA      GLY 902 -41.012   2.692  -9.571
  332    H    SER 903           H        SER 903 -43.257   2.113  -9.154
  333    HA   SER 903           HA       SER 903 -43.636   1.295  -6.354
  334    HB2  SER 903           2HB      SER 903 -46.182   1.492  -7.561
  335    HB3  SER 903           1HB      SER 903 -45.517   2.520  -6.292
  336    HG   SER 903           HG       SER 903 -45.196   4.060  -7.692
  337    H    GLY 904           H        GLY 904 -45.934  -0.241  -6.753
  338    HA2  GLY 904           1HA      GLY 904 -46.786  -2.130  -7.831
  339    HA3  GLY 904           2HA      GLY 904 -45.426  -2.080  -8.945
  340    H    GLY 905           H        GLY 905 -43.245  -2.283  -7.534
  341    HA2  GLY 905           1HA      GLY 905 -43.506  -4.296  -5.458
  342    HA3  GLY 905           2HA      GLY 905 -42.756  -4.846  -6.953
  343    H    HIS 906           H        HIS 906 -40.893  -5.262  -5.549
  344    HA   HIS 906           HA       HIS 906 -39.291  -2.810  -5.222
  345    HB2  HIS 906           2HB      HIS 906 -40.234  -4.265  -3.097
  346    HB3  HIS 906           1HB      HIS 906 -38.647  -4.985  -3.350
  347    HD1  HIS 906           1HD      HIS 906 -40.294  -2.068  -1.858
  348    HD2  HIS 906           2HD      HIS 906 -36.492  -3.067  -3.212
  349    HE1  HIS 906           1HE      HIS 906 -38.721  -0.349  -0.883
  350    H    MET 907           H        MET 907 -38.045  -3.049  -6.998
  351    HA   MET 907           HA       MET 907 -36.992  -5.500  -7.934
  352    HB2  MET 907           2HB      MET 907 -37.264  -3.201  -9.137
  353    HB3  MET 907           1HB      MET 907 -35.673  -2.859  -8.474
  354    HG2  MET 907           2HG      MET 907 -34.671  -4.069 -10.030
  355    HG3  MET 907           1HG      MET 907 -35.731  -5.447  -9.739
  356    HE1  MET 907           3HE      MET 907 -35.353  -2.131 -12.219
  357    HE2  MET 907           1HE      MET 907 -37.099  -1.887 -12.248
  358    HE3  MET 907           2HE      MET 907 -36.229  -1.856 -10.714
  359    H    GLY 908           H        GLY 908 -35.540  -2.856  -6.057
  360    HA2  GLY 908           1HA      GLY 908 -33.893  -2.920  -4.452
  361    HA3  GLY 908           2HA      GLY 908 -33.975  -4.673  -4.513
  362    H    SER 909           H        SER 909 -31.637  -4.475  -4.221
  363    HA   SER 909           HA       SER 909 -30.164  -3.720  -6.624
  364    HB2  SER 909           2HB      SER 909 -28.483  -4.835  -4.593
  365    HB3  SER 909           1HB      SER 909 -28.565  -3.164  -5.148
  366    HG   SER 909           HG       SER 909 -29.986  -2.677  -3.562
  367    H    GLY 910           H        GLY 910 -29.241  -5.174  -7.984
  368    HA2  GLY 910           1HA      GLY 910 -30.111  -7.928  -7.716
  369    HA3  GLY 910           2HA      GLY 910 -29.326  -7.210  -9.115
  370    H    GLY 911           H        GLY 911 -28.423  -7.618  -5.691
  371    HA2  GLY 911           1HA      GLY 911 -26.696  -9.529  -5.469
  372    HA3  GLY 911           2HA      GLY 911 -25.784  -8.544  -6.606
  373    H    LEU  18           H        LEU  18 -26.656  -9.040  -3.348
  374    HA   LEU  18           HA       LEU  18 -25.669  -6.424  -2.496
  375    HB2  LEU  18           2HB      LEU  18 -27.100  -8.676  -1.135
  376    HB3  LEU  18           1HB      LEU  18 -26.246  -7.478  -0.180
  377    HG   LEU  18           HG       LEU  18 -27.777  -5.947  -1.907
  378   HD11  LEU  18          1HD1      LEU  18 -30.078  -6.899  -1.482
  379   HD12  LEU  18          2HD1      LEU  18 -29.105  -7.733  -2.695
  380   HD13  LEU  18          3HD1      LEU  18 -29.275  -8.416  -1.077
  381   HD21  LEU  18          3HD2      LEU  18 -28.890  -6.697   0.740
  382   HD22  LEU  18          1HD2      LEU  18 -27.278  -5.982   0.692
  383   HD23  LEU  18          2HD2      LEU  18 -28.653  -5.104   0.019
  384    H    SER  19           H        SER  19 -24.079  -8.805  -3.602
  385    HA   SER  19           HA       SER  19 -22.263  -9.362  -1.416
  386    HB2  SER  19           2HB      SER  19 -21.222 -10.206  -3.939
  387    HB3  SER  19           1HB      SER  19 -21.867 -11.202  -2.631
  388    HG   SER  19           HG       SER  19 -22.994 -10.525  -5.029
  389    H    TRP  20           H        TRP  20 -22.589  -7.232  -4.097
  390    HA   TRP  20           HA       TRP  20 -21.279  -5.652  -5.070
  391    HB2  TRP  20           2HB      TRP  20 -19.870  -5.260  -2.452
  392    HB3  TRP  20           1HB      TRP  20 -20.400  -4.056  -3.618
  393    HD1  TRP  20           HD       TRP  20 -23.423  -4.489  -3.835
  394    HE1  TRP  20           1HE      TRP  20 -25.001  -4.179  -1.820
  395    HE3  TRP  20           3HE      TRP  20 -20.021  -5.031  -0.057
  396    HZ2  TRP  20           2HZ      TRP  20 -24.816  -4.167   1.001
  397    HZ3  TRP  20           3HZ      TRP  20 -20.801  -4.853   2.270
  398    HH2  TRP  20           HH       TRP  20 -23.149  -4.429   2.789
  399    H    LYS  21           H        LYS  21 -18.574  -5.644  -3.101
  400    HA   LYS  21           HA       LYS  21 -17.110  -7.404  -4.947
  401    HB2  LYS  21           2HB      LYS  21 -16.723  -4.637  -4.423
  402    HB3  LYS  21           1HB      LYS  21 -15.356  -5.498  -3.732
  403    HG2  LYS  21           2HG      LYS  21 -15.061  -4.716  -6.093
  404    HG3  LYS  21           1HG      LYS  21 -14.772  -6.435  -5.824
  405    HD2  LYS  21           2HD      LYS  21 -16.433  -7.032  -7.194
  406    HD3  LYS  21           1HD      LYS  21 -17.545  -5.858  -6.488
  407    HE2  LYS  21           2HE      LYS  21 -16.281  -4.098  -7.820
  408    HE3  LYS  21           1HE      LYS  21 -15.541  -5.441  -8.690
  409    HZ1  LYS  21           3HZ      LYS  21 -18.419  -4.719  -8.586
  410    HZ2  LYS  21           1HZ      LYS  21 -17.859  -6.198  -9.202
  411    HZ3  LYS  21           2HZ      LYS  21 -17.401  -4.741  -9.942
  412    H    ARG  22           H        ARG  22 -15.739  -8.864  -4.066
  413    HA   ARG  22           HA       ARG  22 -16.028  -9.292  -1.195
  414    HB2  ARG  22           2HB      ARG  22 -16.519 -11.151  -2.740
  415    HB3  ARG  22           1HB      ARG  22 -14.870 -11.081  -3.346
  416    HG2  ARG  22           2HG      ARG  22 -14.394 -12.633  -1.831
  417    HG3  ARG  22           1HG      ARG  22 -14.536 -11.355  -0.623
  418    HD2  ARG  22           2HD      ARG  22 -16.734 -11.950  -0.089
  419    HD3  ARG  22           1HD      ARG  22 -16.937 -12.881  -1.572
  420    HE   ARG  22           HE       ARG  22 -15.539 -13.728   0.857
  421   HH11  ARG  22          2HH1      ARG  22 -16.552 -14.451  -2.427
  422   HH12  ARG  22          1HH1      ARG  22 -16.287 -16.160  -2.254
  423   HH21  ARG  22          2HH2      ARG  22 -15.191 -15.958   1.071
  424   HH22  ARG  22          1HH2      ARG  22 -15.530 -17.020  -0.266
  425    H    CYS  23           H        CYS  23 -14.321  -9.470   0.223
  426    HA   CYS  23           HA       CYS  23 -11.816  -8.266  -0.639
  427    HB2  CYS  23           2HB      CYS  23 -12.725  -7.384   1.409
  428    HB3  CYS  23           1HB      CYS  23 -12.898  -8.999   2.090
  429    H    ALA  24           H        ALA  24  -9.781  -9.239  -0.184
  430    HA   ALA  24           HA       ALA  24  -9.884 -12.178   0.069
  431    HB1  ALA  24           1HB      ALA  24  -7.623 -10.731  -1.267
  432    HB2  ALA  24           2HB      ALA  24  -8.126 -12.412  -1.438
  433    HB3  ALA  24           3HB      ALA  24  -9.098 -11.125  -2.152
  434    H    GLY  25           H        GLY  25  -9.543  -9.806   1.997
  435    HA2  GLY  25           1HA      GLY  25  -6.947 -10.607   3.158
  436    HA3  GLY  25           2HA      GLY  25  -7.715  -9.047   3.399
  437    H    CYS  26           H        CYS  26 -10.238  -9.630   4.224
  438    HA   CYS  26           HA       CYS  26  -9.603 -10.835   6.805
  439    HB2  CYS  26           2HB      CYS  26 -11.827  -9.778   7.512
  440    HB3  CYS  26           1HB      CYS  26 -10.486  -8.695   7.175
  441    H    GLY  27           H        GLY  27 -12.876 -10.595   5.678
  442    HA2  GLY  27           1HA      GLY  27 -13.170 -13.246   4.732
  443    HA3  GLY  27           2HA      GLY  27 -13.545 -13.198   6.450
  444    H    GLY  28           H        GLY  28 -14.356 -11.728   3.339
  445    HA2  GLY  28           1HA      GLY  28 -17.008 -12.086   3.288
  446    HA3  GLY  28           2HA      GLY  28 -16.875 -10.727   4.393
  447    H    LYS  29           H        LYS  29 -18.003  -9.385   2.961
  448    HA   LYS  29           HA       LYS  29 -16.643  -8.767   0.440
  449    HB2  LYS  29           2HB      LYS  29 -18.712  -7.461  -0.079
  450    HB3  LYS  29           1HB      LYS  29 -18.986  -9.182   0.140
  451    HG2  LYS  29           2HG      LYS  29 -19.359  -8.074   2.667
  452    HG3  LYS  29           1HG      LYS  29 -20.127  -6.945   1.547
  453    HD2  LYS  29           2HD      LYS  29 -21.127  -9.129   0.503
  454    HD3  LYS  29           1HD      LYS  29 -20.763  -9.813   2.088
  455    HE2  LYS  29           2HE      LYS  29 -22.170  -8.265   3.184
  456    HE3  LYS  29           1HE      LYS  29 -22.321  -7.267   1.739
  457    HZ1  LYS  29           3HZ      LYS  29 -24.297  -8.639   2.188
  458    HZ2  LYS  29           1HZ      LYS  29 -23.362 -10.040   1.985
  459    HZ3  LYS  29           2HZ      LYS  29 -23.599  -8.979   0.681
  460    H    ILE  30           H        ILE  30 -16.334  -6.518  -0.126
  461    HA   ILE  30           HA       ILE  30 -15.156  -5.053   2.028
  462    HB   ILE  30           HB       ILE  30 -15.599  -4.304  -0.867
  463   HG12  ILE  30          2HG1      ILE  30 -12.906  -4.814   0.292
  464   HG13  ILE  30          1HG1      ILE  30 -13.949  -6.210   0.038
  465   HG21  ILE  30          1HG2      ILE  30 -15.289  -2.456   1.002
  466   HG22  ILE  30          2HG2      ILE  30 -13.592  -2.901   0.814
  467   HG23  ILE  30          3HG2      ILE  30 -14.512  -2.325  -0.576
  468   HD11  ILE  30          3HD1      ILE  30 -12.807  -6.131  -1.939
  469   HD12  ILE  30          1HD1      ILE  30 -14.242  -5.189  -2.341
  470   HD13  ILE  30          2HD1      ILE  30 -12.731  -4.367  -1.954
  471    H    ALA  31           H        ALA  31 -16.407  -4.055   3.464
  472    HA   ALA  31           HA       ALA  31 -18.767  -2.610   2.483
  473    HB1  ALA  31           1HB      ALA  31 -18.200  -3.296   5.356
  474    HB2  ALA  31           2HB      ALA  31 -19.733  -2.812   4.627
  475    HB3  ALA  31           3HB      ALA  31 -19.045  -4.394   4.261
  476    H    ASP  32           H        ASP  32 -15.737  -1.959   2.834
  477    HA   ASP  32           HA       ASP  32 -15.810   0.390   4.522
  478    HB2  ASP  32           2HB      ASP  32 -13.751  -1.053   2.939
  479    HB3  ASP  32           1HB      ASP  32 -13.481   0.667   3.203
  480    H    ARG  33           H        ARG  33 -17.324  -0.088   1.864
  481    HA   ARG  33           HA       ARG  33 -18.209   1.167   0.222
  482    HB2  ARG  33           2HB      ARG  33 -18.307   3.059   1.724
  483    HB3  ARG  33           1HB      ARG  33 -16.608   3.418   1.447
  484    HG2  ARG  33           2HG      ARG  33 -17.205   4.777  -0.192
  485    HG3  ARG  33           1HG      ARG  33 -17.819   3.386  -1.083
  486    HD2  ARG  33           2HD      ARG  33 -19.269   5.416   0.522
  487    HD3  ARG  33           1HD      ARG  33 -19.707   4.663  -1.009
  488    HE   ARG  33           HE       ARG  33 -20.019   2.594   0.577
  489   HH11  ARG  33          2HH1      ARG  33 -20.939   5.931   1.131
  490   HH12  ARG  33          1HH1      ARG  33 -22.225   5.528   2.230
  491   HH21  ARG  33          2HH2      ARG  33 -21.694   2.058   2.015
  492   HH22  ARG  33          1HH2      ARG  33 -22.644   3.314   2.755
  493    H    PHE  34           H        PHE  34 -14.866   2.408   0.520
  494    HA   PHE  34           HA       PHE  34 -14.634   2.141  -2.377
  495    HB2  PHE  34           2HB      PHE  34 -13.365   3.833  -0.319
  496    HB3  PHE  34           1HB      PHE  34 -12.306   3.314  -1.630
  497    HD1  PHE  34           1HD      PHE  34 -15.879   4.348  -1.450
  498    HD2  PHE  34           2HD      PHE  34 -12.049   4.976  -3.188
  499    HE1  PHE  34           1HE      PHE  34 -16.838   6.074  -2.908
  500    HE2  PHE  34           2HE      PHE  34 -12.996   6.714  -4.651
  501    HZ   PHE  34           HZ       PHE  34 -15.393   7.263  -4.516
  502    H    LEU  35           H        LEU  35 -13.535   0.601  -3.318
  503    HA   LEU  35           HA       LEU  35 -11.909  -1.178  -1.660
  504    HB2  LEU  35           2HB      LEU  35 -12.030  -2.508  -3.967
  505    HB3  LEU  35           1HB      LEU  35 -13.267  -2.633  -2.733
  506    HG   LEU  35           HG       LEU  35 -13.732  -0.491  -4.692
  507   HD11  LEU  35          1HD1      LEU  35 -12.932  -1.896  -6.351
  508   HD12  LEU  35          2HD1      LEU  35 -13.457  -3.354  -5.508
  509   HD13  LEU  35          3HD1      LEU  35 -14.645  -2.312  -6.290
  510   HD21  LEU  35          3HD2      LEU  35 -15.201  -1.708  -2.806
  511   HD22  LEU  35          1HD2      LEU  35 -15.897  -0.933  -4.230
  512   HD23  LEU  35          2HD2      LEU  35 -15.646  -2.680  -4.209
  513    H    LEU  36           H        LEU  36  -9.840  -1.789  -2.291
  514    HA   LEU  36           HA       LEU  36  -8.570  -0.009  -4.264
  515    HB2  LEU  36           2HB      LEU  36  -7.523  -0.846  -1.559
  516    HB3  LEU  36           1HB      LEU  36  -6.555  -0.039  -2.778
  517    HG   LEU  36           HG       LEU  36  -8.839   1.560  -2.437
  518   HD11  LEU  36          1HD1      LEU  36  -7.618   1.039   0.253
  519   HD12  LEU  36          2HD1      LEU  36  -9.089   1.931  -0.147
  520   HD13  LEU  36          3HD1      LEU  36  -9.056   0.173  -0.295
  521   HD21  LEU  36          3HD2      LEU  36  -7.047   3.027  -1.263
  522   HD22  LEU  36          1HD2      LEU  36  -5.939   1.741  -1.743
  523   HD23  LEU  36          2HD2      LEU  36  -6.857   2.616  -2.968
  524    H    TYR  37           H        TYR  37  -6.479  -0.839  -5.038
  525    HA   TYR  37           HA       TYR  37  -6.478  -3.782  -5.203
  526    HB2  TYR  37           2HB      TYR  37  -6.422  -1.734  -7.252
  527    HB3  TYR  37           1HB      TYR  37  -5.005  -2.768  -7.362
  528    HD1  TYR  37           1HD      TYR  37  -5.536  -5.366  -7.216
  529    HD2  TYR  37           2HD      TYR  37  -8.321  -2.364  -8.360
  530    HE1  TYR  37           1HE      TYR  37  -6.876  -7.065  -8.378
  531    HE2  TYR  37           2HE      TYR  37  -9.671  -4.048  -9.518
  532    HH   TYR  37           HH       TYR  37  -8.905  -6.605 -10.607
  533    H    ALA  38           H        ALA  38  -4.478  -4.824  -5.164
  534    HA   ALA  38           HA       ALA  38  -2.118  -3.171  -4.617
  535    HB1  ALA  38           1HB      ALA  38  -1.502  -5.044  -2.916
  536    HB2  ALA  38           2HB      ALA  38  -2.594  -3.749  -2.426
  537    HB3  ALA  38           3HB      ALA  38  -3.241  -5.326  -2.875
  538    H    MET  39           H        MET  39  -2.367  -6.645  -4.282
  539    HA   MET  39           HA       MET  39  -0.422  -7.027  -6.374
  540    HB2  MET  39           2HB      MET  39  -1.786  -8.838  -4.403
  541    HB3  MET  39           1HB      MET  39  -0.887  -9.511  -5.754
  542    HG2  MET  39           2HG      MET  39   0.720  -9.496  -4.138
  543    HG3  MET  39           1HG      MET  39   1.004  -7.928  -4.892
  544    HE1  MET  39           3HE      MET  39   0.127  -9.829  -1.645
  545    HE2  MET  39           1HE      MET  39  -0.891  -8.686  -0.770
  546    HE3  MET  39           2HE      MET  39  -1.492  -9.450  -2.243
  547    H    ASP  40           H        ASP  40  -3.360  -8.941  -5.821
  548    HA   ASP  40           HA       ASP  40  -4.157  -8.482  -8.610
  549    HB2  ASP  40           2HB      ASP  40  -4.199 -10.740  -9.170
  550    HB3  ASP  40           1HB      ASP  40  -2.758 -10.654  -8.162
  551    H    SER  41           H        SER  41  -5.049  -8.485  -5.428
  552    HA   SER  41           HA       SER  41  -7.750  -9.516  -5.952
  553    HB2  SER  41           2HB      SER  41  -7.129  -9.295  -3.152
  554    HB3  SER  41           1HB      SER  41  -7.509 -10.741  -4.093
  555    HG   SER  41           HG       SER  41  -5.264 -10.757  -4.753
  556    H    TYR  42           H        TYR  42  -9.431  -8.560  -4.440
  557    HA   TYR  42           HA       TYR  42  -9.262  -5.656  -4.532
  558    HB2  TYR  42           2HB      TYR  42 -11.486  -7.625  -4.062
  559    HB3  TYR  42           1HB      TYR  42 -11.688  -5.933  -3.631
  560    HD1  TYR  42           1HD      TYR  42 -10.845  -4.294  -5.648
  561    HD2  TYR  42           2HD      TYR  42 -12.367  -8.243  -6.082
  562    HE1  TYR  42           1HE      TYR  42 -11.519  -3.775  -7.950
  563    HE2  TYR  42           2HE      TYR  42 -13.039  -7.737  -8.392
  564    HH   TYR  42           HH       TYR  42 -12.828  -4.472  -9.690
  565    H    TRP  43           H        TRP  43  -9.158  -4.364  -2.763
  566    HA   TRP  43           HA       TRP  43  -9.278  -5.627  -0.112
  567    HB2  TRP  43           2HB      TRP  43  -7.191  -3.568  -0.840
  568    HB3  TRP  43           1HB      TRP  43  -7.282  -4.535   0.626
  569    HD1  TRP  43           HD       TRP  43  -6.234  -4.741  -3.045
  570    HE1  TRP  43           1HE      TRP  43  -4.780  -6.834  -3.366
  571    HE3  TRP  43           3HE      TRP  43  -6.808  -6.863   1.571
  572    HZ2  TRP  43           2HZ      TRP  43  -3.973  -9.082  -1.877
  573    HZ3  TRP  43           3HZ      TRP  43  -5.655  -8.991   2.041
  574    HH2  TRP  43           HH       TRP  43  -4.269 -10.071   0.347
  575    H    HIS  44           H        HIS  44  -9.063  -3.750   1.579
  576    HA   HIS  44           HA       HIS  44 -10.293  -1.267   0.727
  577    HB2  HIS  44           2HB      HIS  44 -11.920  -1.388   2.701
  578    HB3  HIS  44           1HB      HIS  44 -12.318  -2.364   1.297
  579    HD1  HIS  44           1HD      HIS  44 -13.122  -2.810   4.491
  580    HD2  HIS  44           2HD      HIS  44 -10.463  -4.961   2.122
  581    HE1  HIS  44           1HE      HIS  44 -12.862  -5.102   5.576
  582    H    SER  45           H        SER  45 -10.494   0.153   2.873
  583    HA   SER  45           HA       SER  45  -7.950   0.921   3.434
  584    HB2  SER  45           2HB      SER  45  -9.630   1.550   5.686
  585    HB3  SER  45           1HB      SER  45  -9.041   2.608   4.400
  586    HG   SER  45           HG       SER  45 -11.469   1.251   4.646
  587    H    ARG  46           H        ARG  46  -9.930  -1.175   5.540
  588    HA   ARG  46           HA       ARG  46  -7.920  -1.191   7.575
  589    HB2  ARG  46           2HB      ARG  46  -9.422  -2.368   8.898
  590    HB3  ARG  46           1HB      ARG  46 -10.475  -1.422   7.856
  591    HG2  ARG  46           2HG      ARG  46 -11.532  -3.316   7.392
  592    HG3  ARG  46           1HG      ARG  46 -10.106  -3.792   6.470
  593    HD2  ARG  46           2HD      ARG  46  -9.180  -4.923   8.384
  594    HD3  ARG  46           1HD      ARG  46 -10.482  -4.323   9.415
  595    HE   ARG  46           HE       ARG  46 -10.761  -6.351   7.296
  596   HH11  ARG  46          2HH1      ARG  46 -11.915  -4.814  10.226
  597   HH12  ARG  46          1HH1      ARG  46 -13.284  -5.884  10.391
  598   HH21  ARG  46          2HH2      ARG  46 -12.588  -7.736   7.487
  599   HH22  ARG  46          1HH2      ARG  46 -13.690  -7.498   8.817
  600    H    CYS  47           H        CYS  47  -8.360  -3.067   4.743
  601    HA   CYS  47           HA       CYS  47  -6.887  -5.306   5.929
  602    HB2  CYS  47           2HB      CYS  47  -8.838  -5.093   3.753
  603    HB3  CYS  47           1HB      CYS  47  -7.482  -6.168   3.427
  604    H    LEU  48           H        LEU  48  -6.664  -2.877   3.394
  605    HA   LEU  48           HA       LEU  48  -4.239  -3.974   2.327
  606    HB2  LEU  48           2HB      LEU  48  -6.029  -1.834   1.665
  607    HB3  LEU  48           1HB      LEU  48  -4.390  -1.218   1.714
  608    HG   LEU  48           HG       LEU  48  -5.598  -3.231  -0.126
  609   HD11  LEU  48          1HD1      LEU  48  -4.087  -1.928  -1.711
  610   HD12  LEU  48          2HD1      LEU  48  -5.487  -1.089  -1.039
  611   HD13  LEU  48          3HD1      LEU  48  -3.879  -0.790  -0.378
  612   HD21  LEU  48          3HD2      LEU  48  -3.756  -4.468  -0.431
  613   HD22  LEU  48          1HD2      LEU  48  -2.678  -3.084  -0.245
  614   HD23  LEU  48          2HD2      LEU  48  -3.303  -3.912   1.181
  615    H    LYS  49           H        LYS  49  -3.380  -4.227   4.537
  616    HA   LYS  49           HA       LYS  49  -1.854  -1.850   5.326
  617    HB2  LYS  49           2HB      LYS  49  -2.121  -3.108   7.706
  618    HB3  LYS  49           1HB      LYS  49  -3.168  -1.801   7.175
  619    HG2  LYS  49           2HG      LYS  49  -4.716  -3.325   7.855
  620    HG3  LYS  49           1HG      LYS  49  -4.574  -3.766   6.154
  621    HD2  LYS  49           2HD      LYS  49  -3.343  -5.685   6.630
  622    HD3  LYS  49           1HD      LYS  49  -2.852  -5.093   8.216
  623    HE2  LYS  49           2HE      LYS  49  -4.443  -6.551   8.909
  624    HE3  LYS  49           1HE      LYS  49  -5.492  -5.168   8.602
  625    HZ1  LYS  49           3HZ      LYS  49  -4.968  -7.045   6.403
  626    HZ2  LYS  49           1HZ      LYS  49  -6.349  -6.120   6.728
  627    HZ3  LYS  49           2HZ      LYS  49  -6.040  -7.518   7.627
  628    H    CYS  50           H        CYS  50   0.057  -2.364   6.548
  629    HA   CYS  50           HA       CYS  50   1.626  -4.427   5.485
  630    HB2  CYS  50           2HB      CYS  50   2.421  -2.282   6.480
  631    HB3  CYS  50           1HB      CYS  50   1.984  -2.893   8.066
  632    H    SER  51           H        SER  51   1.861  -6.503   6.055
  633    HA   SER  51           HA       SER  51   0.248  -7.642   8.130
  634    HB2  SER  51           2HB      SER  51   2.511  -8.934   6.587
  635    HB3  SER  51           1HB      SER  51   1.224  -9.761   7.463
  636    HG   SER  51           HG       SER  51  -0.039  -8.201   5.830
  637    H    SER  52           H        SER  52   3.155  -6.001   8.166
  638    HA   SER  52           HA       SER  52   4.227  -7.576  10.386
  639    HB2  SER  52           2HB      SER  52   5.411  -5.945   8.247
  640    HB3  SER  52           1HB      SER  52   6.170  -5.751   9.831
  641    HG   SER  52           HG       SER  52   6.347  -8.064   9.901
  642    H    CYS  53           H        CYS  53   3.607  -4.106   9.582
  643    HA   CYS  53           HA       CYS  53   3.578  -3.666  12.499
  644    HB2  CYS  53           2HB      CYS  53   4.236  -1.372  12.137
  645    HB3  CYS  53           1HB      CYS  53   5.368  -2.435  11.311
  646    H    GLN  54           H        GLN  54   1.570  -4.062   9.994
  647    HA   GLN  54           HA       GLN  54  -0.644  -3.801   9.702
  648    HB2  GLN  54           2HB      GLN  54  -0.283  -3.569  12.515
  649    HB3  GLN  54           1HB      GLN  54  -1.498  -2.397  12.021
  650    HG2  GLN  54           2HG      GLN  54  -1.859  -5.009  10.793
  651    HG3  GLN  54           1HG      GLN  54  -1.932  -5.045  12.553
  652   HE21  GLN  54          1HE2      GLN  54  -3.079  -2.973   9.911
  653   HE22  GLN  54          2HE2      GLN  54  -4.692  -2.797  10.521
  654    H    ALA  55           H        ALA  55   1.364  -1.551   9.209
  655    HA   ALA  55           HA       ALA  55  -0.036   0.894   9.406
  656    HB1  ALA  55           1HB      ALA  55   2.130  -0.015   7.525
  657    HB2  ALA  55           2HB      ALA  55   1.500   1.632   7.566
  658    HB3  ALA  55           3HB      ALA  55   2.304   0.958   8.985
  659    H    GLN  56           H        GLN  56  -1.886   1.434   8.440
  660    HA   GLN  56           HA       GLN  56  -2.983  -0.159   6.318
  661    HB2  GLN  56           2HB      GLN  56  -3.900   2.231   7.879
  662    HB3  GLN  56           1HB      GLN  56  -4.743   1.787   6.402
  663    HG2  GLN  56           2HG      GLN  56  -5.147  -0.459   7.335
  664    HG3  GLN  56           1HG      GLN  56  -4.368   0.050   8.832
  665   HE21  GLN  56          1HE2      GLN  56  -6.530  -0.687   9.636
  666   HE22  GLN  56          2HE2      GLN  56  -7.791   0.502   9.709
  667    H    LEU  57           H        LEU  57  -1.511   0.087   4.617
  668    HA   LEU  57           HA       LEU  57  -0.709   2.662   3.657
  669    HB2  LEU  57           2HB      LEU  57  -0.514   0.075   2.132
  670    HB3  LEU  57           1HB      LEU  57   0.503   1.496   1.990
  671    HG   LEU  57           HG       LEU  57   0.624   0.441   4.674
  672   HD11  LEU  57          1HD1      LEU  57   0.296  -1.561   2.754
  673   HD12  LEU  57          2HD1      LEU  57   2.027  -1.500   3.080
  674   HD13  LEU  57          3HD1      LEU  57   0.889  -1.746   4.404
  675   HD21  LEU  57          3HD2      LEU  57   2.854   0.415   2.689
  676   HD22  LEU  57          1HD2      LEU  57   2.211   1.947   3.280
  677   HD23  LEU  57          2HD2      LEU  57   2.890   0.778   4.414
  678    H    GLY  58           H        GLY  58  -3.352   0.523   3.026
  679    HA2  GLY  58           1HA      GLY  58  -4.082   1.550   0.472
  680    HA3  GLY  58           2HA      GLY  58  -5.129   0.662   1.573
  681    H    ASP  59           H        ASP  59  -4.240   2.848   3.596
  682    HA   ASP  59           HA       ASP  59  -6.376   4.700   2.874
  683    HB2  ASP  59           2HB      ASP  59  -6.199   3.473   5.152
  684    HB3  ASP  59           1HB      ASP  59  -4.952   4.658   5.521
  685    H    ILE  60           H        ILE  60  -3.338   4.501   2.165
  686    HA   ILE  60           HA       ILE  60  -2.775   7.354   2.566
  687    HB   ILE  60           HB       ILE  60  -0.664   5.275   2.060
  688   HG12  ILE  60          2HG1      ILE  60  -1.326   6.453   4.757
  689   HG13  ILE  60          1HG1      ILE  60  -1.973   4.909   4.219
  690   HG21  ILE  60          1HG2      ILE  60  -0.637   8.153   2.921
  691   HG22  ILE  60          2HG2      ILE  60   0.758   7.093   3.132
  692   HG23  ILE  60          3HG2      ILE  60   0.132   7.418   1.513
  693   HD11  ILE  60          3HD1      ILE  60   0.642   5.560   5.281
  694   HD12  ILE  60          1HD1      ILE  60  -0.168   4.001   5.135
  695   HD13  ILE  60          2HD1      ILE  60   0.733   4.658   3.767
  696    H    GLY  61           H        GLY  61  -1.899   4.694   0.427
  697    HA2  GLY  61           1HA      GLY  61  -2.778   4.796  -1.880
  698    HA3  GLY  61           2HA      GLY  61  -2.392   6.510  -1.853
  699    H    THR  62           H        THR  62   0.182   5.714  -0.368
  700    HA   THR  62           HA       THR  62   1.824   5.619  -2.684
  701    HB   THR  62           HB       THR  62   3.160   4.886  -0.194
  702    HG1  THR  62           1HG      THR  62   2.226   7.498  -0.050
  703   HG21  THR  62          3HG2      THR  62   4.738   5.934  -1.374
  704   HG22  THR  62          1HG2      THR  62   3.899   7.453  -1.061
  705   HG23  THR  62          2HG2      THR  62   3.546   6.536  -2.525
  706    H    SER  63           H        SER  63   3.118   3.968  -3.457
  707    HA   SER  63           HA       SER  63   1.942   1.427  -3.444
  708    HB2  SER  63           2HB      SER  63   4.763   1.689  -4.333
  709    HB3  SER  63           1HB      SER  63   3.377   0.966  -5.155
  710    HG   SER  63           HG       SER  63   2.916   2.829  -6.050
  711    H    SER  64           H        SER  64   2.003  -0.041  -1.895
  712    HA   SER  64           HA       SER  64   4.195  -0.285  -0.052
  713    HB2  SER  64           2HB      SER  64   2.578  -2.577   0.104
  714    HB3  SER  64           1HB      SER  64   2.485  -1.144   1.131
  715    HG   SER  64           HG       SER  64   0.796  -1.992  -0.843
  716    H    TYR  65           H        TYR  65   4.838  -2.820   0.254
  717    HA   TYR  65           HA       TYR  65   5.744  -3.738  -2.398
  718    HB2  TYR  65           2HB      TYR  65   7.353  -3.620   0.163
  719    HB3  TYR  65           1HB      TYR  65   7.889  -4.412  -1.316
  720    HD1  TYR  65           1HD      TYR  65   7.123  -1.164   0.240
  721    HD2  TYR  65           2HD      TYR  65   8.716  -3.141  -3.169
  722    HE1  TYR  65           1HE      TYR  65   8.039   0.971  -0.561
  723    HE2  TYR  65           2HE      TYR  65   9.636  -1.012  -3.979
  724    HH   TYR  65           HH       TYR  65   9.681   1.841  -2.016
  725    H    THR  66           H        THR  66   6.523  -6.053  -2.324
  726    HA   THR  66           HA       THR  66   5.408  -7.723  -0.269
  727    HB   THR  66           HB       THR  66   3.437  -7.159  -1.746
  728    HG1  THR  66           1HG      THR  66   3.326  -9.027  -0.530
  729   HG21  THR  66          3HG2      THR  66   4.038  -9.070  -3.810
  730   HG22  THR  66          1HG2      THR  66   5.250  -7.787  -3.797
  731   HG23  THR  66          2HG2      THR  66   3.541  -7.384  -3.961
  732    H    LYS  67           H        LYS  67   5.582 -10.101  -1.050
  733    HA   LYS  67           HA       LYS  67   7.466 -10.760  -3.066
  734    HB2  LYS  67           2HB      LYS  67   8.750  -9.829  -0.876
  735    HB3  LYS  67           1HB      LYS  67   8.575 -11.518  -0.420
  736    HG2  LYS  67           2HG      LYS  67   9.655 -12.162  -2.557
  737    HG3  LYS  67           1HG      LYS  67   9.920 -10.450  -2.893
  738    HD2  LYS  67           2HD      LYS  67  11.221 -10.279  -0.792
  739    HD3  LYS  67           1HD      LYS  67  11.022 -12.019  -0.565
  740    HE2  LYS  67           2HE      LYS  67  12.952 -12.202  -1.684
  741    HE3  LYS  67           1HE      LYS  67  11.985 -11.877  -3.122
  742    HZ1  LYS  67           3HZ      LYS  67  12.495  -9.399  -2.254
  743    HZ2  LYS  67           1HZ      LYS  67  13.449 -10.216  -3.392
  744    HZ3  LYS  67           2HZ      LYS  67  13.910 -10.193  -1.765
  745    H    SER  68           H        SER  68   6.696 -12.011   0.178
  746    HA   SER  68           HA       SER  68   6.000 -14.583  -1.010
  747    HB2  SER  68           2HB      SER  68   5.971 -14.125   1.942
  748    HB3  SER  68           1HB      SER  68   6.510 -15.537   1.026
  749    HG   SER  68           HG       SER  68   8.361 -14.376   0.424
  750    H    GLY  69           H        GLY  69   4.148 -12.582  -1.559
  751    HA2  GLY  69           1HA      GLY  69   1.839 -12.544  -1.708
  752    HA3  GLY  69           2HA      GLY  69   1.776 -13.833  -0.517
  753    H    MET  70           H        MET  70   3.481 -12.123   1.312
  754    HA   MET  70           HA       MET  70   1.265 -10.872   2.643
  755    HB2  MET  70           2HB      MET  70   4.108 -10.484   3.517
  756    HB3  MET  70           1HB      MET  70   2.652 -10.627   4.492
  757    HG2  MET  70           2HG      MET  70   2.527 -13.017   3.933
  758    HG3  MET  70           1HG      MET  70   4.022 -12.858   3.010
  759    HE1  MET  70           3HE      MET  70   6.753 -12.454   5.015
  760    HE2  MET  70           1HE      MET  70   6.308 -14.161   4.991
  761    HE3  MET  70           2HE      MET  70   5.971 -13.141   3.592
  762    H    ILE  71           H        ILE  71   0.867  -8.729   2.921
  763    HA   ILE  71           HA       ILE  71   2.239  -6.889   1.126
  764    HB   ILE  71           HB       ILE  71   0.086  -5.942   2.952
  765   HG12  ILE  71          2HG1      ILE  71  -1.354  -6.816   0.767
  766   HG13  ILE  71          1HG1      ILE  71  -0.251  -8.157   1.061
  767   HG21  ILE  71          1HG2      ILE  71   0.372  -5.459   0.008
  768   HG22  ILE  71          2HG2      ILE  71  -0.418  -4.458   1.225
  769   HG23  ILE  71          3HG2      ILE  71   1.341  -4.583   1.193
  770   HD11  ILE  71          3HD1      ILE  71  -1.925  -8.799   2.430
  771   HD12  ILE  71          1HD1      ILE  71  -1.072  -7.745   3.559
  772   HD13  ILE  71          2HD1      ILE  71  -2.491  -7.150   2.695
  773    H    LEU  72           H        LEU  72   3.813  -5.586   1.810
  774    HA   LEU  72           HA       LEU  72   3.985  -5.017   4.690
  775    HB2  LEU  72           2HB      LEU  72   6.065  -6.135   2.855
  776    HB3  LEU  72           1HB      LEU  72   6.565  -5.088   4.170
  777    HG   LEU  72           HG       LEU  72   5.098  -6.762   5.612
  778   HD11  LEU  72          1HD1      LEU  72   5.069  -8.981   4.832
  779   HD12  LEU  72          2HD1      LEU  72   4.422  -8.004   3.518
  780   HD13  LEU  72          3HD1      LEU  72   6.083  -8.594   3.443
  781   HD21  LEU  72          3HD2      LEU  72   7.209  -6.783   6.389
  782   HD22  LEU  72          1HD2      LEU  72   7.352  -8.270   5.449
  783   HD23  LEU  72          2HD2      LEU  72   7.911  -6.741   4.772
  784    H    CYS  73           H        CYS  73   4.900  -3.029   5.246
  785    HA   CYS  73           HA       CYS  73   4.535  -0.969   3.326
  786    HB2  CYS  73           2HB      CYS  73   5.211   0.561   5.086
  787    HB3  CYS  73           1HB      CYS  73   4.103  -0.640   5.738
  788    H    ARG  74           H        ARG  74   6.285   0.749   3.094
  789    HA   ARG  74           HA       ARG  74   8.423  -0.352   1.629
  790    HB2  ARG  74           2HB      ARG  74   9.256   2.194   2.062
  791    HB3  ARG  74           1HB      ARG  74   8.099   1.731   0.826
  792    HG2  ARG  74           2HG      ARG  74   6.713   2.148   3.281
  793    HG3  ARG  74           1HG      ARG  74   7.746   3.539   2.948
  794    HD2  ARG  74           2HD      ARG  74   6.746   3.321   0.539
  795    HD3  ARG  74           1HD      ARG  74   5.462   2.442   1.371
  796    HE   ARG  74           HE       ARG  74   4.974   4.417   2.624
  797   HH11  ARG  74          2HH1      ARG  74   7.172   4.850  -0.066
  798   HH12  ARG  74          1HH1      ARG  74   7.011   6.580  -0.099
  799   HH21  ARG  74          2HH2      ARG  74   4.727   6.685   2.575
  800   HH22  ARG  74          1HH2      ARG  74   5.618   7.634   1.418
  801    H    ASN  75           H        ASN  75   8.076   0.638   4.917
  802    HA   ASN  75           HA       ASN  75  10.887   0.748   5.505
  803    HB2  ASN  75           2HB      ASN  75   8.838   1.903   6.709
  804    HB3  ASN  75           1HB      ASN  75   8.797   0.397   7.620
  805   HD21  ASN  75          1HD2      ASN  75   9.879   0.444   9.439
  806   HD22  ASN  75          2HD2      ASN  75  11.293   1.406   9.764
  807    H    ASP  76           H        ASP  76   8.248  -1.530   6.025
  808    HA   ASP  76           HA       ASP  76   9.808  -3.271   7.661
  809    HB2  ASP  76           2HB      ASP  76   7.053  -3.090   6.775
  810    HB3  ASP  76           1HB      ASP  76   7.641  -4.750   6.780
  811    H    TYR  77           H        TYR  77   8.877  -3.256   4.254
  812    HA   TYR  77           HA       TYR  77   9.532  -5.914   3.707
  813    HB2  TYR  77           2HB      TYR  77   8.306  -4.637   2.065
  814    HB3  TYR  77           1HB      TYR  77   9.656  -3.520   1.864
  815    HD1  TYR  77           1HD      TYR  77   9.069  -7.210   1.748
  816    HD2  TYR  77           2HD      TYR  77  10.966  -3.835  -0.004
  817    HE1  TYR  77           1HE      TYR  77  10.044  -8.664   0.027
  818    HE2  TYR  77           2HE      TYR  77  11.940  -5.278  -1.740
  819    HH   TYR  77           HH       TYR  77  12.583  -7.702  -1.939
  820    H    ILE  78           H        ILE  78  11.587  -3.013   3.646
  821    HA   ILE  78           HA       ILE  78  13.876  -4.405   2.651
  822    HB   ILE  78           HB       ILE  78  13.996  -1.852   4.246
  823   HG12  ILE  78          2HG1      ILE  78  13.436  -2.091   1.281
  824   HG13  ILE  78          1HG1      ILE  78  12.220  -1.693   2.490
  825   HG21  ILE  78          1HG2      ILE  78  16.161  -2.233   3.797
  826   HG22  ILE  78          2HG2      ILE  78  15.799  -3.359   2.489
  827   HG23  ILE  78          3HG2      ILE  78  15.753  -1.622   2.195
  828   HD11  ILE  78          3HD1      ILE  78  14.504   0.046   2.713
  829   HD12  ILE  78          1HD1      ILE  78  13.836   0.073   1.082
  830   HD13  ILE  78          2HD1      ILE  78  12.804   0.444   2.464
  831    H    ARG  79           H        ARG  79  12.590  -3.721   5.820
  832    HA   ARG  79           HA       ARG  79  14.895  -4.532   7.290
  833    HB2  ARG  79           2HB      ARG  79  12.240  -3.544   7.848
  834    HB3  ARG  79           1HB      ARG  79  12.606  -4.913   8.885
  835    HG2  ARG  79           2HG      ARG  79  14.852  -3.606   9.274
  836    HG3  ARG  79           1HG      ARG  79  13.871  -2.226   8.772
  837    HD2  ARG  79           2HD      ARG  79  12.167  -3.032  10.486
  838    HD3  ARG  79           1HD      ARG  79  13.447  -4.077  11.101
  839    HE   ARG  79           HE       ARG  79  14.746  -1.951  11.431
  840   HH11  ARG  79          2HH1      ARG  79  11.244  -1.984  11.414
  841   HH12  ARG  79          1HH1      ARG  79  11.097  -0.573  12.423
  842   HH21  ARG  79          2HH2      ARG  79  14.560  -0.111  12.776
  843   HH22  ARG  79          1HH2      ARG  79  12.984   0.493  13.192
  844    H    LEU  80           H        LEU  80  11.982  -6.112   6.130
  845    HA   LEU  80           HA       LEU  80  12.497  -8.573   7.531
  846    HB2  LEU  80           2HB      LEU  80  10.273  -7.361   6.434
  847    HB3  LEU  80           1HB      LEU  80  10.585  -8.679   5.323
  848    HG   LEU  80           HG       LEU  80   8.961  -9.260   7.089
  849   HD11  LEU  80          1HD1      LEU  80  10.951 -11.109   7.945
  850   HD12  LEU  80          2HD1      LEU  80   9.641 -11.345   6.787
  851   HD13  LEU  80          3HD1      LEU  80  11.206 -10.742   6.239
  852   HD21  LEU  80          3HD2      LEU  80  10.575  -7.863   8.770
  853   HD22  LEU  80          1HD2      LEU  80   9.332  -9.003   9.287
  854   HD23  LEU  80          2HD2      LEU  80  11.012  -9.525   9.167
  855    H    PHE  81           H        PHE  81  12.242  -7.769   4.056
  856    HA   PHE  81           HA       PHE  81  13.743 -10.241   3.495
  857    HB2  PHE  81           2HB      PHE  81  11.708  -8.733   1.850
  858    HB3  PHE  81           1HB      PHE  81  12.705 -10.026   1.192
  859    HD1  PHE  81           1HD      PHE  81  12.350 -12.329   1.856
  860    HD2  PHE  81           2HD      PHE  81   9.904  -9.194   3.374
  861    HE1  PHE  81           1HE      PHE  81  10.699 -13.985   2.615
  862    HE2  PHE  81           2HE      PHE  81   8.251 -10.850   4.138
  863    HZ   PHE  81           HZ       PHE  81   8.650 -13.246   3.758
  864    H    GLY  82           H        GLY  82  13.112  -7.382   1.502
  865    HA2  GLY  82           1HA      GLY  82  14.668  -5.940   0.506
  866    HA3  GLY  82           2HA      GLY  82  15.969  -6.891   1.221
  Start of MODEL   19
    1    H    SER 641           1H       SER 641  33.828  20.063   1.446
    2    HA   SER 641           HA       SER 641  36.640  20.904   1.688
    3    HB2  SER 641           2HB      SER 641  35.966  18.009   1.694
    4    HB3  SER 641           1HB      SER 641  37.293  18.859   2.488
    5    HG   SER 641           HG       SER 641  36.011  18.332   4.147
    6    H    LEU 642           H        LEU 642  37.851  20.347  -0.145
    7    HA   LEU 642           HA       LEU 642  36.287  19.879  -2.551
    8    HB2  LEU 642           2HB      LEU 642  39.272  20.218  -2.395
    9    HB3  LEU 642           1HB      LEU 642  38.217  20.538  -3.758
   10    HG   LEU 642           HG       LEU 642  37.499  22.180  -1.482
   11   HD11  LEU 642          1HD1      LEU 642  39.924  21.891  -0.997
   12   HD12  LEU 642          2HD1      LEU 642  40.272  22.596  -2.575
   13   HD13  LEU 642          3HD1      LEU 642  39.445  23.553  -1.344
   14   HD21  LEU 642          3HD2      LEU 642  37.431  23.880  -3.094
   15   HD22  LEU 642          1HD2      LEU 642  38.581  23.051  -4.142
   16   HD23  LEU 642          2HD2      LEU 642  36.945  22.419  -3.956
   17    H    GLN 643           H        GLN 643  38.498  18.277  -0.445
   18    HA   GLN 643           HA       GLN 643  38.887  15.981  -2.146
   19    HB2  GLN 643           2HB      GLN 643  39.423  16.126   0.820
   20    HB3  GLN 643           1HB      GLN 643  40.196  15.091  -0.373
   21    HG2  GLN 643           2HG      GLN 643  41.848  16.594  -0.221
   22    HG3  GLN 643           1HG      GLN 643  40.852  17.505  -1.355
   23   HE21  GLN 643          1HE2      GLN 643  42.660  17.869   1.254
   24   HE22  GLN 643          2HE2      GLN 643  41.847  19.190   2.036
   25    H    ASN 644           H        ASN 644  36.754  15.355  -2.572
   26    HA   ASN 644           HA       ASN 644  34.834  14.895  -0.539
   27    HB2  ASN 644           2HB      ASN 644  34.713  15.090  -3.266
   28    HB3  ASN 644           1HB      ASN 644  34.496  13.358  -3.027
   29   HD21  ASN 644          1HD2      ASN 644  32.373  13.819  -3.935
   30   HD22  ASN 644          2HD2      ASN 644  31.117  14.352  -2.867
   31    H    ASN 645           H        ASN 645  35.763  13.603   1.011
   32    HA   ASN 645           HA       ASN 645  36.911  11.061   0.482
   33    HB2  ASN 645           2HB      ASN 645  37.158  12.511   2.597
   34    HB3  ASN 645           1HB      ASN 645  35.598  11.849   3.080
   35   HD21  ASN 645          1HD2      ASN 645  38.833  10.869   2.006
   36   HD22  ASN 645          2HD2      ASN 645  38.894   9.432   2.976
   37    H    GLN 646           H        GLN 646  36.002   9.077   0.372
   38    HA   GLN 646           HA       GLN 646  34.437   7.481   0.010
   39    HB2  GLN 646           2HB      GLN 646  33.284   9.060   2.128
   40    HB3  GLN 646           1HB      GLN 646  32.017   8.519   1.034
   41    HG2  GLN 646           2HG      GLN 646  32.149   6.850   2.643
   42    HG3  GLN 646           1HG      GLN 646  33.048   6.199   1.273
   43   HE21  GLN 646          1HE2      GLN 646  33.120   6.978   4.549
   44   HE22  GLN 646          2HE2      GLN 646  34.804   6.692   4.837
   45    H    ASP 647           H        ASP 647  34.752   8.205  -2.173
   46    HA   ASP 647           HA       ASP 647  32.994  10.078  -3.405
   47    HB2  ASP 647           2HB      ASP 647  35.286   9.454  -4.235
   48    HB3  ASP 647           1HB      ASP 647  34.610   7.916  -4.765
   49    H    VAL 648           H        VAL 648  31.032   9.152  -2.493
   50    HA   VAL 648           HA       VAL 648  29.701   7.527  -4.480
   51    HB   VAL 648           HB       VAL 648  30.570   5.824  -2.913
   52   HG11  VAL 648          1HG1      VAL 648  29.569   7.686  -0.929
   53   HG12  VAL 648          2HG1      VAL 648  28.999   6.041  -0.650
   54   HG13  VAL 648          3HG1      VAL 648  30.731   6.369  -0.763
   55   HG21  VAL 648          3HG2      VAL 648  28.540   4.614  -2.602
   56   HG22  VAL 648          1HG2      VAL 648  27.585   6.095  -2.614
   57   HG23  VAL 648          2HG2      VAL 648  28.383   5.550  -4.090
   58    H    SER 649           H        SER 649  29.655   9.455  -1.562
   59    HA   SER 649           HA       SER 649  26.860  10.002  -1.593
   60    HB2  SER 649           2HB      SER 649  28.420  12.075  -0.332
   61    HB3  SER 649           1HB      SER 649  27.376  10.867   0.417
   62    HG   SER 649           HG       SER 649  30.084  10.954   0.288
   63    H    PHE 650           H        PHE 650  26.448  10.587  -3.754
   64    HA   PHE 650           HA       PHE 650  27.870  12.540  -5.188
   65    HB2  PHE 650           2HB      PHE 650  25.569  10.870  -5.594
   66    HB3  PHE 650           1HB      PHE 650  25.220  12.501  -6.157
   67    HD1  PHE 650           2HD      PHE 650  27.722   9.772  -6.432
   68    HD2  PHE 650           1HD      PHE 650  25.975  13.208  -8.238
   69    HE1  PHE 650           2HE      PHE 650  28.963   9.307  -8.508
   70    HE2  PHE 650           1HE      PHE 650  27.209  12.751 -10.314
   71    HZ   PHE 650           HZ       PHE 650  28.704  10.799 -10.451
   72    H    GLU 651           H        GLU 651  27.995  14.628  -4.815
   73    HA   GLU 651           HA       GLU 651  25.913  16.028  -3.339
   74    HB2  GLU 651           2HB      GLU 651  28.663  16.741  -4.315
   75    HB3  GLU 651           1HB      GLU 651  27.547  17.998  -3.799
   76    HG2  GLU 651           2HG      GLU 651  27.820  15.771  -1.917
   77    HG3  GLU 651           1HG      GLU 651  29.294  16.704  -2.174
   78    H    ASN 652           H        ASN 652  26.778  15.326  -6.521
   79    HA   ASN 652           HA       ASN 652  25.883  17.675  -7.835
   80    HB2  ASN 652           2HB      ASN 652  27.333  16.363  -9.104
   81    HB3  ASN 652           1HB      ASN 652  26.502  14.869  -8.697
   82   HD21  ASN 652          1HD2      ASN 652  26.194  17.869 -10.525
   83   HD22  ASN 652          2HD2      ASN 652  25.179  17.210 -11.772
   84    H    ILE 653           H        ILE 653  24.278  14.710  -6.833
   85    HA   ILE 653           HA       ILE 653  21.731  15.932  -7.634
   86    HB   ILE 653           HB       ILE 653  20.952  13.471  -7.956
   87   HG12  ILE 653          2HG1      ILE 653  23.508  12.774  -9.141
   88   HG13  ILE 653          1HG1      ILE 653  23.652  13.000  -7.402
   89   HG21  ILE 653          1HG2      ILE 653  21.432  13.597 -10.334
   90   HG22  ILE 653          2HG2      ILE 653  20.983  15.181  -9.706
   91   HG23  ILE 653          3HG2      ILE 653  22.676  14.809 -10.033
   92   HD11  ILE 653          3HD1      ILE 653  23.199  10.679  -7.976
   93   HD12  ILE 653          1HD1      ILE 653  21.879  11.376  -7.035
   94   HD13  ILE 653          2HD1      ILE 653  21.704  11.163  -8.777
   95    H    GLN 654           H        GLN 654  20.155  15.867  -6.131
   96    HA   GLN 654           HA       GLN 654  20.501  14.063  -3.828
   97    HB2  GLN 654           2HB      GLN 654  20.167  17.026  -3.835
   98    HB3  GLN 654           1HB      GLN 654  19.377  16.111  -2.560
   99    HG2  GLN 654           2HG      GLN 654  22.317  16.091  -3.201
  100    HG3  GLN 654           1HG      GLN 654  21.550  16.911  -1.843
  101   HE21  GLN 654          1HE2      GLN 654  23.304  14.302  -2.625
  102   HE22  GLN 654          2HE2      GLN 654  22.802  13.212  -1.382
  103    H    TRP 655           H        TRP 655  18.947  13.454  -5.973
  104    HA   TRP 655           HA       TRP 655  16.236  14.326  -5.690
  105    HB2  TRP 655           2HB      TRP 655  17.663  12.267  -7.331
  106    HB3  TRP 655           1HB      TRP 655  15.909  12.192  -7.203
  107    HD1  TRP 655           HD       TRP 655  18.529  14.937  -8.075
  108    HE1  TRP 655           1HE      TRP 655  17.592  16.322 -10.032
  109    HE3  TRP 655           3HE      TRP 655  14.019  12.592  -8.624
  110    HZ2  TRP 655           2HZ      TRP 655  15.238  16.402 -11.602
  111    HZ3  TRP 655           3HZ      TRP 655  12.482  13.385 -10.375
  112    HH2  TRP 655           HH       TRP 655  13.080  15.252 -11.832
  113    H    SER 656           H        SER 656  14.443  13.024  -5.039
  114    HA   SER 656           HA       SER 656  15.130  11.134  -2.916
  115    HB2  SER 656           2HB      SER 656  12.343  11.617  -2.959
  116    HB3  SER 656           1HB      SER 656  13.523  12.248  -1.810
  117    HG   SER 656           HG       SER 656  12.385  13.452  -4.069
  118    H    ILE 657           H        ILE 657  15.631   9.857  -5.118
  119    HA   ILE 657           HA       ILE 657  13.207   8.346  -5.821
  120    HB   ILE 657           HB       ILE 657  14.048   7.879  -7.958
  121   HG12  ILE 657          2HG1      ILE 657  16.388   7.343  -7.207
  122   HG13  ILE 657          1HG1      ILE 657  16.291   8.211  -8.732
  123   HG21  ILE 657          1HG2      ILE 657  13.268  10.203  -7.618
  124   HG22  ILE 657          2HG2      ILE 657  14.951  10.700  -7.448
  125   HG23  ILE 657          3HG2      ILE 657  14.384  10.011  -8.970
  126   HD11  ILE 657          3HD1      ILE 657  18.031   8.859  -6.885
  127   HD12  ILE 657          1HD1      ILE 657  17.248  10.093  -7.874
  128   HD13  ILE 657          2HD1      ILE 657  16.669   9.772  -6.238
  129    H    ASP 658           H        ASP 658  14.273   6.109  -6.924
  130    HA   ASP 658           HA       ASP 658  14.991   4.537  -4.685
  131    HB2  ASP 658           2HB      ASP 658  13.864   3.772  -6.856
  132    HB3  ASP 658           1HB      ASP 658  15.476   3.757  -7.561
  133    HA   PRO 659           HA       PRO 659  19.299   5.660  -4.523
  134    HB2  PRO 659           2HB      PRO 659  19.516   3.349  -2.710
  135    HB3  PRO 659           1HB      PRO 659  19.849   5.054  -2.398
  136    HG2  PRO 659           2HG      PRO 659  17.703   3.835  -1.350
  137    HG3  PRO 659           1HG      PRO 659  17.646   5.527  -1.878
  138    HD2  PRO 659           2HD      PRO 659  16.632   3.074  -3.265
  139    HD3  PRO 659           1HD      PRO 659  15.879   4.676  -3.114
  140    H    GLY 660           H        GLY 660  18.003   2.661  -5.573
  141    HA2  GLY 660           1HA      GLY 660  19.262   1.752  -7.537
  142    HA3  GLY 660           2HA      GLY 660  20.684   1.828  -6.505
  143    H    ALA 661           H        ALA 661  17.624   0.914  -5.169
  144    HA   ALA 661           HA       ALA 661  18.686  -1.746  -4.601
  145    HB1  ALA 661           1HB      ALA 661  17.386  -1.746  -2.768
  146    HB2  ALA 661           2HB      ALA 661  17.271  -0.010  -3.058
  147    HB3  ALA 661           3HB      ALA 661  15.996  -1.088  -3.630
  148    H    ASP 662           H        ASP 662  16.371  -0.122  -6.558
  149    HA   ASP 662           HA       ASP 662  15.018  -0.768  -8.256
  150    HB2  ASP 662           2HB      ASP 662  17.260  -2.285  -8.587
  151    HB3  ASP 662           1HB      ASP 662  16.024  -3.533  -8.460
  152    H    LEU 663           H        LEU 663  13.467  -0.721  -6.380
  153    HA   LEU 663           HA       LEU 663  12.407  -3.385  -5.764
  154    HB2  LEU 663           2HB      LEU 663  11.630  -0.781  -4.469
  155    HB3  LEU 663           1HB      LEU 663  11.307  -2.402  -3.887
  156    HG   LEU 663           HG       LEU 663  14.060  -1.179  -4.081
  157   HD11  LEU 663          1HD1      LEU 663  12.729  -0.001  -2.433
  158   HD12  LEU 663          2HD1      LEU 663  12.245  -1.531  -1.702
  159   HD13  LEU 663          3HD1      LEU 663  13.931  -1.017  -1.635
  160   HD21  LEU 663          3HD2      LEU 663  14.737  -3.075  -2.705
  161   HD22  LEU 663          1HD2      LEU 663  13.091  -3.704  -2.751
  162   HD23  LEU 663          2HD2      LEU 663  14.043  -3.617  -4.233
  163    H    SER 664           H        SER 664  12.035  -1.584  -8.219
  164    HA   SER 664           HA       SER 664   9.382  -0.654  -8.272
  165    HB2  SER 664           2HB      SER 664  10.381  -1.451 -10.872
  166    HB3  SER 664           1HB      SER 664  10.058   0.165 -10.243
  167    HG   SER 664           HG       SER 664  12.411  -0.953 -10.679
  168    H    GLN 665           H        GLN 665  10.781  -3.795  -8.895
  169    HA   GLN 665           HA       GLN 665   8.499  -4.905 -10.206
  170    HB2  GLN 665           2HB      GLN 665  10.750  -6.300  -8.746
  171    HB3  GLN 665           1HB      GLN 665   9.612  -7.066  -9.844
  172    HG2  GLN 665           2HG      GLN 665  11.389  -6.786 -11.231
  173    HG3  GLN 665           1HG      GLN 665  10.529  -5.276 -11.528
  174   HE21  GLN 665          1HE2      GLN 665  13.115  -5.347 -12.161
  175   HE22  GLN 665          2HE2      GLN 665  14.056  -4.414 -11.039
  176    H    TYR 666           H        TYR 666   9.458  -4.446  -6.904
  177    HA   TYR 666           HA       TYR 666   7.418  -6.282  -5.911
  178    HB2  TYR 666           2HB      TYR 666   9.129  -4.566  -4.144
  179    HB3  TYR 666           1HB      TYR 666   8.456  -6.160  -3.827
  180    HD1  TYR 666           1HD      TYR 666   9.407  -8.103  -5.300
  181    HD2  TYR 666           2HD      TYR 666  11.354  -4.374  -4.723
  182    HE1  TYR 666           1HE      TYR 666  11.549  -9.134  -5.929
  183    HE2  TYR 666           2HE      TYR 666  13.502  -5.388  -5.352
  184    HH   TYR 666           HH       TYR 666  14.461  -7.846  -5.259
  185    H    LYS 667           H        LYS 667   7.712  -3.067  -6.788
  186    HA   LYS 667           HA       LYS 667   6.095  -1.785  -4.860
  187    HB2  LYS 667           2HB      LYS 667   7.259  -1.122  -7.446
  188    HB3  LYS 667           1HB      LYS 667   5.644  -0.452  -7.255
  189    HG2  LYS 667           2HG      LYS 667   6.315   1.063  -5.763
  190    HG3  LYS 667           1HG      LYS 667   7.374  -0.079  -4.931
  191    HD2  LYS 667           2HD      LYS 667   9.076   0.212  -6.639
  192    HD3  LYS 667           1HD      LYS 667   8.004   1.279  -7.553
  193    HE2  LYS 667           2HE      LYS 667   8.133   2.973  -5.926
  194    HE3  LYS 667           1HE      LYS 667   8.822   1.880  -4.728
  195    HZ1  LYS 667           3HZ      LYS 667  10.795   2.639  -5.365
  196    HZ2  LYS 667           1HZ      LYS 667  10.146   3.451  -6.707
  197    HZ3  LYS 667           2HZ      LYS 667  10.585   1.819  -6.832
  198    H    MET 668           H        MET 668   4.014  -2.053  -4.478
  199    HA   MET 668           HA       MET 668   2.381  -3.422  -6.465
  200    HB2  MET 668           2HB      MET 668   0.660  -3.529  -4.671
  201    HB3  MET 668           1HB      MET 668   2.172  -4.315  -4.247
  202    HG2  MET 668           2HG      MET 668   2.806  -2.373  -2.911
  203    HG3  MET 668           1HG      MET 668   1.293  -1.582  -3.341
  204    HE1  MET 668           3HE      MET 668   2.410  -5.011  -2.618
  205    HE2  MET 668           1HE      MET 668   2.421  -4.978  -0.856
  206    HE3  MET 668           2HE      MET 668   1.068  -5.711  -1.716
  207    H    ASP 669           H        ASP 669   1.119  -2.383  -7.811
  208    HA   ASP 669           HA       ASP 669   0.725   0.457  -7.567
  209    HB2  ASP 669           2HB      ASP 669   0.996  -0.424  -9.792
  210    HB3  ASP 669           1HB      ASP 669  -0.324  -1.566  -9.554
  211    H    VAL 670           H        VAL 670  -0.724   1.285  -6.235
  212    HA   VAL 670           HA       VAL 670  -3.038  -0.250  -5.419
  213    HB   VAL 670           HB       VAL 670  -2.481   2.639  -4.740
  214   HG11  VAL 670          1HG1      VAL 670  -3.718   0.811  -2.798
  215   HG12  VAL 670          2HG1      VAL 670  -4.134   2.473  -3.221
  216   HG13  VAL 670          3HG1      VAL 670  -4.674   1.138  -4.242
  217   HG21  VAL 670          3HG2      VAL 670  -0.786   0.510  -4.144
  218   HG22  VAL 670          1HG2      VAL 670  -0.808   2.095  -3.370
  219   HG23  VAL 670          2HG2      VAL 670  -1.729   0.760  -2.676
  220    H    THR 671           H        THR 671  -4.324  -0.470  -7.183
  221    HA   THR 671           HA       THR 671  -5.154   1.856  -8.702
  222    HB   THR 671           HB       THR 671  -6.515  -0.757  -9.101
  223    HG1  THR 671           1HG      THR 671  -3.741  -0.347  -9.729
  224   HG21  THR 671          3HG2      THR 671  -5.861   1.625 -10.594
  225   HG22  THR 671          1HG2      THR 671  -7.014   0.348 -10.977
  226   HG23  THR 671          2HG2      THR 671  -5.324   0.183 -11.455
  227    H    VAL 672           H        VAL 672  -6.577   3.140  -7.752
  228    HA   VAL 672           HA       VAL 672  -8.431   2.094  -5.782
  229    HB   VAL 672           HB       VAL 672  -8.475   4.952  -6.669
  230   HG11  VAL 672          1HG1      VAL 672  -8.960   5.333  -4.314
  231   HG12  VAL 672          2HG1      VAL 672 -10.072   4.148  -5.000
  232   HG13  VAL 672          3HG1      VAL 672  -8.737   3.616  -3.978
  233   HG21  VAL 672          3HG2      VAL 672  -6.451   3.954  -4.682
  234   HG22  VAL 672          1HG2      VAL 672  -6.067   4.158  -6.392
  235   HG23  VAL 672          2HG2      VAL 672  -6.570   5.548  -5.428
  236    H    ILE 673           H        ILE 673 -10.314   1.306  -6.369
  237    HA   ILE 673           HA       ILE 673 -11.492   1.987  -8.928
  238    HB   ILE 673           HB       ILE 673 -12.144  -0.013  -6.786
  239   HG12  ILE 673          2HG1      ILE 673 -12.253  -1.144  -9.340
  240   HG13  ILE 673          1HG1      ILE 673 -10.914  -0.002  -9.408
  241   HG21  ILE 673          1HG2      ILE 673 -14.214   1.262  -7.785
  242   HG22  ILE 673          2HG2      ILE 673 -13.924   0.201  -9.166
  243   HG23  ILE 673          3HG2      ILE 673 -14.242  -0.491  -7.575
  244   HD11  ILE 673          3HD1      ILE 673 -10.601  -1.356  -6.994
  245   HD12  ILE 673          1HD1      ILE 673 -11.057  -2.587  -8.171
  246   HD13  ILE 673          2HD1      ILE 673  -9.656  -1.557  -8.469
  247    H    ASP 674           H        ASP 674 -12.881   3.600  -9.192
  248    HA   ASP 674           HA       ASP 674 -14.069   4.984  -6.981
  249    HB2  ASP 674           2HB      ASP 674 -13.472   5.791  -9.455
  250    HB3  ASP 674           1HB      ASP 674 -15.138   5.307  -9.750
  251    H    THR 675           H        THR 675 -15.389   3.661  -5.821
  252    HA   THR 675           HA       THR 675 -16.969   1.602  -6.753
  253    HB   THR 675           HB       THR 675 -18.064   3.052  -4.439
  254    HG1  THR 675           1HG      THR 675 -16.112   2.380  -3.207
  255   HG21  THR 675          3HG2      THR 675 -17.720   0.361  -5.375
  256   HG22  THR 675          1HG2      THR 675 -18.717   0.957  -4.049
  257   HG23  THR 675          2HG2      THR 675 -17.034   0.522  -3.760
  258    H    LYS 676           H        LYS 676 -18.886   1.417  -7.688
  259    HA   LYS 676           HA       LYS 676 -20.425   3.866  -8.222
  260    HB2  LYS 676           2HB      LYS 676 -19.526   1.974  -9.960
  261    HB3  LYS 676           1HB      LYS 676 -21.140   1.364  -9.618
  262    HG2  LYS 676           2HG      LYS 676 -21.874   2.756 -11.176
  263    HG3  LYS 676           1HG      LYS 676 -21.521   4.063 -10.043
  264    HD2  LYS 676           2HD      LYS 676 -19.104   3.850 -11.016
  265    HD3  LYS 676           1HD      LYS 676 -19.929   3.081 -12.371
  266    HE2  LYS 676           2HE      LYS 676 -21.489   5.190 -12.188
  267    HE3  LYS 676           1HE      LYS 676 -20.078   5.890 -11.398
  268    HZ1  LYS 676           3HZ      LYS 676 -20.487   5.872 -14.047
  269    HZ2  LYS 676           1HZ      LYS 676 -19.508   4.495 -13.867
  270    HZ3  LYS 676           2HZ      LYS 676 -18.963   6.007 -13.318
  271    H    ASP 677           H        ASP 677 -20.465   0.809  -6.697
  272    HA   ASP 677           HA       ASP 677 -23.218   0.384  -6.385
  273    HB2  ASP 677           2HB      ASP 677 -20.881  -0.959  -5.662
  274    HB3  ASP 677           1HB      ASP 677 -21.652  -0.566  -4.128
  275    H    GLY 678           H        GLY 678 -24.493   1.840  -5.561
  276    HA2  GLY 678           1HA      GLY 678 -25.349   2.564  -3.351
  277    HA3  GLY 678           2HA      GLY 678 -23.713   3.125  -3.025
  278    H    SER 679           H        SER 679 -23.066   4.341  -5.392
  279    HA   SER 679           HA       SER 679 -24.518   6.804  -5.138
  280    HB2  SER 679           2HB      SER 679 -22.748   6.939  -7.333
  281    HB3  SER 679           1HB      SER 679 -22.480   7.551  -5.699
  282    HG   SER 679           HG       SER 679 -20.901   6.138  -5.764
  283    H    GLN 680           H        GLN 680 -23.953   4.441  -7.733
  284    HA   GLN 680           HA       GLN 680 -26.034   5.706  -9.343
  285    HB2  GLN 680           2HB      GLN 680 -23.739   3.973  -9.867
  286    HB3  GLN 680           1HB      GLN 680 -25.186   3.471 -10.730
  287    HG2  GLN 680           2HG      GLN 680 -23.998   4.929 -12.159
  288    HG3  GLN 680           1HG      GLN 680 -25.399   5.819 -11.566
  289   HE21  GLN 680          1HE2      GLN 680 -24.526   7.830 -11.858
  290   HE22  GLN 680          2HE2      GLN 680 -23.193   8.436 -10.921
  291    H    SER 681           H        SER 681 -27.002   4.679  -7.030
  292    HA   SER 681           HA       SER 681 -27.796   1.998  -7.025
  293    HB2  SER 681           2HB      SER 681 -29.784   3.380  -5.660
  294    HB3  SER 681           1HB      SER 681 -28.281   2.767  -4.966
  295    HG   SER 681           HG       SER 681 -27.539   4.739  -4.835
  296    H    LYS 682           H        LYS 682 -29.186   4.826  -8.510
  297    HA   LYS 682           HA       LYS 682 -31.773   3.831  -9.016
  298    HB2  LYS 682           2HB      LYS 682 -30.656   6.253  -9.206
  299    HB3  LYS 682           1HB      LYS 682 -30.558   5.787 -10.900
  300    HG2  LYS 682           2HG      LYS 682 -32.758   6.027 -11.222
  301    HG3  LYS 682           1HG      LYS 682 -33.169   5.297  -9.669
  302    HD2  LYS 682           2HD      LYS 682 -33.667   7.342  -8.931
  303    HD3  LYS 682           1HD      LYS 682 -31.948   7.729  -9.036
  304    HE2  LYS 682           2HE      LYS 682 -32.764   9.378 -10.370
  305    HE3  LYS 682           1HE      LYS 682 -32.578   8.112 -11.579
  306    HZ1  LYS 682           3HZ      LYS 682 -35.125   8.218 -10.167
  307    HZ2  LYS 682           1HZ      LYS 682 -34.797   7.849 -11.789
  308    HZ3  LYS 682           2HZ      LYS 682 -34.812   9.465 -11.275
  309    H    LEU 683           H        LEU 683 -28.753   3.487 -10.760
  310    HA   LEU 683           HA       LEU 683 -30.194   2.277 -13.016
  311    HB2  LEU 683           2HB      LEU 683 -27.437   3.456 -12.777
  312    HB3  LEU 683           1HB      LEU 683 -27.932   2.501 -14.162
  313    HG   LEU 683           HG       LEU 683 -29.910   4.499 -13.753
  314   HD11  LEU 683          1HD1      LEU 683 -27.639   6.123 -14.383
  315   HD12  LEU 683          2HD1      LEU 683 -28.851   6.343 -13.122
  316   HD13  LEU 683          3HD1      LEU 683 -27.413   5.373 -12.803
  317   HD21  LEU 683          3HD2      LEU 683 -28.859   3.262 -15.841
  318   HD22  LEU 683          1HD2      LEU 683 -29.626   4.843 -15.990
  319   HD23  LEU 683          2HD2      LEU 683 -27.868   4.720 -15.899
  320    H    GLY 684           H        GLY 684 -28.189   1.529 -10.356
  321    HA2  GLY 684           1HA      GLY 684 -26.958  -0.809 -11.485
  322    HA3  GLY 684           2HA      GLY 684 -26.908  -0.311  -9.803
  323    H    GLY 685           H        GLY 685 -30.091  -0.392 -10.857
  324    HA2  GLY 685           1HA      GLY 685 -30.683  -2.696  -9.261
  325    HA3  GLY 685           2HA      GLY 685 -31.829  -1.767 -10.217
  326    H    GLY 901           H        GLY 901 -29.947  -4.602 -10.027
  327    HA2  GLY 901           1HA      GLY 901 -30.013  -5.270 -12.819
  328    HA3  GLY 901           2HA      GLY 901 -29.549  -6.333 -11.499
  329    H    GLY 902           H        GLY 902 -32.297  -4.972 -13.236
  330    HA2  GLY 902           1HA      GLY 902 -33.752  -7.057 -13.852
  331    HA3  GLY 902           2HA      GLY 902 -34.038  -7.040 -12.117
  332    H    SER 903           H        SER 903 -36.272  -6.696 -12.525
  333    HA   SER 903           HA       SER 903 -36.845  -3.864 -13.077
  334    HB2  SER 903           2HB      SER 903 -39.085  -5.555 -13.774
  335    HB3  SER 903           1HB      SER 903 -38.256  -4.348 -14.754
  336    HG   SER 903           HG       SER 903 -38.222  -6.922 -15.114
  337    H    GLY 904           H        GLY 904 -36.806  -3.566 -10.796
  338    HA2  GLY 904           1HA      GLY 904 -39.357  -4.105  -9.553
  339    HA3  GLY 904           2HA      GLY 904 -38.021  -4.980  -8.819
  340    H    GLY 905           H        GLY 905 -36.039  -3.491  -8.393
  341    HA2  GLY 905           1HA      GLY 905 -37.028  -0.929  -7.322
  342    HA3  GLY 905           2HA      GLY 905 -36.122  -2.037  -6.305
  343    H    HIS 906           H        HIS 906 -34.274  -1.026  -5.921
  344    HA   HIS 906           HA       HIS 906 -32.634  -0.237  -8.211
  345    HB2  HIS 906           2HB      HIS 906 -31.948   1.825  -7.113
  346    HB3  HIS 906           1HB      HIS 906 -33.697   1.805  -7.310
  347    HD1  HIS 906           1HD      HIS 906 -35.125   1.438  -5.060
  348    HD2  HIS 906           2HD      HIS 906 -31.038   2.053  -4.556
  349    HE1  HIS 906           1HE      HIS 906 -34.775   1.985  -2.614
  350    H    MET 907           H        MET 907 -30.312   0.300  -7.336
  351    HA   MET 907           HA       MET 907 -29.488  -2.055  -5.862
  352    HB2  MET 907           2HB      MET 907 -28.296  -1.144  -7.925
  353    HB3  MET 907           1HB      MET 907 -27.692   0.138  -6.884
  354    HG2  MET 907           2HG      MET 907 -26.072  -1.671  -7.161
  355    HG3  MET 907           1HG      MET 907 -26.567  -1.475  -5.481
  356    HE1  MET 907           3HE      MET 907 -25.069  -3.975  -6.908
  357    HE2  MET 907           1HE      MET 907 -25.367  -3.973  -5.170
  358    HE3  MET 907           2HE      MET 907 -25.852  -5.360  -6.145
  359    H    GLY 908           H        GLY 908 -30.565  -1.332  -3.872
  360    HA2  GLY 908           1HA      GLY 908 -29.332   0.824  -2.390
  361    HA3  GLY 908           2HA      GLY 908 -30.543  -0.302  -1.788
  362    H    SER 909           H        SER 909 -27.136   0.126  -2.491
  363    HA   SER 909           HA       SER 909 -26.214  -2.368  -1.629
  364    HB2  SER 909           2HB      SER 909 -24.508   0.052  -1.272
  365    HB3  SER 909           1HB      SER 909 -24.119  -1.503  -2.012
  366    HG   SER 909           HG       SER 909 -24.716  -0.753  -3.881
  367    H    GLY 910           H        GLY 910 -26.935  -3.077   0.302
  368    HA2  GLY 910           1HA      GLY 910 -25.735  -1.795   2.637
  369    HA3  GLY 910           2HA      GLY 910 -27.474  -2.059   2.664
  370    H    GLY 911           H        GLY 911 -27.960  -4.444   1.772
  371    HA2  GLY 911           1HA      GLY 911 -26.423  -6.191   3.576
  372    HA3  GLY 911           2HA      GLY 911 -28.069  -6.478   3.032
  373    H    LEU  18           H        LEU  18 -26.546  -5.455   0.358
  374    HA   LEU  18           HA       LEU  18 -26.491  -8.032  -0.820
  375    HB2  LEU  18           2HB      LEU  18 -25.439  -5.387  -1.816
  376    HB3  LEU  18           1HB      LEU  18 -25.527  -6.844  -2.786
  377    HG   LEU  18           HG       LEU  18 -28.089  -6.165  -1.574
  378   HD11  LEU  18          1HD1      LEU  18 -27.198  -4.281  -3.711
  379   HD12  LEU  18          2HD1      LEU  18 -28.542  -4.138  -2.579
  380   HD13  LEU  18          3HD1      LEU  18 -26.887  -3.910  -2.017
  381   HD21  LEU  18          3HD2      LEU  18 -27.382  -6.366  -4.484
  382   HD22  LEU  18          1HD2      LEU  18 -27.537  -7.792  -3.456
  383   HD23  LEU  18          2HD2      LEU  18 -28.919  -6.721  -3.698
  384    H    SER  19           H        SER  19 -24.402  -8.560  -2.241
  385    HA   SER  19           HA       SER  19 -22.342  -8.985  -0.218
  386    HB2  SER  19           2HB      SER  19 -21.836 -10.443  -2.623
  387    HB3  SER  19           1HB      SER  19 -22.315 -11.068  -1.044
  388    HG   SER  19           HG       SER  19 -24.136 -11.546  -1.977
  389    H    TRP  20           H        TRP  20 -22.747  -7.753  -3.490
  390    HA   TRP  20           HA       TRP  20 -21.414  -6.564  -4.886
  391    HB2  TRP  20           2HB      TRP  20 -19.777  -5.601  -2.567
  392    HB3  TRP  20           1HB      TRP  20 -20.288  -4.727  -4.006
  393    HD1  TRP  20           HD       TRP  20 -23.225  -4.564  -4.040
  394    HE1  TRP  20           1HE      TRP  20 -24.656  -3.680  -2.103
  395    HE3  TRP  20           3HE      TRP  20 -19.903  -5.176  -0.217
  396    HZ2  TRP  20           2HZ      TRP  20 -24.415  -3.270   0.673
  397    HZ3  TRP  20           3HZ      TRP  20 -20.575  -4.510   2.050
  398    HH2  TRP  20           HH       TRP  20 -22.790  -3.574   2.489
  399    H    LYS  21           H        LYS  21 -18.610  -6.379  -3.017
  400    HA   LYS  21           HA       LYS  21 -17.422  -8.642  -4.472
  401    HB2  LYS  21           2HB      LYS  21 -16.805  -5.945  -4.800
  402    HB3  LYS  21           1HB      LYS  21 -15.520  -6.559  -3.768
  403    HG2  LYS  21           2HG      LYS  21 -14.740  -6.799  -5.969
  404    HG3  LYS  21           1HG      LYS  21 -15.231  -8.417  -5.463
  405    HD2  LYS  21           2HD      LYS  21 -16.734  -8.549  -7.104
  406    HD3  LYS  21           1HD      LYS  21 -17.435  -6.988  -6.669
  407    HE2  LYS  21           2HE      LYS  21 -16.399  -5.953  -8.352
  408    HE3  LYS  21           1HE      LYS  21 -14.852  -6.699  -7.955
  409    HZ1  LYS  21           3HZ      LYS  21 -15.230  -7.596  -9.994
  410    HZ2  LYS  21           1HZ      LYS  21 -16.919  -7.587  -9.831
  411    HZ3  LYS  21           2HZ      LYS  21 -15.995  -8.774  -9.045
  412    H    ARG  22           H        ARG  22 -16.350 -10.075  -3.290
  413    HA   ARG  22           HA       ARG  22 -16.451  -9.966  -0.454
  414    HB2  ARG  22           2HB      ARG  22 -15.656 -11.882  -2.511
  415    HB3  ARG  22           1HB      ARG  22 -14.661 -11.976  -1.063
  416    HG2  ARG  22           2HG      ARG  22 -16.699 -13.473  -1.161
  417    HG3  ARG  22           1HG      ARG  22 -16.492 -12.503   0.298
  418    HD2  ARG  22           2HD      ARG  22 -17.964 -10.838  -1.291
  419    HD3  ARG  22           1HD      ARG  22 -18.587 -12.421  -1.749
  420    HE   ARG  22           HE       ARG  22 -18.476 -11.547   1.062
  421   HH11  ARG  22          2HH1      ARG  22 -20.211 -12.876  -1.681
  422   HH12  ARG  22          1HH1      ARG  22 -21.646 -13.241  -0.757
  423   HH21  ARG  22          2HH2      ARG  22 -20.358 -12.031   2.281
  424   HH22  ARG  22          1HH2      ARG  22 -21.727 -12.765   1.491
  425    H    CYS  23           H        CYS  23 -14.935  -9.431   1.018
  426    HA   CYS  23           HA       CYS  23 -12.534  -8.149   0.011
  427    HB2  CYS  23           2HB      CYS  23 -12.651  -6.792   1.810
  428    HB3  CYS  23           1HB      CYS  23 -14.305  -7.366   1.901
  429    H    ALA  24           H        ALA  24 -10.440  -8.789   0.549
  430    HA   ALA  24           HA       ALA  24 -10.372 -11.680   0.601
  431    HB1  ALA  24           1HB      ALA  24  -8.539 -11.526  -0.682
  432    HB2  ALA  24           2HB      ALA  24  -9.115  -9.879  -0.933
  433    HB3  ALA  24           3HB      ALA  24  -7.856 -10.200   0.260
  434    H    GLY  25           H        GLY  25  -8.891  -9.060   2.504
  435    HA2  GLY  25           1HA      GLY  25  -7.169 -10.798   3.970
  436    HA3  GLY  25           2HA      GLY  25  -7.549  -9.133   4.374
  437    H    CYS  26           H        CYS  26  -9.899  -8.881   5.193
  438    HA   CYS  26           HA       CYS  26 -10.150 -10.369   7.566
  439    HB2  CYS  26           2HB      CYS  26 -12.537  -8.941   6.537
  440    HB3  CYS  26           1HB      CYS  26 -11.783  -8.879   8.126
  441    H    GLY  27           H        GLY  27 -11.613 -10.684   4.396
  442    HA2  GLY  27           1HA      GLY  27 -12.429 -12.686   3.505
  443    HA3  GLY  27           2HA      GLY  27 -12.477 -13.362   5.126
  444    H    GLY  28           H        GLY  28 -13.942 -10.397   3.829
  445    HA2  GLY  28           1HA      GLY  28 -16.589 -11.594   4.346
  446    HA3  GLY  28           2HA      GLY  28 -16.189 -10.017   5.013
  447    H    LYS  29           H        LYS  29 -16.900  -8.366   3.890
  448    HA   LYS  29           HA       LYS  29 -16.706  -8.399   0.985
  449    HB2  LYS  29           2HB      LYS  29 -19.091  -7.285   1.015
  450    HB3  LYS  29           1HB      LYS  29 -18.927  -9.036   0.972
  451    HG2  LYS  29           2HG      LYS  29 -19.266  -9.123   3.396
  452    HG3  LYS  29           1HG      LYS  29 -19.456  -7.368   3.425
  453    HD2  LYS  29           2HD      LYS  29 -21.202  -8.439   1.443
  454    HD3  LYS  29           1HD      LYS  29 -21.428  -9.346   2.940
  455    HE2  LYS  29           2HE      LYS  29 -21.486  -7.013   4.055
  456    HE3  LYS  29           1HE      LYS  29 -21.796  -6.422   2.426
  457    HZ1  LYS  29           3HZ      LYS  29 -23.848  -7.323   2.386
  458    HZ2  LYS  29           1HZ      LYS  29 -23.723  -7.134   4.067
  459    HZ3  LYS  29           2HZ      LYS  29 -23.436  -8.648   3.354
  460    H    ILE  30           H        ILE  30 -16.451  -6.344   0.104
  461    HA   ILE  30           HA       ILE  30 -15.438  -4.430   1.985
  462    HB   ILE  30           HB       ILE  30 -15.774  -4.208  -1.013
  463   HG12  ILE  30          2HG1      ILE  30 -13.063  -4.323  -0.016
  464   HG13  ILE  30          1HG1      ILE  30 -13.983  -5.720   0.536
  465   HG21  ILE  30          1HG2      ILE  30 -13.956  -2.497   0.647
  466   HG22  ILE  30          2HG2      ILE  30 -14.560  -2.221  -0.987
  467   HG23  ILE  30          3HG2      ILE  30 -15.644  -2.048   0.396
  468   HD11  ILE  30          3HD1      ILE  30 -12.688  -5.756  -1.747
  469   HD12  ILE  30          1HD1      ILE  30 -14.256  -6.547  -1.572
  470   HD13  ILE  30          2HD1      ILE  30 -14.151  -4.958  -2.330
  471    H    ALA  31           H        ALA  31 -16.884  -3.405   3.178
  472    HA   ALA  31           HA       ALA  31 -18.983  -1.889   1.782
  473    HB1  ALA  31           1HB      ALA  31 -20.521  -2.521   3.281
  474    HB2  ALA  31           2HB      ALA  31 -19.379  -3.779   3.753
  475    HB3  ALA  31           3HB      ALA  31 -19.426  -2.253   4.637
  476    H    ASP  32           H        ASP  32 -16.094  -1.508   2.692
  477    HA   ASP  32           HA       ASP  32 -16.072   0.526   4.665
  478    HB2  ASP  32           2HB      ASP  32 -14.177  -0.989   3.370
  479    HB3  ASP  32           1HB      ASP  32 -13.899   0.614   2.702
  480    H    ARG  33           H        ARG  33 -14.867   1.063   1.407
  481    HA   ARG  33           HA       ARG  33 -16.966   2.802   0.617
  482    HB2  ARG  33           2HB      ARG  33 -15.785   4.341   2.160
  483    HB3  ARG  33           1HB      ARG  33 -14.310   4.118   1.228
  484    HG2  ARG  33           2HG      ARG  33 -14.971   5.502  -0.408
  485    HG3  ARG  33           1HG      ARG  33 -16.646   4.954  -0.341
  486    HD2  ARG  33           2HD      ARG  33 -15.913   6.401   2.053
  487    HD3  ARG  33           1HD      ARG  33 -15.615   7.361   0.601
  488    HE   ARG  33           HE       ARG  33 -17.898   7.332   0.114
  489   HH11  ARG  33          2HH1      ARG  33 -17.174   5.609   3.082
  490   HH12  ARG  33          1HH1      ARG  33 -18.831   5.511   3.577
  491   HH21  ARG  33          2HH2      ARG  33 -20.082   7.214   0.775
  492   HH22  ARG  33          1HH2      ARG  33 -20.484   6.413   2.273
  493    H    PHE  34           H        PHE  34 -13.468   2.923  -0.023
  494    HA   PHE  34           HA       PHE  34 -14.110   2.435  -2.834
  495    HB2  PHE  34           2HB      PHE  34 -12.067   4.039  -1.429
  496    HB3  PHE  34           1HB      PHE  34 -11.528   3.227  -2.898
  497    HD1  PHE  34           1HD      PHE  34 -14.615   5.016  -1.808
  498    HD2  PHE  34           2HD      PHE  34 -11.581   4.563  -4.755
  499    HE1  PHE  34           1HE      PHE  34 -15.697   6.742  -3.173
  500    HE2  PHE  34           2HE      PHE  34 -12.661   6.287  -6.132
  501    HZ   PHE  34           HZ       PHE  34 -14.723   7.369  -5.349
  502    H    LEU  35           H        LEU  35 -12.958   0.988  -4.074
  503    HA   LEU  35           HA       LEU  35 -11.800  -1.241  -2.581
  504    HB2  LEU  35           2HB      LEU  35 -13.019  -0.905  -5.290
  505    HB3  LEU  35           1HB      LEU  35 -11.878  -2.211  -5.037
  506    HG   LEU  35           HG       LEU  35 -13.464  -2.729  -2.971
  507   HD11  LEU  35          1HD1      LEU  35 -14.901  -0.712  -4.416
  508   HD12  LEU  35          2HD1      LEU  35 -15.794  -2.234  -4.449
  509   HD13  LEU  35          3HD1      LEU  35 -15.322  -1.522  -2.907
  510   HD21  LEU  35          3HD2      LEU  35 -12.951  -4.276  -4.780
  511   HD22  LEU  35          1HD2      LEU  35 -14.673  -4.309  -4.403
  512   HD23  LEU  35          2HD2      LEU  35 -14.100  -3.449  -5.832
  513    H    LEU  36           H        LEU  36  -9.682  -1.594  -2.563
  514    HA   LEU  36           HA       LEU  36  -8.030  -0.061  -4.464
  515    HB2  LEU  36           2HB      LEU  36  -7.037  -1.106  -1.832
  516    HB3  LEU  36           1HB      LEU  36  -6.379   0.186  -2.818
  517    HG   LEU  36           HG       LEU  36  -9.099   0.679  -1.800
  518   HD11  LEU  36          1HD1      LEU  36  -6.800   0.819   0.129
  519   HD12  LEU  36          2HD1      LEU  36  -8.514   1.075   0.447
  520   HD13  LEU  36          3HD1      LEU  36  -7.921  -0.543   0.076
  521   HD21  LEU  36          3HD2      LEU  36  -7.022   2.598  -1.184
  522   HD22  LEU  36          1HD2      LEU  36  -7.006   2.140  -2.887
  523   HD23  LEU  36          2HD2      LEU  36  -8.478   2.786  -2.159
  524    H    TYR  37           H        TYR  37  -6.624  -1.103  -5.707
  525    HA   TYR  37           HA       TYR  37  -6.465  -4.010  -5.530
  526    HB2  TYR  37           2HB      TYR  37  -6.149  -2.002  -7.626
  527    HB3  TYR  37           1HB      TYR  37  -4.852  -3.190  -7.635
  528    HD1  TYR  37           1HD      TYR  37  -6.057  -5.692  -7.016
  529    HD2  TYR  37           2HD      TYR  37  -7.681  -2.466  -9.261
  530    HE1  TYR  37           1HE      TYR  37  -7.516  -7.268  -8.208
  531    HE2  TYR  37           2HE      TYR  37  -9.149  -4.028 -10.453
  532    HH   TYR  37           HH       TYR  37  -9.378  -6.292 -10.982
  533    H    ALA  38           H        ALA  38  -4.510  -5.124  -5.345
  534    HA   ALA  38           HA       ALA  38  -2.129  -3.555  -4.660
  535    HB1  ALA  38           1HB      ALA  38  -1.633  -5.140  -2.820
  536    HB2  ALA  38           2HB      ALA  38  -3.077  -4.166  -2.539
  537    HB3  ALA  38           3HB      ALA  38  -3.234  -5.849  -3.047
  538    H    MET  39           H        MET  39  -3.369  -6.825  -5.257
  539    HA   MET  39           HA       MET  39  -1.031  -7.315  -6.957
  540    HB2  MET  39           2HB      MET  39  -1.853  -8.759  -4.541
  541    HB3  MET  39           1HB      MET  39  -1.585  -9.801  -5.931
  542    HG2  MET  39           2HG      MET  39   0.663  -9.109  -6.133
  543    HG3  MET  39           1HG      MET  39   0.420  -7.765  -5.015
  544    HE1  MET  39           3HE      MET  39   0.817  -8.226  -2.119
  545    HE2  MET  39           1HE      MET  39  -0.814  -8.291  -2.788
  546    HE3  MET  39           2HE      MET  39  -0.262  -9.548  -1.680
  547    H    ASP  40           H        ASP  40  -3.836  -9.233  -5.932
  548    HA   ASP  40           HA       ASP  40  -4.825  -9.200  -8.689
  549    HB2  ASP  40           2HB      ASP  40  -4.814 -11.488  -8.963
  550    HB3  ASP  40           1HB      ASP  40  -3.355 -11.280  -8.004
  551    H    SER  41           H        SER  41  -5.456  -8.853  -5.437
  552    HA   SER  41           HA       SER  41  -8.261  -9.660  -5.759
  553    HB2  SER  41           2HB      SER  41  -7.505  -9.262  -3.010
  554    HB3  SER  41           1HB      SER  41  -8.091 -10.727  -3.798
  555    HG   SER  41           HG       SER  41  -5.861 -11.006  -4.559
  556    H    TYR  42           H        TYR  42  -9.765  -8.380  -4.341
  557    HA   TYR  42           HA       TYR  42  -9.127  -5.527  -4.574
  558    HB2  TYR  42           2HB      TYR  42 -11.860  -5.983  -3.853
  559    HB3  TYR  42           1HB      TYR  42 -11.220  -5.282  -5.333
  560    HD1  TYR  42           2HD      TYR  42 -12.334  -8.412  -3.729
  561    HD2  TYR  42           1HD      TYR  42 -11.116  -6.552  -7.360
  562    HE1  TYR  42           2HE      TYR  42 -13.133 -10.366  -4.992
  563    HE2  TYR  42           1HE      TYR  42 -11.910  -8.502  -8.631
  564    HH   TYR  42           HH       TYR  42 -12.254 -11.114  -7.982
  565    H    TRP  43           H        TRP  43  -8.891  -4.306  -2.820
  566    HA   TRP  43           HA       TRP  43  -9.609  -5.496  -0.223
  567    HB2  TRP  43           2HB      TRP  43  -7.214  -3.710  -0.580
  568    HB3  TRP  43           1HB      TRP  43  -7.568  -4.819   0.738
  569    HD1  TRP  43           HD       TRP  43  -6.511  -4.924  -2.981
  570    HE1  TRP  43           1HE      TRP  43  -5.129  -7.053  -3.354
  571    HE3  TRP  43           3HE      TRP  43  -6.946  -7.015   1.667
  572    HZ2  TRP  43           2HZ      TRP  43  -4.316  -9.316  -1.884
  573    HZ3  TRP  43           3HZ      TRP  43  -5.831  -9.165   2.100
  574    HH2  TRP  43           HH       TRP  43  -4.543 -10.289   0.355
  575    H    HIS  44           H        HIS  44  -9.695  -3.883   1.520
  576    HA   HIS  44           HA       HIS  44 -10.334  -1.154   0.624
  577    HB2  HIS  44           2HB      HIS  44 -11.856  -1.013   2.661
  578    HB3  HIS  44           1HB      HIS  44 -12.444  -2.054   1.367
  579    HD1  HIS  44           1HD      HIS  44 -12.692  -2.106   4.803
  580    HD2  HIS  44           2HD      HIS  44 -11.036  -4.805   2.094
  581    HE1  HIS  44           1HE      HIS  44 -12.555  -4.367   5.996
  582    H    SER  45           H        SER  45 -10.318   0.078   3.133
  583    HA   SER  45           HA       SER  45  -7.550   0.378   3.486
  584    HB2  SER  45           2HB      SER  45  -8.760   1.396   5.794
  585    HB3  SER  45           1HB      SER  45  -8.375   2.286   4.320
  586    HG   SER  45           HG       SER  45 -10.435   1.917   3.567
  587    H    ARG  46           H        ARG  46  -9.939  -1.487   5.264
  588    HA   ARG  46           HA       ARG  46  -8.108  -2.163   7.389
  589    HB2  ARG  46           2HB      ARG  46 -10.924  -2.303   6.943
  590    HB3  ARG  46           1HB      ARG  46 -10.349  -3.909   7.376
  591    HG2  ARG  46           2HG      ARG  46  -9.706  -1.438   8.955
  592    HG3  ARG  46           1HG      ARG  46 -11.089  -2.485   9.293
  593    HD2  ARG  46           2HD      ARG  46  -9.597  -4.369   9.659
  594    HD3  ARG  46           1HD      ARG  46  -8.204  -3.372   9.249
  595    HE   ARG  46           HE       ARG  46  -8.621  -2.090  11.264
  596   HH11  ARG  46          2HH1      ARG  46 -10.275  -5.170  10.982
  597   HH12  ARG  46          1HH1      ARG  46 -10.526  -5.343  12.692
  598   HH21  ARG  46          2HH2      ARG  46  -8.941  -2.307  13.505
  599   HH22  ARG  46          1HH2      ARG  46  -9.744  -3.714  14.139
  600    H    CYS  47           H        CYS  47  -8.708  -3.379   4.275
  601    HA   CYS  47           HA       CYS  47  -7.744  -6.057   4.940
  602    HB2  CYS  47           2HB      CYS  47  -9.317  -4.918   2.819
  603    HB3  CYS  47           1HB      CYS  47  -7.918  -5.740   2.140
  604    H    LEU  48           H        LEU  48  -6.911  -3.347   2.828
  605    HA   LEU  48           HA       LEU  48  -4.304  -4.397   2.239
  606    HB2  LEU  48           2HB      LEU  48  -6.016  -2.263   1.294
  607    HB3  LEU  48           1HB      LEU  48  -4.379  -1.692   1.521
  608    HG   LEU  48           HG       LEU  48  -5.435  -3.701  -0.411
  609   HD11  LEU  48          1HD1      LEU  48  -4.962  -1.273  -0.930
  610   HD12  LEU  48          2HD1      LEU  48  -3.254  -1.666  -0.739
  611   HD13  LEU  48          3HD1      LEU  48  -4.207  -2.465  -1.988
  612   HD21  LEU  48          3HD2      LEU  48  -3.682  -5.069  -0.370
  613   HD22  LEU  48          1HD2      LEU  48  -2.544  -3.723  -0.303
  614   HD23  LEU  48          2HD2      LEU  48  -3.257  -4.346   1.183
  615    H    LYS  49           H        LYS  49  -3.447  -4.599   4.340
  616    HA   LYS  49           HA       LYS  49  -2.306  -2.100   5.347
  617    HB2  LYS  49           2HB      LYS  49  -2.611  -3.460   7.676
  618    HB3  LYS  49           1HB      LYS  49  -3.731  -2.231   7.111
  619    HG2  LYS  49           2HG      LYS  49  -5.173  -3.915   7.658
  620    HG3  LYS  49           1HG      LYS  49  -4.903  -4.262   5.948
  621    HD2  LYS  49           2HD      LYS  49  -3.514  -6.073   6.412
  622    HD3  LYS  49           1HD      LYS  49  -3.186  -5.525   8.058
  623    HE2  LYS  49           2HE      LYS  49  -4.647  -7.257   8.447
  624    HE3  LYS  49           1HE      LYS  49  -5.752  -5.886   8.376
  625    HZ1  LYS  49           3HZ      LYS  49  -5.778  -6.574   5.843
  626    HZ2  LYS  49           1HZ      LYS  49  -6.813  -7.294   6.979
  627    HZ3  LYS  49           2HZ      LYS  49  -5.395  -8.093   6.493
  628    H    CYS  50           H        CYS  50  -0.299  -2.445   6.546
  629    HA   CYS  50           HA       CYS  50   1.338  -4.482   5.502
  630    HB2  CYS  50           2HB      CYS  50   2.273  -2.389   6.401
  631    HB3  CYS  50           1HB      CYS  50   1.724  -2.819   8.012
  632    H    SER  51           H        SER  51   1.666  -6.532   6.130
  633    HA   SER  51           HA       SER  51  -0.091  -7.733   8.018
  634    HB2  SER  51           2HB      SER  51   2.410  -9.032   6.940
  635    HB3  SER  51           1HB      SER  51   0.889  -9.796   7.398
  636    HG   SER  51           HG       SER  51   0.947  -7.896   5.317
  637    H    SER  52           H        SER  52   2.762  -6.026   8.361
  638    HA   SER  52           HA       SER  52   3.431  -7.347  10.894
  639    HB2  SER  52           2HB      SER  52   5.309  -5.311  10.014
  640    HB3  SER  52           1HB      SER  52   5.588  -7.013  10.383
  641    HG   SER  52           HG       SER  52   4.701  -5.882   7.932
  642    H    CYS  53           H        CYS  53   2.770  -4.184   9.422
  643    HA   CYS  53           HA       CYS  53   2.921  -2.818  11.972
  644    HB2  CYS  53           2HB      CYS  53   2.212  -1.938   9.177
  645    HB3  CYS  53           1HB      CYS  53   2.073  -0.862  10.562
  646    H    GLN  54           H        GLN  54   0.464  -4.140   9.896
  647    HA   GLN  54           HA       GLN  54  -1.787  -4.127   9.866
  648    HB2  GLN  54           2HB      GLN  54  -1.288  -3.542  12.759
  649    HB3  GLN  54           1HB      GLN  54  -2.927  -3.451  12.120
  650    HG2  GLN  54           2HG      GLN  54  -1.162  -5.852  11.785
  651    HG3  GLN  54           1HG      GLN  54  -2.252  -5.636  13.148
  652   HE21  GLN  54          1HE2      GLN  54  -4.340  -4.344  11.613
  653   HE22  GLN  54          2HE2      GLN  54  -5.065  -5.584  10.650
  654    H    ALA  55           H        ALA  55   0.007  -1.616   9.658
  655    HA   ALA  55           HA       ALA  55  -1.871   0.533  10.023
  656    HB1  ALA  55           1HB      ALA  55  -0.092   1.861   9.743
  657    HB2  ALA  55           2HB      ALA  55   0.874   0.387   9.757
  658    HB3  ALA  55           3HB      ALA  55   0.348   1.081   8.223
  659    H    GLN  56           H        GLN  56  -3.244   1.336   8.551
  660    HA   GLN  56           HA       GLN  56  -3.964  -0.342   6.379
  661    HB2  GLN  56           2HB      GLN  56  -5.005   2.447   6.552
  662    HB3  GLN  56           1HB      GLN  56  -5.853   0.953   6.190
  663    HG2  GLN  56           2HG      GLN  56  -4.926   0.765   8.846
  664    HG3  GLN  56           1HG      GLN  56  -5.669   2.353   8.654
  665   HE21  GLN  56          1HE2      GLN  56  -7.823   2.297   7.481
  666   HE22  GLN  56          2HE2      GLN  56  -8.905   1.018   7.934
  667    H    LEU  57           H        LEU  57  -2.368  -0.455   4.848
  668    HA   LEU  57           HA       LEU  57  -1.029   1.782   3.749
  669    HB2  LEU  57           2HB      LEU  57  -1.529  -0.842   2.351
  670    HB3  LEU  57           1HB      LEU  57  -0.226   0.291   2.050
  671    HG   LEU  57           HG       LEU  57  -0.536  -1.215   4.645
  672   HD11  LEU  57          1HD1      LEU  57   0.381  -2.147   2.071
  673   HD12  LEU  57          2HD1      LEU  57   1.661  -2.220   3.283
  674   HD13  LEU  57          3HD1      LEU  57   0.125  -3.039   3.570
  675   HD21  LEU  57          3HD2      LEU  57   1.525  -0.399   5.246
  676   HD22  LEU  57          1HD2      LEU  57   2.013  -0.100   3.576
  677   HD23  LEU  57          2HD2      LEU  57   0.861   0.979   4.365
  678    H    GLY  58           H        GLY  58  -4.138   0.388   3.237
  679    HA2  GLY  58           1HA      GLY  58  -4.638   1.665   0.715
  680    HA3  GLY  58           2HA      GLY  58  -5.836   0.927   1.766
  681    H    ASP  59           H        ASP  59  -4.468   2.776   3.905
  682    HA   ASP  59           HA       ASP  59  -6.245   5.035   3.368
  683    HB2  ASP  59           2HB      ASP  59  -5.386   3.635   5.793
  684    HB3  ASP  59           1HB      ASP  59  -5.318   5.386   5.940
  685    H    ILE  60           H        ILE  60  -3.148   4.185   3.037
  686    HA   ILE  60           HA       ILE  60  -2.197   6.968   3.036
  687    HB   ILE  60           HB       ILE  60  -0.313   4.748   3.782
  688   HG12  ILE  60          2HG1      ILE  60  -1.486   6.388   5.970
  689   HG13  ILE  60          1HG1      ILE  60  -2.461   5.063   5.343
  690   HG21  ILE  60          1HG2      ILE  60   1.123   6.415   4.417
  691   HG22  ILE  60          2HG2      ILE  60   0.249   7.218   3.112
  692   HG23  ILE  60          3HG2      ILE  60  -0.178   7.546   4.792
  693   HD11  ILE  60          3HD1      ILE  60  -0.761   4.767   7.354
  694   HD12  ILE  60          1HD1      ILE  60  -1.099   3.475   6.202
  695   HD13  ILE  60          2HD1      ILE  60   0.352   4.461   6.022
  696    H    GLY  61           H        GLY  61  -1.941   7.344   0.903
  697    HA2  GLY  61           1HA      GLY  61  -1.638   5.174  -0.952
  698    HA3  GLY  61           2HA      GLY  61  -1.747   6.878  -1.349
  699    H    THR  62           H        THR  62   0.638   5.122   0.618
  700    HA   THR  62           HA       THR  62   2.738   6.052  -1.225
  701    HB   THR  62           HB       THR  62   3.495   4.704   1.303
  702    HG1  THR  62           1HG      THR  62   1.631   6.561   1.368
  703   HG21  THR  62          3HG2      THR  62   4.405   7.321   0.119
  704   HG22  THR  62          1HG2      THR  62   5.076   5.759  -0.351
  705   HG23  THR  62          2HG2      THR  62   5.240   6.326   1.312
  706    H    SER  63           H        SER  63   3.791   4.605  -2.490
  707    HA   SER  63           HA       SER  63   2.772   2.078  -2.976
  708    HB2  SER  63           2HB      SER  63   5.582   2.232  -3.669
  709    HB3  SER  63           1HB      SER  63   4.171   2.184  -4.727
  710    HG   SER  63           HG       SER  63   4.175   4.317  -4.866
  711    H    SER  64           H        SER  64   2.711   0.415  -1.618
  712    HA   SER  64           HA       SER  64   4.902  -0.142   0.198
  713    HB2  SER  64           2HB      SER  64   3.081  -2.240   0.354
  714    HB3  SER  64           1HB      SER  64   3.113  -0.818   1.394
  715    HG   SER  64           HG       SER  64   1.272  -1.535  -0.429
  716    H    TYR  65           H        TYR  65   5.203  -2.798   0.274
  717    HA   TYR  65           HA       TYR  65   5.891  -3.550  -2.484
  718    HB2  TYR  65           2HB      TYR  65   7.730  -3.696  -0.092
  719    HB3  TYR  65           1HB      TYR  65   8.076  -4.401  -1.666
  720    HD1  TYR  65           1HD      TYR  65   8.013  -2.730  -3.682
  721    HD2  TYR  65           2HD      TYR  65   8.462  -1.557   0.377
  722    HE1  TYR  65           1HE      TYR  65   9.014  -0.610  -4.411
  723    HE2  TYR  65           2HE      TYR  65   9.468   0.567  -0.339
  724    HH   TYR  65           HH       TYR  65  10.536   1.567  -2.190
  725    H    THR  66           H        THR  66   6.110  -5.770  -2.877
  726    HA   THR  66           HA       THR  66   5.523  -7.597  -0.671
  727    HB   THR  66           HB       THR  66   3.402  -7.094  -2.004
  728    HG1  THR  66           1HG      THR  66   3.489  -8.931  -0.729
  729   HG21  THR  66          3HG2      THR  66   4.384  -7.072  -4.238
  730   HG22  THR  66          1HG2      THR  66   3.125  -8.300  -4.118
  731   HG23  THR  66          2HG2      THR  66   4.824  -8.772  -4.073
  732    H    LYS  67           H        LYS  67   6.108  -9.848  -1.221
  733    HA   LYS  67           HA       LYS  67   7.814 -10.319  -3.472
  734    HB2  LYS  67           2HB      LYS  67   9.079  -9.012  -1.479
  735    HB3  LYS  67           1HB      LYS  67   9.307 -10.668  -0.935
  736    HG2  LYS  67           2HG      LYS  67  10.079 -11.030  -3.416
  737    HG3  LYS  67           1HG      LYS  67  10.377  -9.293  -3.343
  738    HD2  LYS  67           2HD      LYS  67  11.852  -9.569  -1.473
  739    HD3  LYS  67           1HD      LYS  67  11.440 -11.279  -1.339
  740    HE2  LYS  67           2HE      LYS  67  12.471 -10.399  -3.959
  741    HE3  LYS  67           1HE      LYS  67  13.620 -10.345  -2.621
  742    HZ1  LYS  67           3HZ      LYS  67  13.646 -12.577  -2.427
  743    HZ2  LYS  67           1HZ      LYS  67  13.219 -12.515  -4.068
  744    HZ3  LYS  67           2HZ      LYS  67  12.027 -12.775  -2.891
  745    H    SER  68           H        SER  68   7.568 -11.463  -0.106
  746    HA   SER  68           HA       SER  68   7.610 -14.209  -0.962
  747    HB2  SER  68           2HB      SER  68   6.948 -14.059   1.775
  748    HB3  SER  68           1HB      SER  68   8.535 -14.380   1.071
  749    HG   SER  68           HG       SER  68   9.001 -12.576   2.079
  750    H    GLY  69           H        GLY  69   5.240 -12.244  -1.429
  751    HA2  GLY  69           1HA      GLY  69   3.000 -12.747  -1.851
  752    HA3  GLY  69           2HA      GLY  69   3.170 -14.206  -0.886
  753    H    MET  70           H        MET  70   4.385 -11.411   0.605
  754    HA   MET  70           HA       MET  70   1.971 -11.241   2.283
  755    HB2  MET  70           2HB      MET  70   4.886 -11.149   2.908
  756    HB3  MET  70           1HB      MET  70   3.803 -10.176   3.893
  757    HG2  MET  70           2HG      MET  70   3.569 -11.997   5.138
  758    HG3  MET  70           1HG      MET  70   2.540 -12.603   3.842
  759    HE1  MET  70           3HE      MET  70   7.017 -13.155   3.976
  760    HE2  MET  70           1HE      MET  70   6.042 -11.931   4.793
  761    HE3  MET  70           2HE      MET  70   6.311 -13.499   5.555
  762    H    ILE  71           H        ILE  71   1.169  -9.229   2.830
  763    HA   ILE  71           HA       ILE  71   2.067  -7.001   1.179
  764    HB   ILE  71           HB       ILE  71  -0.191  -6.877   3.161
  765   HG12  ILE  71          2HG1      ILE  71  -0.927  -7.521   0.387
  766   HG13  ILE  71          1HG1      ILE  71  -0.113  -8.831   1.239
  767   HG21  ILE  71          1HG2      ILE  71  -1.082  -5.363   1.291
  768   HG22  ILE  71          2HG2      ILE  71   0.256  -4.768   2.277
  769   HG23  ILE  71          3HG2      ILE  71   0.565  -5.407   0.662
  770   HD11  ILE  71          3HD1      ILE  71  -2.710  -7.496   1.889
  771   HD12  ILE  71          1HD1      ILE  71  -2.370  -9.207   1.630
  772   HD13  ILE  71          2HD1      ILE  71  -1.815  -8.415   3.102
  773    H    LEU  72           H        LEU  72   3.752  -5.881   1.987
  774    HA   LEU  72           HA       LEU  72   3.651  -5.172   4.841
  775    HB2  LEU  72           2HB      LEU  72   6.291  -5.471   3.497
  776    HB3  LEU  72           1HB      LEU  72   5.880  -5.632   5.193
  777    HG   LEU  72           HG       LEU  72   4.836  -7.686   3.303
  778   HD11  LEU  72          1HD1      LEU  72   7.048  -7.670   2.527
  779   HD12  LEU  72          2HD1      LEU  72   7.701  -7.386   4.141
  780   HD13  LEU  72          3HD1      LEU  72   7.001  -8.955   3.736
  781   HD21  LEU  72          3HD2      LEU  72   4.276  -7.624   5.733
  782   HD22  LEU  72          1HD2      LEU  72   5.053  -9.116   5.208
  783   HD23  LEU  72          2HD2      LEU  72   5.981  -7.898   6.081
  784    H    CYS  73           H        CYS  73   4.824  -3.212   5.375
  785    HA   CYS  73           HA       CYS  73   4.380  -1.127   3.490
  786    HB2  CYS  73           2HB      CYS  73   5.370   0.329   5.211
  787    HB3  CYS  73           1HB      CYS  73   4.146  -0.741   5.889
  788    H    ARG  74           H        ARG  74   6.292   0.539   3.272
  789    HA   ARG  74           HA       ARG  74   8.200  -0.684   1.583
  790    HB2  ARG  74           2HB      ARG  74   8.968   1.965   2.538
  791    HB3  ARG  74           1HB      ARG  74   8.664   1.403   0.901
  792    HG2  ARG  74           2HG      ARG  74   6.701   2.421   0.865
  793    HG3  ARG  74           1HG      ARG  74   6.193   1.603   2.344
  794    HD2  ARG  74           2HD      ARG  74   7.695   3.349   3.531
  795    HD3  ARG  74           1HD      ARG  74   7.570   4.239   2.015
  796    HE   ARG  74           HE       ARG  74   4.986   3.566   2.712
  797   HH11  ARG  74          2HH1      ARG  74   7.616   5.425   4.110
  798   HH12  ARG  74          1HH1      ARG  74   6.563   6.505   4.977
  799   HH21  ARG  74          2HH2      ARG  74   3.602   4.998   3.830
  800   HH22  ARG  74          1HH2      ARG  74   4.276   6.269   4.807
  801    H    ASN  75           H        ASN  75   8.225   0.265   4.936
  802    HA   ASN  75           HA       ASN  75  11.096   0.115   5.170
  803    HB2  ASN  75           2HB      ASN  75   9.552   1.628   6.545
  804    HB3  ASN  75           1HB      ASN  75   9.147   0.180   7.465
  805   HD21  ASN  75          1HD2      ASN  75  10.642  -0.700   8.863
  806   HD22  ASN  75          2HD2      ASN  75  12.125   0.099   9.271
  807    H    ASP  76           H        ASP  76   8.313  -1.835   6.182
  808    HA   ASP  76           HA       ASP  76   9.814  -3.739   7.629
  809    HB2  ASP  76           2HB      ASP  76   7.044  -3.437   6.754
  810    HB3  ASP  76           1HB      ASP  76   7.577  -5.116   6.795
  811    H    TYR  77           H        TYR  77   8.818  -3.581   4.245
  812    HA   TYR  77           HA       TYR  77   9.657  -6.180   3.544
  813    HB2  TYR  77           2HB      TYR  77   8.327  -5.110   1.913
  814    HB3  TYR  77           1HB      TYR  77   9.328  -3.658   1.921
  815    HD1  TYR  77           1HD      TYR  77   9.601  -7.313   1.203
  816    HD2  TYR  77           2HD      TYR  77  10.860  -3.372   0.198
  817    HE1  TYR  77           1HE      TYR  77  10.945  -8.219  -0.642
  818    HE2  TYR  77           2HE      TYR  77  12.203  -4.272  -1.653
  819    HH   TYR  77           HH       TYR  77  13.357  -6.614  -2.097
  820    H    ILE  78           H        ILE  78  11.365  -3.070   3.548
  821    HA   ILE  78           HA       ILE  78  13.785  -4.038   2.472
  822    HB   ILE  78           HB       ILE  78  13.051  -1.609   4.076
  823   HG12  ILE  78          2HG1      ILE  78  14.358  -1.785   1.369
  824   HG13  ILE  78          1HG1      ILE  78  12.616  -1.940   1.566
  825   HG21  ILE  78          1HG2      ILE  78  15.715  -2.757   3.845
  826   HG22  ILE  78          2HG2      ILE  78  15.619  -1.114   3.210
  827   HG23  ILE  78          3HG2      ILE  78  15.133  -1.447   4.872
  828   HD11  ILE  78          3HD1      ILE  78  14.295   0.422   1.582
  829   HD12  ILE  78          1HD1      ILE  78  12.556   0.267   1.329
  830   HD13  ILE  78          2HD1      ILE  78  13.206   0.352   2.966
  831    H    ARG  79           H        ARG  79  12.590  -3.726   5.779
  832    HA   ARG  79           HA       ARG  79  14.915  -4.544   7.122
  833    HB2  ARG  79           2HB      ARG  79  12.395  -3.745   7.865
  834    HB3  ARG  79           1HB      ARG  79  12.387  -5.445   8.312
  835    HG2  ARG  79           2HG      ARG  79  14.638  -3.651   9.135
  836    HG3  ARG  79           1HG      ARG  79  13.130  -3.711  10.051
  837    HD2  ARG  79           2HD      ARG  79  13.527  -6.297   9.948
  838    HD3  ARG  79           1HD      ARG  79  15.199  -5.826   9.652
  839    HE   ARG  79           HE       ARG  79  13.644  -5.211  12.078
  840   HH11  ARG  79          2HH1      ARG  79  16.704  -5.514  10.394
  841   HH12  ARG  79          1HH1      ARG  79  17.657  -5.358  11.838
  842   HH21  ARG  79          2HH2      ARG  79  14.898  -5.013  13.983
  843   HH22  ARG  79          1HH2      ARG  79  16.637  -5.043  13.871
  844    H    LEU  80           H        LEU  80  12.262  -6.352   5.687
  845    HA   LEU  80           HA       LEU  80  13.154  -8.900   6.628
  846    HB2  LEU  80           2HB      LEU  80  10.895  -7.831   5.224
  847    HB3  LEU  80           1HB      LEU  80  11.502  -9.227   4.353
  848    HG   LEU  80           HG       LEU  80  11.377 -10.498   6.540
  849   HD11  LEU  80          1HD1      LEU  80  11.244  -8.304   7.861
  850   HD12  LEU  80          2HD1      LEU  80   9.535  -8.305   7.428
  851   HD13  LEU  80          3HD1      LEU  80  10.209  -9.639   8.366
  852   HD21  LEU  80          3HD2      LEU  80   9.651 -10.413   4.608
  853   HD22  LEU  80          1HD2      LEU  80   9.186 -11.134   6.148
  854   HD23  LEU  80          2HD2      LEU  80   8.672  -9.495   5.753
  855    H    PHE  81           H        PHE  81  13.188  -7.321   3.423
  856    HA   PHE  81           HA       PHE  81  15.366  -9.158   2.660
  857    HB2  PHE  81           2HB      PHE  81  13.169  -8.172   0.824
  858    HB3  PHE  81           1HB      PHE  81  14.479  -9.265   0.393
  859    HD1  PHE  81           2HD      PHE  81  14.478 -11.565   1.144
  860    HD2  PHE  81           1HD      PHE  81  11.267  -8.933   2.066
  861    HE1  PHE  81           2HE      PHE  81  13.080 -13.492   1.758
  862    HE2  PHE  81           1HE      PHE  81   9.860 -10.856   2.676
  863    HZ   PHE  81           HZ       PHE  81  10.766 -13.138   2.522
  864    H    GLY  82           H        GLY  82  13.803  -6.484   0.952
  865    HA2  GLY  82           1HA      GLY  82  14.761  -4.324   0.595
  866    HA3  GLY  82           2HA      GLY  82  16.335  -4.995   1.012
  Start of MODEL   20
    1    H    SER 641           1H       SER 641  20.613   7.433  17.815
    2    HA   SER 641           HA       SER 641  21.584   9.366  18.363
    3    HB2  SER 641           2HB      SER 641  24.200   9.406  17.386
    4    HB3  SER 641           1HB      SER 641  23.708   9.160  19.063
    5    HG   SER 641           HG       SER 641  24.809   7.352  18.690
    6    H    LEU 642           H        LEU 642  23.803   8.870  15.666
    7    HA   LEU 642           HA       LEU 642  22.320  10.969  14.258
    8    HB2  LEU 642           2HB      LEU 642  25.105  10.386  14.681
    9    HB3  LEU 642           1HB      LEU 642  24.766  10.474  12.964
   10    HG   LEU 642           HG       LEU 642  25.483  12.637  13.739
   11   HD11  LEU 642          1HD1      LEU 642  23.105  12.164  12.381
   12   HD12  LEU 642          2HD1      LEU 642  22.706  13.416  13.557
   13   HD13  LEU 642          3HD1      LEU 642  24.027  13.667  12.414
   14   HD21  LEU 642          3HD2      LEU 642  25.029  12.541  16.063
   15   HD22  LEU 642          1HD2      LEU 642  24.068  13.870  15.411
   16   HD23  LEU 642          2HD2      LEU 642  23.300  12.327  15.787
   17    H    GLN 643           H        GLN 643  20.815   9.060  13.758
   18    HA   GLN 643           HA       GLN 643  21.730   7.428  11.536
   19    HB2  GLN 643           2HB      GLN 643  20.058   6.704  13.398
   20    HB3  GLN 643           1HB      GLN 643  18.874   7.588  12.444
   21    HG2  GLN 643           2HG      GLN 643  19.384   6.186  10.510
   22    HG3  GLN 643           1HG      GLN 643  20.563   5.294  11.467
   23   HE21  GLN 643          1HE2      GLN 643  17.151   6.061  11.137
   24   HE22  GLN 643          2HE2      GLN 643  16.567   4.633  11.926
   25    H    ASN 644           H        ASN 644  22.225   9.360  10.249
   26    HA   ASN 644           HA       ASN 644  19.836  10.241   8.780
   27    HB2  ASN 644           2HB      ASN 644  21.189  11.948  10.377
   28    HB3  ASN 644           1HB      ASN 644  22.119  12.128   8.893
   29   HD21  ASN 644          1HD2      ASN 644  21.246  14.354   9.125
   30   HD22  ASN 644          2HD2      ASN 644  19.700  14.693   8.420
   31    H    ASN 645           H        ASN 645  20.254   8.631   7.258
   32    HA   ASN 645           HA       ASN 645  22.396   9.301   5.385
   33    HB2  ASN 645           2HB      ASN 645  23.452   7.516   6.532
   34    HB3  ASN 645           1HB      ASN 645  21.955   6.598   6.647
   35   HD21  ASN 645          1HD2      ASN 645  22.119   4.829   5.478
   36   HD22  ASN 645          2HD2      ASN 645  22.792   4.716   3.882
   37    H    GLN 646           H        GLN 646  21.192   9.924   3.714
   38    HA   GLN 646           HA       GLN 646  19.354   7.936   2.581
   39    HB2  GLN 646           2HB      GLN 646  18.714  10.720   3.386
   40    HB3  GLN 646           1HB      GLN 646  18.093  10.196   1.825
   41    HG2  GLN 646           2HG      GLN 646  17.562   8.961   4.512
   42    HG3  GLN 646           1HG      GLN 646  16.418   9.805   3.469
   43   HE21  GLN 646          1HE2      GLN 646  18.112   6.847   4.066
   44   HE22  GLN 646          2HE2      GLN 646  17.263   5.883   2.900
   45    H    ASP 647           H        ASP 647  21.923   8.181   1.826
   46    HA   ASP 647           HA       ASP 647  22.386  10.040  -0.262
   47    HB2  ASP 647           2HB      ASP 647  24.245   8.987   0.911
   48    HB3  ASP 647           1HB      ASP 647  23.728   7.398   0.353
   49    H    VAL 648           H        VAL 648  21.500  10.062  -2.195
   50    HA   VAL 648           HA       VAL 648  20.372   7.585  -3.289
   51    HB   VAL 648           HB       VAL 648  19.442   9.365  -5.023
   52   HG11  VAL 648          1HG1      VAL 648  18.200   7.857  -3.414
   53   HG12  VAL 648          2HG1      VAL 648  18.208   9.210  -2.284
   54   HG13  VAL 648          3HG1      VAL 648  17.397   9.368  -3.840
   55   HG21  VAL 648          3HG2      VAL 648  19.202  11.153  -2.698
   56   HG22  VAL 648          1HG2      VAL 648  20.802  11.097  -3.439
   57   HG23  VAL 648          2HG2      VAL 648  19.393  11.533  -4.409
   58    H    SER 649           H        SER 649  21.125   6.693  -5.116
   59    HA   SER 649           HA       SER 649  23.620   7.675  -6.182
   60    HB2  SER 649           2HB      SER 649  22.342   5.413  -7.557
   61    HB3  SER 649           1HB      SER 649  23.944   5.527  -6.828
   62    HG   SER 649           HG       SER 649  22.839   5.308  -4.756
   63    H    PHE 650           H        PHE 650  23.865   8.829  -7.999
   64    HA   PHE 650           HA       PHE 650  21.465   9.285  -9.648
   65    HB2  PHE 650           2HB      PHE 650  23.727  11.109  -8.853
   66    HB3  PHE 650           1HB      PHE 650  22.728  11.449 -10.263
   67    HD1  PHE 650           1HD      PHE 650  20.070  11.022  -9.628
   68    HD2  PHE 650           2HD      PHE 650  23.155  12.342  -7.010
   69    HE1  PHE 650           1HE      PHE 650  18.385  12.090  -8.192
   70    HE2  PHE 650           2HE      PHE 650  21.471  13.411  -5.568
   71    HZ   PHE 650           HZ       PHE 650  19.083  13.287  -6.159
   72    H    GLU 651           H        GLU 651  21.942   9.862 -11.936
   73    HA   GLU 651           HA       GLU 651  23.555   7.869 -13.137
   74    HB2  GLU 651           2HB      GLU 651  21.577   8.651 -14.256
   75    HB3  GLU 651           1HB      GLU 651  22.171  10.304 -14.261
   76    HG2  GLU 651           2HG      GLU 651  24.149   8.969 -15.596
   77    HG3  GLU 651           1HG      GLU 651  22.694   8.117 -16.113
   78    H    ASN 652           H        ASN 652  24.028  11.321 -12.555
   79    HA   ASN 652           HA       ASN 652  26.451  11.499 -14.046
   80    HB2  ASN 652           2HB      ASN 652  24.774  13.285 -12.605
   81    HB3  ASN 652           1HB      ASN 652  26.409  13.460 -11.973
   82   HD21  ASN 652          1HD2      ASN 652  28.030  14.240 -13.295
   83   HD22  ASN 652          2HD2      ASN 652  27.700  14.994 -14.824
   84    H    ILE 653           H        ILE 653  25.670  10.434 -10.861
   85    HA   ILE 653           HA       ILE 653  28.540  10.210 -10.222
   86    HB   ILE 653           HB       ILE 653  26.407   9.995  -8.120
   87   HG12  ILE 653          2HG1      ILE 653  27.727  12.632  -8.498
   88   HG13  ILE 653          1HG1      ILE 653  26.430  12.225  -9.614
   89   HG21  ILE 653          1HG2      ILE 653  28.361  11.048  -6.802
   90   HG22  ILE 653          2HG2      ILE 653  28.469   9.351  -7.275
   91   HG23  ILE 653          3HG2      ILE 653  29.342  10.580  -8.191
   92   HD11  ILE 653          3HD1      ILE 653  25.446  13.433  -7.852
   93   HD12  ILE 653          1HD1      ILE 653  25.005  11.743  -7.594
   94   HD13  ILE 653          2HD1      ILE 653  26.286  12.480  -6.630
   95    H    GLN 654           H        GLN 654  28.465   8.263 -11.562
   96    HA   GLN 654           HA       GLN 654  26.955   6.040 -10.381
   97    HB2  GLN 654           2HB      GLN 654  28.091   6.546 -13.108
   98    HB3  GLN 654           1HB      GLN 654  27.736   4.904 -12.587
   99    HG2  GLN 654           2HG      GLN 654  25.712   7.121 -12.527
  100    HG3  GLN 654           1HG      GLN 654  25.946   6.063 -13.915
  101   HE21  GLN 654          1HE2      GLN 654  24.353   6.497 -11.008
  102   HE22  GLN 654          2HE2      GLN 654  23.691   4.905 -10.834
  103    H    TRP 655           H        TRP 655  28.348   5.619  -8.652
  104    HA   TRP 655           HA       TRP 655  30.973   4.555  -9.403
  105    HB2  TRP 655           2HB      TRP 655  31.349   4.401  -6.912
  106    HB3  TRP 655           1HB      TRP 655  31.157   6.031  -7.538
  107    HD1  TRP 655           HD       TRP 655  28.481   7.016  -7.197
  108    HE1  TRP 655           1HE      TRP 655  27.036   6.832  -5.066
  109    HE3  TRP 655           3HE      TRP 655  30.888   3.117  -4.925
  110    HZ2  TRP 655           2HZ      TRP 655  26.946   5.242  -2.738
  111    HZ3  TRP 655           3HZ      TRP 655  30.061   2.328  -2.746
  112    HH2  TRP 655           HH       TRP 655  28.131   3.371  -1.677
  113    H    SER 656           H        SER 656  31.202   2.647  -7.306
  114    HA   SER 656           HA       SER 656  29.872   0.459  -8.543
  115    HB2  SER 656           2HB      SER 656  30.928  -0.160  -5.919
  116    HB3  SER 656           1HB      SER 656  31.476  -0.711  -7.504
  117    HG   SER 656           HG       SER 656  33.074   0.632  -7.352
  118    H    ILE 657           H        ILE 657  27.664   0.806  -8.372
  119    HA   ILE 657           HA       ILE 657  26.541   0.612  -5.652
  120    HB   ILE 657           HB       ILE 657  24.458   1.619  -6.663
  121   HG12  ILE 657          2HG1      ILE 657  25.916   2.985  -8.781
  122   HG13  ILE 657          1HG1      ILE 657  25.840   1.248  -9.054
  123   HG21  ILE 657          1HG2      ILE 657  26.074   2.871  -5.267
  124   HG22  ILE 657          2HG2      ILE 657  26.902   3.380  -6.738
  125   HG23  ILE 657          3HG2      ILE 657  25.238   3.884  -6.443
  126   HD11  ILE 657          3HD1      ILE 657  23.709   3.272  -9.114
  127   HD12  ILE 657          1HD1      ILE 657  23.903   1.788 -10.049
  128   HD13  ILE 657          2HD1      ILE 657  23.285   1.718  -8.396
  129    H    ASP 658           H        ASP 658  24.468  -0.544  -5.511
  130    HA   ASP 658           HA       ASP 658  24.537  -3.026  -6.938
  131    HB2  ASP 658           2HB      ASP 658  23.735  -2.654  -4.534
  132    HB3  ASP 658           1HB      ASP 658  22.248  -2.030  -5.240
  133    HA   PRO 659           HA       PRO 659  22.194  -1.549 -10.428
  134    HB2  PRO 659           2HB      PRO 659  21.985  -4.395 -11.130
  135    HB3  PRO 659           1HB      PRO 659  22.758  -3.075 -12.009
  136    HG2  PRO 659           2HG      PRO 659  24.198  -4.993 -10.801
  137    HG3  PRO 659           1HG      PRO 659  24.756  -3.312 -10.884
  138    HD2  PRO 659           2HD      PRO 659  23.473  -4.771  -8.601
  139    HD3  PRO 659           1HD      PRO 659  24.848  -3.644  -8.588
  140    H    GLY 660           H        GLY 660  21.120  -3.698  -7.999
  141    HA2  GLY 660           1HA      GLY 660  18.348  -3.474  -8.998
  142    HA3  GLY 660           2HA      GLY 660  18.930  -4.826  -8.036
  143    H    ALA 661           H        ALA 661  19.782  -1.482  -7.441
  144    HA   ALA 661           HA       ALA 661  19.035  -1.600  -4.719
  145    HB1  ALA 661           1HB      ALA 661  19.414   0.884  -4.788
  146    HB2  ALA 661           2HB      ALA 661  20.765  -0.099  -5.355
  147    HB3  ALA 661           3HB      ALA 661  19.719   0.714  -6.517
  148    H    ASP 662           H        ASP 662  17.346  -0.700  -7.603
  149    HA   ASP 662           HA       ASP 662  15.067   0.300  -6.073
  150    HB2  ASP 662           2HB      ASP 662  15.686   1.540  -8.103
  151    HB3  ASP 662           1HB      ASP 662  15.490   0.082  -9.069
  152    H    LEU 663           H        LEU 663  13.610  -1.107  -5.379
  153    HA   LEU 663           HA       LEU 663  13.587  -3.816  -6.361
  154    HB2  LEU 663           2HB      LEU 663  11.597  -2.634  -4.437
  155    HB3  LEU 663           1HB      LEU 663  12.124  -4.302  -4.573
  156    HG   LEU 663           HG       LEU 663  14.269  -2.405  -3.914
  157   HD11  LEU 663          1HD1      LEU 663  11.943  -1.850  -2.646
  158   HD12  LEU 663          2HD1      LEU 663  12.631  -3.066  -1.571
  159   HD13  LEU 663          3HD1      LEU 663  13.545  -1.606  -1.946
  160   HD21  LEU 663          3HD2      LEU 663  13.539  -5.182  -3.508
  161   HD22  LEU 663          1HD2      LEU 663  15.127  -4.412  -3.475
  162   HD23  LEU 663          2HD2      LEU 663  14.122  -4.423  -2.027
  163    H    SER 664           H        SER 664  13.031  -2.755  -8.554
  164    HA   SER 664           HA       SER 664  10.527  -1.657  -9.107
  165    HB2  SER 664           2HB      SER 664  11.762  -3.315 -11.225
  166    HB3  SER 664           1HB      SER 664  11.254  -1.628 -11.263
  167    HG   SER 664           HG       SER 664  13.153  -1.209  -9.901
  168    H    GLN 665           H        GLN 665  11.567  -5.034  -9.099
  169    HA   GLN 665           HA       GLN 665   9.198  -6.026 -10.343
  170    HB2  GLN 665           2HB      GLN 665  10.781  -7.863  -8.648
  171    HB3  GLN 665           1HB      GLN 665  10.205  -8.066 -10.296
  172    HG2  GLN 665           2HG      GLN 665  12.361  -7.855 -10.831
  173    HG3  GLN 665           1HG      GLN 665  12.066  -6.128 -10.635
  174   HE21  GLN 665          1HE2      GLN 665  13.819  -8.809  -9.574
  175   HE22  GLN 665          2HE2      GLN 665  14.597  -8.067  -8.211
  176    H    TYR 666           H        TYR 666   9.908  -5.038  -7.170
  177    HA   TYR 666           HA       TYR 666   7.841  -6.756  -6.004
  178    HB2  TYR 666           2HB      TYR 666   9.858  -4.954  -4.653
  179    HB3  TYR 666           1HB      TYR 666   8.739  -6.041  -3.836
  180    HD1  TYR 666           2HD      TYR 666   8.898  -8.567  -4.875
  181    HD2  TYR 666           1HD      TYR 666  12.027  -5.689  -4.774
  182    HE1  TYR 666           2HE      TYR 666  10.556 -10.376  -4.974
  183    HE2  TYR 666           1HE      TYR 666  13.694  -7.492  -4.877
  184    HH   TYR 666           HH       TYR 666  12.880 -10.710  -5.631
  185    H    LYS 667           H        LYS 667   8.083  -3.769  -7.384
  186    HA   LYS 667           HA       LYS 667   6.661  -2.158  -5.530
  187    HB2  LYS 667           2HB      LYS 667   7.204  -1.889  -8.480
  188    HB3  LYS 667           1HB      LYS 667   6.308  -0.687  -7.567
  189    HG2  LYS 667           2HG      LYS 667   8.471  -0.866  -6.015
  190    HG3  LYS 667           1HG      LYS 667   9.192  -1.310  -7.562
  191    HD2  LYS 667           2HD      LYS 667   8.235   0.761  -8.544
  192    HD3  LYS 667           1HD      LYS 667   7.660   1.215  -6.938
  193    HE2  LYS 667           2HE      LYS 667   9.629   2.215  -6.640
  194    HE3  LYS 667           1HE      LYS 667  10.336   0.601  -6.551
  195    HZ1  LYS 667           3HZ      LYS 667  10.305   2.499  -8.792
  196    HZ2  LYS 667           1HZ      LYS 667  10.352   0.839  -9.128
  197    HZ3  LYS 667           2HZ      LYS 667  11.582   1.550  -8.200
  198    H    MET 668           H        MET 668   4.621  -2.380  -4.981
  199    HA   MET 668           HA       MET 668   2.728  -3.555  -6.896
  200    HB2  MET 668           2HB      MET 668   3.131  -4.286  -4.365
  201    HB3  MET 668           1HB      MET 668   1.983  -2.989  -4.067
  202    HG2  MET 668           2HG      MET 668   0.259  -4.088  -5.120
  203    HG3  MET 668           1HG      MET 668   1.342  -5.078  -6.097
  204    HE1  MET 668           3HE      MET 668   2.576  -4.954  -2.440
  205    HE2  MET 668           1HE      MET 668   0.964  -4.251  -2.301
  206    HE3  MET 668           2HE      MET 668   1.308  -5.812  -1.559
  207    H    ASP 669           H        ASP 669   1.012  -2.397  -7.640
  208    HA   ASP 669           HA       ASP 669   0.987   0.441  -6.932
  209    HB2  ASP 669           2HB      ASP 669   0.558   0.907  -9.087
  210    HB3  ASP 669           1HB      ASP 669   1.032  -0.754  -9.401
  211    H    VAL 670           H        VAL 670  -0.793   1.466  -6.170
  212    HA   VAL 670           HA       VAL 670  -2.921  -0.316  -5.201
  213    HB   VAL 670           HB       VAL 670  -2.501   2.485  -4.199
  214   HG11  VAL 670          1HG1      VAL 670  -4.234   1.891  -2.950
  215   HG12  VAL 670          2HG1      VAL 670  -4.154   0.228  -3.529
  216   HG13  VAL 670          3HG1      VAL 670  -3.185   0.726  -2.142
  217   HG21  VAL 670          3HG2      VAL 670  -1.116   1.393  -2.351
  218   HG22  VAL 670          1HG2      VAL 670  -0.908   0.040  -3.465
  219   HG23  VAL 670          2HG2      VAL 670  -0.323   1.645  -3.906
  220    H    THR 671           H        THR 671  -4.294  -0.340  -6.931
  221    HA   THR 671           HA       THR 671  -5.200   2.164  -8.084
  222    HB   THR 671           HB       THR 671  -6.599  -0.320  -8.832
  223    HG1  THR 671           1HG      THR 671  -3.777   0.010  -9.131
  224   HG21  THR 671          3HG2      THR 671  -6.419   0.567 -11.016
  225   HG22  THR 671          1HG2      THR 671  -5.077   1.615 -10.564
  226   HG23  THR 671          2HG2      THR 671  -6.703   1.957  -9.966
  227    H    VAL 672           H        VAL 672  -6.694   3.293  -7.045
  228    HA   VAL 672           HA       VAL 672  -8.577   1.964  -5.256
  229    HB   VAL 672           HB       VAL 672  -8.746   4.898  -5.738
  230   HG11  VAL 672          1HG1      VAL 672  -9.051   4.894  -3.277
  231   HG12  VAL 672          2HG1      VAL 672 -10.222   3.884  -4.125
  232   HG13  VAL 672          3HG1      VAL 672  -8.857   3.143  -3.288
  233   HG21  VAL 672          3HG2      VAL 672  -6.774   5.506  -4.748
  234   HG22  VAL 672          1HG2      VAL 672  -6.630   3.993  -3.851
  235   HG23  VAL 672          2HG2      VAL 672  -6.244   4.039  -5.572
  236    H    ILE 673           H        ILE 673 -10.730   1.723  -5.646
  237    HA   ILE 673           HA       ILE 673 -11.687   2.670  -8.272
  238    HB   ILE 673           HB       ILE 673 -12.265   0.149  -6.743
  239   HG12  ILE 673          2HG1      ILE 673 -12.066  -0.497  -9.385
  240   HG13  ILE 673          1HG1      ILE 673 -11.009   0.908  -9.305
  241   HG21  ILE 673          1HG2      ILE 673 -13.872   0.599  -9.159
  242   HG22  ILE 673          2HG2      ILE 673 -14.310  -0.158  -7.628
  243   HG23  ILE 673          3HG2      ILE 673 -14.310   1.603  -7.774
  244   HD11  ILE 673          3HD1      ILE 673  -9.404  -0.385  -8.526
  245   HD12  ILE 673          1HD1      ILE 673 -10.378  -0.714  -7.093
  246   HD13  ILE 673          2HD1      ILE 673 -10.496  -1.769  -8.502
  247    H    ASP 674           H        ASP 674 -13.445   3.918  -8.350
  248    HA   ASP 674           HA       ASP 674 -14.672   4.858  -5.931
  249    HB2  ASP 674           2HB      ASP 674 -14.291   6.209  -8.061
  250    HB3  ASP 674           1HB      ASP 674 -15.655   5.336  -8.746
  251    H    THR 675           H        THR 675 -16.276   3.917  -4.889
  252    HA   THR 675           HA       THR 675 -17.567   1.613  -6.093
  253    HB   THR 675           HB       THR 675 -18.328   2.170  -3.353
  254    HG1  THR 675           1HG      THR 675 -16.346   2.304  -2.435
  255   HG21  THR 675          3HG2      THR 675 -18.306  -0.059  -3.354
  256   HG22  THR 675          1HG2      THR 675 -16.576  -0.074  -3.688
  257   HG23  THR 675          2HG2      THR 675 -17.731  -0.021  -5.020
  258    H    LYS 676           H        LYS 676 -18.395   4.576  -6.564
  259    HA   LYS 676           HA       LYS 676 -20.985   4.764  -5.346
  260    HB2  LYS 676           2HB      LYS 676 -19.337   6.610  -6.412
  261    HB3  LYS 676           1HB      LYS 676 -20.435   6.375  -7.768
  262    HG2  LYS 676           2HG      LYS 676 -22.178   6.606  -5.700
  263    HG3  LYS 676           1HG      LYS 676 -20.877   7.686  -5.190
  264    HD2  LYS 676           2HD      LYS 676 -22.038   7.801  -7.958
  265    HD3  LYS 676           1HD      LYS 676 -22.766   8.677  -6.610
  266    HE2  LYS 676           2HE      LYS 676 -20.913  10.056  -6.340
  267    HE3  LYS 676           1HE      LYS 676 -19.848   8.952  -7.207
  268    HZ1  LYS 676           3HZ      LYS 676 -21.818   9.691  -9.000
  269    HZ2  LYS 676           1HZ      LYS 676 -20.191  10.177  -9.003
  270    HZ3  LYS 676           2HZ      LYS 676 -21.356  11.122  -8.213
  271    H    ASP 677           H        ASP 677 -19.779   3.535  -8.401
  272    HA   ASP 677           HA       ASP 677 -22.363   3.562  -9.650
  273    HB2  ASP 677           2HB      ASP 677 -21.318   2.925 -11.615
  274    HB3  ASP 677           1HB      ASP 677 -20.007   3.737 -10.771
  275    H    GLY 678           H        GLY 678 -21.781   1.972  -7.210
  276    HA2  GLY 678           1HA      GLY 678 -22.727  -0.652  -8.186
  277    HA3  GLY 678           2HA      GLY 678 -21.760  -0.448  -6.731
  278    H    SER 679           H        SER 679 -23.248   1.955  -5.909
  279    HA   SER 679           HA       SER 679 -25.350   0.547  -4.509
  280    HB2  SER 679           2HB      SER 679 -25.465   3.180  -3.693
  281    HB3  SER 679           1HB      SER 679 -24.496   1.917  -2.935
  282    HG   SER 679           HG       SER 679 -23.711   4.081  -4.422
  283    H    GLN 680           H        GLN 680 -25.222   2.013  -7.423
  284    HA   GLN 680           HA       GLN 680 -27.603   3.616  -7.315
  285    HB2  GLN 680           2HB      GLN 680 -26.368   2.602  -9.858
  286    HB3  GLN 680           1HB      GLN 680 -27.222   4.111  -9.571
  287    HG2  GLN 680           2HG      GLN 680 -24.650   3.593  -8.163
  288    HG3  GLN 680           1HG      GLN 680 -24.636   4.084  -9.856
  289   HE21  GLN 680          1HE2      GLN 680 -24.721   6.183 -10.284
  290   HE22  GLN 680          2HE2      GLN 680 -25.159   7.427  -9.158
  291    H    SER 681           H        SER 681 -28.806   1.700  -6.335
  292    HA   SER 681           HA       SER 681 -29.787  -0.217  -8.259
  293    HB2  SER 681           2HB      SER 681 -31.457  -0.021  -5.926
  294    HB3  SER 681           1HB      SER 681 -30.392  -1.338  -6.415
  295    HG   SER 681           HG       SER 681 -29.933   0.780  -4.652
  296    H    LYS 682           H        LYS 682 -30.583   2.947  -7.182
  297    HA   LYS 682           HA       LYS 682 -33.315   2.807  -8.188
  298    HB2  LYS 682           2HB      LYS 682 -31.733   4.993  -6.843
  299    HB3  LYS 682           1HB      LYS 682 -33.353   5.242  -7.478
  300    HG2  LYS 682           2HG      LYS 682 -32.974   2.959  -5.641
  301    HG3  LYS 682           1HG      LYS 682 -32.875   4.578  -4.945
  302    HD2  LYS 682           2HD      LYS 682 -35.096   4.795  -5.021
  303    HD3  LYS 682           1HD      LYS 682 -35.118   4.398  -6.742
  304    HE2  LYS 682           2HE      LYS 682 -35.186   2.050  -6.250
  305    HE3  LYS 682           1HE      LYS 682 -34.986   2.364  -4.526
  306    HZ1  LYS 682           3HZ      LYS 682 -37.129   3.448  -4.488
  307    HZ2  LYS 682           1HZ      LYS 682 -37.294   1.882  -5.123
  308    HZ3  LYS 682           2HZ      LYS 682 -37.318   3.229  -6.157
  309    H    LEU 683           H        LEU 683 -30.190   4.117  -9.054
  310    HA   LEU 683           HA       LEU 683 -31.154   5.699 -11.228
  311    HB2  LEU 683           2HB      LEU 683 -28.645   5.231  -9.943
  312    HB3  LEU 683           1HB      LEU 683 -28.445   5.001 -11.673
  313    HG   LEU 683           HG       LEU 683 -29.971   7.398 -11.123
  314   HD11  LEU 683          1HD1      LEU 683 -28.844   8.378  -9.488
  315   HD12  LEU 683          2HD1      LEU 683 -27.937   6.884  -9.243
  316   HD13  LEU 683          3HD1      LEU 683 -27.324   8.115 -10.346
  317   HD21  LEU 683          3HD2      LEU 683 -28.869   8.094 -12.937
  318   HD22  LEU 683          1HD2      LEU 683 -27.300   7.653 -12.265
  319   HD23  LEU 683          2HD2      LEU 683 -28.294   6.431 -13.060
  320    H    GLY 684           H        GLY 684 -31.787   5.037 -13.135
  321    HA2  GLY 684           1HA      GLY 684 -31.462   3.608 -15.092
  322    HA3  GLY 684           2HA      GLY 684 -31.032   2.306 -13.984
  323    H    GLY 685           H        GLY 685 -33.326   3.730 -12.343
  324    HA2  GLY 685           1HA      GLY 685 -35.587   2.563 -13.818
  325    HA3  GLY 685           2HA      GLY 685 -35.330   2.162 -12.124
  326    H    GLY 901           H        GLY 901 -35.029   5.232 -13.876
  327    HA2  GLY 901           1HA      GLY 901 -36.396   6.616 -11.739
  328    HA3  GLY 901           2HA      GLY 901 -35.723   7.341 -13.192
  329    H    GLY 902           H        GLY 902 -38.326   5.101 -12.286
  330    HA2  GLY 902           1HA      GLY 902 -40.542   6.479 -12.904
  331    HA3  GLY 902           2HA      GLY 902 -39.963   6.004 -14.497
  332    H    SER 903           H        SER 903 -42.054   4.825 -14.546
  333    HA   SER 903           HA       SER 903 -42.175   2.449 -12.890
  334    HB2  SER 903           2HB      SER 903 -44.048   3.061 -15.164
  335    HB3  SER 903           1HB      SER 903 -44.370   2.172 -13.674
  336    HG   SER 903           HG       SER 903 -44.209   4.941 -14.111
  337    H    GLY 904           H        GLY 904 -40.862   0.831 -13.430
  338    HA2  GLY 904           1HA      GLY 904 -40.759  -1.105 -14.939
  339    HA3  GLY 904           2HA      GLY 904 -40.794   0.035 -16.277
  340    H    GLY 905           H        GLY 905 -38.905   0.031 -13.269
  341    HA2  GLY 905           1HA      GLY 905 -36.477  -0.524 -14.797
  342    HA3  GLY 905           2HA      GLY 905 -36.573   1.045 -14.011
  343    H    HIS 906           H        HIS 906 -37.967  -1.868 -12.650
  344    HA   HIS 906           HA       HIS 906 -36.359  -1.507 -10.268
  345    HB2  HIS 906           2HB      HIS 906 -38.843  -2.110 -10.277
  346    HB3  HIS 906           1HB      HIS 906 -38.346  -3.725 -10.773
  347    HD1  HIS 906           1HD      HIS 906 -38.993  -1.760  -7.794
  348    HD2  HIS 906           2HD      HIS 906 -36.530  -4.948  -8.816
  349    HE1  HIS 906           1HE      HIS 906 -38.295  -2.843  -5.620
  350    H    MET 907           H        MET 907 -34.338  -1.958 -11.354
  351    HA   MET 907           HA       MET 907 -33.832  -4.738 -12.045
  352    HB2  MET 907           2HB      MET 907 -32.601  -2.197 -12.631
  353    HB3  MET 907           1HB      MET 907 -31.404  -3.305 -11.973
  354    HG2  MET 907           2HG      MET 907 -31.289  -3.662 -14.258
  355    HG3  MET 907           1HG      MET 907 -32.295  -4.989 -13.680
  356    HE1  MET 907           3HE      MET 907 -31.846  -1.996 -15.818
  357    HE2  MET 907           1HE      MET 907 -33.426  -1.598 -16.490
  358    HE3  MET 907           2HE      MET 907 -33.021  -1.112 -14.843
  359    H    GLY 908           H        GLY 908 -33.091  -2.402  -9.536
  360    HA2  GLY 908           1HA      GLY 908 -32.557  -2.738  -7.329
  361    HA3  GLY 908           2HA      GLY 908 -32.793  -4.458  -7.588
  362    H    SER 909           H        SER 909 -30.892  -4.097  -5.938
  363    HA   SER 909           HA       SER 909 -28.354  -3.944  -7.385
  364    HB2  SER 909           2HB      SER 909 -28.113  -4.440  -4.532
  365    HB3  SER 909           1HB      SER 909 -27.496  -3.092  -5.489
  366    HG   SER 909           HG       SER 909 -29.126  -1.907  -4.868
  367    H    GLY 910           H        GLY 910 -28.255  -5.898  -8.442
  368    HA2  GLY 910           1HA      GLY 910 -28.841  -8.399  -7.205
  369    HA3  GLY 910           2HA      GLY 910 -27.973  -8.168  -8.717
  370    H    GLY 911           H        GLY 911 -25.902  -6.519  -7.659
  371    HA2  GLY 911           1HA      GLY 911 -24.268  -8.567  -6.398
  372    HA3  GLY 911           2HA      GLY 911 -23.718  -7.003  -6.983
  373    H    LEU  18           H        LEU  18 -25.913  -8.304  -4.491
  374    HA   LEU  18           HA       LEU  18 -25.504  -6.035  -2.782
  375    HB2  LEU  18           2HB      LEU  18 -27.125  -8.485  -2.748
  376    HB3  LEU  18           1HB      LEU  18 -26.603  -7.942  -1.163
  377    HG   LEU  18           HG       LEU  18 -28.260  -6.398  -3.161
  378   HD11  LEU  18          1HD1      LEU  18 -29.314  -6.587  -0.503
  379   HD12  LEU  18          2HD1      LEU  18 -30.015  -7.132  -2.026
  380   HD13  LEU  18          3HD1      LEU  18 -28.940  -8.196  -1.119
  381   HD21  LEU  18          3HD2      LEU  18 -28.156  -4.504  -1.810
  382   HD22  LEU  18          1HD2      LEU  18 -27.498  -5.396  -0.439
  383   HD23  LEU  18          2HD2      LEU  18 -26.487  -5.071  -1.848
  384    H    SER  19           H        SER  19 -23.620  -8.653  -3.489
  385    HA   SER  19           HA       SER  19 -22.369  -8.833  -0.863
  386    HB2  SER  19           2HB      SER  19 -20.836 -10.271  -2.711
  387    HB3  SER  19           1HB      SER  19 -22.040 -10.937  -1.604
  388    HG   SER  19           HG       SER  19 -22.137 -10.985  -4.204
  389    H    TRP  20           H        TRP  20 -22.344  -6.802  -3.384
  390    HA   TRP  20           HA       TRP  20 -20.950  -5.267  -4.292
  391    HB2  TRP  20           2HB      TRP  20 -19.295  -5.293  -1.794
  392    HB3  TRP  20           1HB      TRP  20 -19.801  -3.926  -2.780
  393    HD1  TRP  20           HD       TRP  20 -22.866  -4.045  -2.729
  394    HE1  TRP  20           1HE      TRP  20 -24.197  -3.808  -0.539
  395    HE3  TRP  20           3HE      TRP  20 -19.207  -5.345   0.583
  396    HZ2  TRP  20           2HZ      TRP  20 -23.754  -4.121   2.223
  397    HZ3  TRP  20           3HZ      TRP  20 -19.737  -5.349   2.987
  398    HH2  TRP  20           HH       TRP  20 -21.964  -4.751   3.790
  399    H    LYS  21           H        LYS  21 -18.116  -5.741  -2.580
  400    HA   LYS  21           HA       LYS  21 -17.014  -7.425  -4.715
  401    HB2  LYS  21           2HB      LYS  21 -15.574  -5.147  -3.340
  402    HB3  LYS  21           1HB      LYS  21 -14.948  -6.143  -4.645
  403    HG2  LYS  21           2HG      LYS  21 -17.412  -4.460  -4.979
  404    HG3  LYS  21           1HG      LYS  21 -15.791  -3.818  -5.243
  405    HD2  LYS  21           2HD      LYS  21 -15.415  -5.679  -6.879
  406    HD3  LYS  21           1HD      LYS  21 -17.118  -6.100  -6.703
  407    HE2  LYS  21           2HE      LYS  21 -17.839  -4.236  -7.815
  408    HE3  LYS  21           1HE      LYS  21 -16.430  -3.283  -7.356
  409    HZ1  LYS  21           3HZ      LYS  21 -16.879  -4.826  -9.713
  410    HZ2  LYS  21           1HZ      LYS  21 -15.433  -5.287  -8.949
  411    HZ3  LYS  21           2HZ      LYS  21 -15.679  -3.669  -9.398
  412    H    ARG  22           H        ARG  22 -15.861  -9.143  -4.080
  413    HA   ARG  22           HA       ARG  22 -15.887  -9.811  -1.282
  414    HB2  ARG  22           2HB      ARG  22 -15.763 -11.214  -3.774
  415    HB3  ARG  22           1HB      ARG  22 -14.422 -11.735  -2.765
  416    HG2  ARG  22           2HG      ARG  22 -17.325 -11.753  -1.970
  417    HG3  ARG  22           1HG      ARG  22 -16.381 -13.154  -2.473
  418    HD2  ARG  22           2HD      ARG  22 -15.047 -11.720  -0.357
  419    HD3  ARG  22           1HD      ARG  22 -16.688 -12.153   0.117
  420    HE   ARG  22           HE       ARG  22 -14.474 -13.958  -0.424
  421   HH11  ARG  22          2HH1      ARG  22 -17.916 -13.601   0.115
  422   HH12  ARG  22          1HH1      ARG  22 -18.160 -15.263   0.549
  423   HH21  ARG  22          2HH2      ARG  22 -14.782 -16.145   0.162
  424   HH22  ARG  22          1HH2      ARG  22 -16.367 -16.704   0.617
  425    H    CYS  23           H        CYS  23 -14.279  -9.551   0.119
  426    HA   CYS  23           HA       CYS  23 -11.740  -8.512  -0.767
  427    HB2  CYS  23           2HB      CYS  23 -12.727  -7.586   1.242
  428    HB3  CYS  23           1HB      CYS  23 -12.810  -9.181   1.984
  429    H    ALA  24           H        ALA  24  -9.716  -9.453  -0.265
  430    HA   ALA  24           HA       ALA  24  -9.802 -12.397  -0.165
  431    HB1  ALA  24           1HB      ALA  24  -8.692 -11.804  -2.122
  432    HB2  ALA  24           2HB      ALA  24  -7.855 -10.453  -1.356
  433    HB3  ALA  24           3HB      ALA  24  -7.376 -12.110  -0.990
  434    H    GLY  25           H        GLY  25  -9.335  -9.782   1.763
  435    HA2  GLY  25           1HA      GLY  25  -7.031 -10.793   3.236
  436    HA3  GLY  25           2HA      GLY  25  -7.875  -9.277   3.520
  437    H    CYS  26           H        CYS  26 -10.426  -9.938   4.009
  438    HA   CYS  26           HA       CYS  26 -10.105 -11.407   6.515
  439    HB2  CYS  26           2HB      CYS  26 -12.382 -10.363   7.055
  440    HB3  CYS  26           1HB      CYS  26 -10.991  -9.291   6.995
  441    H    GLY  27           H        GLY  27 -11.720 -11.533   3.471
  442    HA2  GLY  27           1HA      GLY  27 -12.517 -13.584   2.575
  443    HA3  GLY  27           2HA      GLY  27 -12.775 -14.166   4.215
  444    H    GLY  28           H        GLY  28 -13.860 -11.074   4.155
  445    HA2  GLY  28           1HA      GLY  28 -16.614 -11.940   3.570
  446    HA3  GLY  28           2HA      GLY  28 -16.171 -10.574   4.589
  447    H    LYS  29           H        LYS  29 -17.672  -9.353   3.238
  448    HA   LYS  29           HA       LYS  29 -16.574  -8.691   0.604
  449    HB2  LYS  29           2HB      LYS  29 -18.813  -7.221   0.685
  450    HB3  LYS  29           1HB      LYS  29 -18.790  -8.895   0.150
  451    HG2  LYS  29           2HG      LYS  29 -19.320  -9.489   2.581
  452    HG3  LYS  29           1HG      LYS  29 -19.717  -7.776   2.770
  453    HD2  LYS  29           2HD      LYS  29 -21.171  -8.165   0.645
  454    HD3  LYS  29           1HD      LYS  29 -21.052  -9.869   1.094
  455    HE2  LYS  29           2HE      LYS  29 -22.224  -7.601   2.690
  456    HE3  LYS  29           1HE      LYS  29 -23.045  -9.033   2.070
  457    HZ1  LYS  29           3HZ      LYS  29 -21.592  -8.687   4.504
  458    HZ2  LYS  29           1HZ      LYS  29 -21.036 -10.026   3.630
  459    HZ3  LYS  29           2HZ      LYS  29 -22.671  -9.921   4.057
  460    H    ILE  30           H        ILE  30 -16.194  -6.487   0.042
  461    HA   ILE  30           HA       ILE  30 -14.884  -5.060   2.108
  462    HB   ILE  30           HB       ILE  30 -15.587  -4.297  -0.727
  463   HG12  ILE  30          2HG1      ILE  30 -12.816  -4.649   0.331
  464   HG13  ILE  30          1HG1      ILE  30 -13.788  -6.085   0.037
  465   HG21  ILE  30          1HG2      ILE  30 -15.411  -2.324   0.875
  466   HG22  ILE  30          2HG2      ILE  30 -13.707  -2.752   1.038
  467   HG23  ILE  30          3HG2      ILE  30 -14.360  -2.304  -0.539
  468   HD11  ILE  30          3HD1      ILE  30 -12.523  -4.241  -1.855
  469   HD12  ILE  30          1HD1      ILE  30 -12.891  -5.958  -2.008
  470   HD13  ILE  30          2HD1      ILE  30 -14.153  -4.758  -2.284
  471    H    ALA  31           H        ALA  31 -15.988  -4.164   3.702
  472    HA   ALA  31           HA       ALA  31 -18.479  -2.727   3.121
  473    HB1  ALA  31           1HB      ALA  31 -19.191  -3.192   5.239
  474    HB2  ALA  31           2HB      ALA  31 -18.126  -4.575   4.984
  475    HB3  ALA  31           3HB      ALA  31 -17.559  -3.185   5.911
  476    H    ASP  32           H        ASP  32 -15.729  -1.767   2.590
  477    HA   ASP  32           HA       ASP  32 -15.405   0.429   4.478
  478    HB2  ASP  32           2HB      ASP  32 -13.583  -1.046   3.115
  479    HB3  ASP  32           1HB      ASP  32 -13.753   0.325   2.022
  480    H    ARG  33           H        ARG  33 -14.569   2.494   2.971
  481    HA   ARG  33           HA       ARG  33 -16.916   3.302   1.470
  482    HB2  ARG  33           2HB      ARG  33 -15.748   4.948   2.904
  483    HB3  ARG  33           1HB      ARG  33 -14.294   4.751   1.933
  484    HG2  ARG  33           2HG      ARG  33 -15.017   6.495   0.772
  485    HG3  ARG  33           1HG      ARG  33 -16.174   5.378   0.048
  486    HD2  ARG  33           2HD      ARG  33 -17.336   6.148   2.460
  487    HD3  ARG  33           1HD      ARG  33 -16.620   7.622   1.804
  488    HE   ARG  33           HE       ARG  33 -17.971   7.366  -0.155
  489   HH11  ARG  33          2HH1      ARG  33 -18.807   5.267   2.516
  490   HH12  ARG  33          1HH1      ARG  33 -20.363   4.843   1.873
  491   HH21  ARG  33          2HH2      ARG  33 -20.017   6.815  -1.021
  492   HH22  ARG  33          1HH2      ARG  33 -21.055   5.719  -0.145
  493    H    PHE  34           H        PHE  34 -13.457   3.472   0.696
  494    HA   PHE  34           HA       PHE  34 -14.114   2.795  -2.071
  495    HB2  PHE  34           2HB      PHE  34 -12.073   4.497  -0.780
  496    HB3  PHE  34           1HB      PHE  34 -11.522   3.579  -2.180
  497    HD1  PHE  34           2HD      PHE  34 -14.487   5.594  -1.160
  498    HD2  PHE  34           1HD      PHE  34 -11.669   4.634  -4.201
  499    HE1  PHE  34           2HE      PHE  34 -15.544   7.227  -2.650
  500    HE2  PHE  34           1HE      PHE  34 -12.730   6.263  -5.705
  501    HZ   PHE  34           HZ       PHE  34 -14.669   7.557  -4.937
  502    H    LEU  35           H        LEU  35 -13.143   1.089  -3.115
  503    HA   LEU  35           HA       LEU  35 -11.603  -0.732  -1.412
  504    HB2  LEU  35           2HB      LEU  35 -12.113  -2.471  -2.983
  505    HB3  LEU  35           1HB      LEU  35 -13.593  -1.658  -2.523
  506    HG   LEU  35           HG       LEU  35 -12.787  -0.331  -4.836
  507   HD11  LEU  35          1HD1      LEU  35 -11.941  -3.166  -4.858
  508   HD12  LEU  35          2HD1      LEU  35 -12.798  -2.579  -6.282
  509   HD13  LEU  35          3HD1      LEU  35 -11.312  -1.785  -5.756
  510   HD21  LEU  35          3HD2      LEU  35 -15.006  -0.621  -4.849
  511   HD22  LEU  35          1HD2      LEU  35 -14.652  -2.140  -5.676
  512   HD23  LEU  35          2HD2      LEU  35 -14.910  -2.125  -3.930
  513    H    LEU  36           H        LEU  36  -9.661  -1.671  -2.191
  514    HA   LEU  36           HA       LEU  36  -8.311   0.011  -4.194
  515    HB2  LEU  36           2HB      LEU  36  -6.986  -1.078  -1.715
  516    HB3  LEU  36           1HB      LEU  36  -6.329   0.076  -2.860
  517    HG   LEU  36           HG       LEU  36  -8.706   1.223  -1.857
  518   HD11  LEU  36          1HD1      LEU  36  -7.824  -0.617   0.005
  519   HD12  LEU  36          2HD1      LEU  36  -7.132   0.908   0.556
  520   HD13  LEU  36          3HD1      LEU  36  -8.872   0.769   0.313
  521   HD21  LEU  36          3HD2      LEU  36  -5.958   1.850  -2.227
  522   HD22  LEU  36          1HD2      LEU  36  -7.318   2.949  -1.987
  523   HD23  LEU  36          2HD2      LEU  36  -6.424   2.340  -0.594
  524    H    TYR  37           H        TYR  37  -6.370  -0.983  -5.113
  525    HA   TYR  37           HA       TYR  37  -6.637  -3.903  -5.353
  526    HB2  TYR  37           2HB      TYR  37  -6.248  -1.759  -7.297
  527    HB3  TYR  37           1HB      TYR  37  -5.045  -3.033  -7.457
  528    HD1  TYR  37           1HD      TYR  37  -6.404  -5.491  -7.025
  529    HD2  TYR  37           2HD      TYR  37  -7.882  -1.967  -8.888
  530    HE1  TYR  37           1HE      TYR  37  -8.021  -6.844  -8.287
  531    HE2  TYR  37           2HE      TYR  37  -9.503  -3.309 -10.157
  532    HH   TYR  37           HH       TYR  37  -9.279  -6.598 -10.513
  533    H    ALA  38           H        ALA  38  -4.778  -5.164  -5.303
  534    HA   ALA  38           HA       ALA  38  -2.201  -3.856  -4.901
  535    HB1  ALA  38           1HB      ALA  38  -3.626  -5.424  -2.849
  536    HB2  ALA  38           2HB      ALA  38  -1.927  -5.833  -3.081
  537    HB3  ALA  38           3HB      ALA  38  -2.388  -4.180  -2.674
  538    H    MET  39           H        MET  39  -2.555  -7.211  -4.098
  539    HA   MET  39           HA       MET  39  -1.167  -7.953  -6.524
  540    HB2  MET  39           2HB      MET  39  -1.359 -10.311  -5.519
  541    HB3  MET  39           1HB      MET  39  -0.349  -9.144  -4.679
  542    HG2  MET  39           2HG      MET  39  -2.617  -8.724  -3.357
  543    HG3  MET  39           1HG      MET  39  -2.905 -10.390  -3.859
  544    HE1  MET  39           3HE      MET  39   0.197  -8.238  -2.480
  545    HE2  MET  39           1HE      MET  39  -1.230  -8.011  -1.468
  546    HE3  MET  39           2HE      MET  39   0.173  -8.870  -0.833
  547    H    ASP  40           H        ASP  40  -3.358  -6.916  -7.357
  548    HA   ASP  40           HA       ASP  40  -5.210  -7.126  -8.620
  549    HB2  ASP  40           2HB      ASP  40  -3.396  -9.036  -9.472
  550    HB3  ASP  40           1HB      ASP  40  -4.917  -9.918  -9.358
  551    H    SER  41           H        SER  41  -5.427  -8.002  -5.767
  552    HA   SER  41           HA       SER  41  -7.962  -9.457  -6.096
  553    HB2  SER  41           2HB      SER  41  -7.007  -9.108  -3.350
  554    HB3  SER  41           1HB      SER  41  -7.511 -10.580  -4.183
  555    HG   SER  41           HG       SER  41  -5.364 -10.376  -5.275
  556    H    TYR  42           H        TYR  42  -9.664  -8.705  -4.427
  557    HA   TYR  42           HA       TYR  42  -9.821  -5.799  -4.548
  558    HB2  TYR  42           2HB      TYR  42 -11.745  -7.986  -3.806
  559    HB3  TYR  42           1HB      TYR  42 -12.097  -6.311  -3.413
  560    HD1  TYR  42           2HD      TYR  42 -10.912  -5.098  -5.972
  561    HD2  TYR  42           1HD      TYR  42 -13.517  -8.392  -5.288
  562    HE1  TYR  42           2HE      TYR  42 -11.912  -4.765  -8.196
  563    HE2  TYR  42           1HE      TYR  42 -14.523  -8.069  -7.505
  564    HH   TYR  42           HH       TYR  42 -13.394  -6.765  -9.876
  565    H    TRP  43           H        TRP  43  -9.503  -4.463  -2.821
  566    HA   TRP  43           HA       TRP  43  -9.343  -5.683  -0.149
  567    HB2  TRP  43           2HB      TRP  43  -7.375  -3.597  -1.078
  568    HB3  TRP  43           1HB      TRP  43  -7.313  -4.568   0.386
  569    HD1  TRP  43           HD       TRP  43  -6.658  -4.789  -3.378
  570    HE1  TRP  43           1HE      TRP  43  -5.183  -6.843  -3.829
  571    HE3  TRP  43           3HE      TRP  43  -6.623  -6.813   1.308
  572    HZ2  TRP  43           2HZ      TRP  43  -4.130  -9.022  -2.401
  573    HZ3  TRP  43           3HZ      TRP  43  -5.351  -8.889   1.683
  574    HH2  TRP  43           HH       TRP  43  -4.129  -9.967  -0.144
  575    H    HIS  44           H        HIS  44  -9.376  -4.112   1.583
  576    HA   HIS  44           HA       HIS  44 -10.397  -1.449   0.943
  577    HB2  HIS  44           2HB      HIS  44 -11.977  -1.628   2.919
  578    HB3  HIS  44           1HB      HIS  44 -12.442  -2.588   1.523
  579    HD1  HIS  44           1HD      HIS  44 -12.866  -3.000   4.883
  580    HD2  HIS  44           2HD      HIS  44 -10.756  -5.246   2.086
  581    HE1  HIS  44           1HE      HIS  44 -12.598  -5.339   5.871
  582    H    SER  45           H        SER  45 -10.272  -0.097   3.101
  583    HA   SER  45           HA       SER  45  -7.574   0.120   3.645
  584    HB2  SER  45           2HB      SER  45  -9.456   1.143   5.703
  585    HB3  SER  45           1HB      SER  45  -8.140   1.965   4.864
  586    HG   SER  45           HG       SER  45 -10.809   1.634   4.118
  587    H    ARG  46           H        ARG  46  -9.930  -1.832   5.353
  588    HA   ARG  46           HA       ARG  46  -8.431  -2.115   7.747
  589    HB2  ARG  46           2HB      ARG  46 -10.943  -3.061   6.713
  590    HB3  ARG  46           1HB      ARG  46 -10.069  -4.383   7.475
  591    HG2  ARG  46           2HG      ARG  46 -10.838  -1.754   8.727
  592    HG3  ARG  46           1HG      ARG  46 -11.487  -3.352   9.103
  593    HD2  ARG  46           2HD      ARG  46  -9.916  -3.577  10.664
  594    HD3  ARG  46           1HD      ARG  46  -8.697  -3.551   9.390
  595    HE   ARG  46           HE       ARG  46  -9.140  -0.933   9.790
  596   HH11  ARG  46          2HH1      ARG  46  -8.526  -3.543  12.054
  597   HH12  ARG  46          1HH1      ARG  46  -7.710  -2.516  13.201
  598   HH21  ARG  46          2HH2      ARG  46  -8.080   0.401  11.275
  599   HH22  ARG  46          1HH2      ARG  46  -7.475  -0.267  12.762
  600    H    CYS  47           H        CYS  47  -8.636  -4.093   4.795
  601    HA   CYS  47           HA       CYS  47  -6.669  -5.927   5.949
  602    HB2  CYS  47           2HB      CYS  47  -8.410  -6.133   3.504
  603    HB3  CYS  47           1HB      CYS  47  -7.148  -7.298   3.888
  604    H    LEU  48           H        LEU  48  -7.063  -3.581   3.384
  605    HA   LEU  48           HA       LEU  48  -4.557  -4.194   2.126
  606    HB2  LEU  48           2HB      LEU  48  -6.718  -2.946   1.213
  607    HB3  LEU  48           1HB      LEU  48  -5.863  -1.533   1.801
  608    HG   LEU  48           HG       LEU  48  -5.615  -2.581  -0.698
  609   HD11  LEU  48          1HD1      LEU  48  -3.160  -1.316  -0.032
  610   HD12  LEU  48          2HD1      LEU  48  -4.555  -0.653  -0.885
  611   HD13  LEU  48          3HD1      LEU  48  -4.462  -0.544   0.872
  612   HD21  LEU  48          3HD2      LEU  48  -4.462  -4.570  -0.023
  613   HD22  LEU  48          1HD2      LEU  48  -3.301  -3.501  -0.813
  614   HD23  LEU  48          2HD2      LEU  48  -3.322  -3.638   0.946
  615    H    LYS  49           H        LYS  49  -3.519  -4.192   4.267
  616    HA   LYS  49           HA       LYS  49  -2.130  -1.652   4.624
  617    HB2  LYS  49           2HB      LYS  49  -2.219  -2.268   7.194
  618    HB3  LYS  49           1HB      LYS  49  -3.511  -1.333   6.461
  619    HG2  LYS  49           2HG      LYS  49  -4.812  -2.839   7.509
  620    HG3  LYS  49           1HG      LYS  49  -4.469  -3.811   6.077
  621    HD2  LYS  49           2HD      LYS  49  -2.319  -4.362   7.683
  622    HD3  LYS  49           1HD      LYS  49  -3.631  -4.189   8.853
  623    HE2  LYS  49           2HE      LYS  49  -3.726  -6.440   8.309
  624    HE3  LYS  49           1HE      LYS  49  -4.947  -5.733   7.252
  625    HZ1  LYS  49           3HZ      LYS  49  -3.828  -6.372   5.461
  626    HZ2  LYS  49           1HZ      LYS  49  -2.865  -7.323   6.483
  627    HZ3  LYS  49           2HZ      LYS  49  -2.358  -5.766   6.041
  628    H    CYS  50           H        CYS  50  -0.169  -1.970   5.899
  629    HA   CYS  50           HA       CYS  50   1.382  -4.166   5.127
  630    HB2  CYS  50           2HB      CYS  50   2.243  -1.963   5.797
  631    HB3  CYS  50           1HB      CYS  50   1.699  -2.250   7.440
  632    H    SER  51           H        SER  51   1.689  -6.135   6.030
  633    HA   SER  51           HA       SER  51  -0.030  -6.934   8.198
  634    HB2  SER  51           2HB      SER  51   2.138  -8.703   7.125
  635    HB3  SER  51           1HB      SER  51   0.499  -9.122   7.621
  636    HG   SER  51           HG       SER  51   1.307  -7.784   5.247
  637    H    SER  52           H        SER  52   2.953  -5.461   8.054
  638    HA   SER  52           HA       SER  52   4.032  -6.870  10.368
  639    HB2  SER  52           2HB      SER  52   5.754  -4.778   9.411
  640    HB3  SER  52           1HB      SER  52   6.019  -6.520   9.422
  641    HG   SER  52           HG       SER  52   4.686  -4.993   7.424
  642    H    CYS  53           H        CYS  53   3.210  -3.506   9.400
  643    HA   CYS  53           HA       CYS  53   3.341  -2.866  12.267
  644    HB2  CYS  53           2HB      CYS  53   3.600  -0.499  11.646
  645    HB3  CYS  53           1HB      CYS  53   4.888  -1.498  10.994
  646    H    GLN  54           H        GLN  54   1.252  -3.301   9.666
  647    HA   GLN  54           HA       GLN  54  -0.993  -3.378   9.541
  648    HB2  GLN  54           2HB      GLN  54  -0.469  -3.419  12.364
  649    HB3  GLN  54           1HB      GLN  54  -1.947  -2.522  12.044
  650    HG2  GLN  54           2HG      GLN  54  -1.750  -5.004  10.534
  651    HG3  GLN  54           1HG      GLN  54  -1.742  -5.238  12.280
  652   HE21  GLN  54          1HE2      GLN  54  -3.354  -2.546  10.761
  653   HE22  GLN  54          2HE2      GLN  54  -4.969  -3.071  11.105
  654    H    ALA  55           H        ALA  55   0.604  -0.807   9.281
  655    HA   ALA  55           HA       ALA  55  -1.260   1.280   9.868
  656    HB1  ALA  55           1HB      ALA  55   0.540   2.515   9.450
  657    HB2  ALA  55           2HB      ALA  55   1.403   1.093   8.864
  658    HB3  ALA  55           3HB      ALA  55   0.449   2.068   7.746
  659    H    GLN  56           H        GLN  56  -2.991   1.894   8.743
  660    HA   GLN  56           HA       GLN  56  -4.062   0.356   6.679
  661    HB2  GLN  56           2HB      GLN  56  -4.697   2.896   8.037
  662    HB3  GLN  56           1HB      GLN  56  -5.394   2.705   6.436
  663    HG2  GLN  56           2HG      GLN  56  -6.812   1.968   8.383
  664    HG3  GLN  56           1HG      GLN  56  -6.611   0.817   7.068
  665   HE21  GLN  56          1HE2      GLN  56  -6.193  -1.179   7.634
  666   HE22  GLN  56          2HE2      GLN  56  -5.467  -1.683   9.122
  667    H    LEU  57           H        LEU  57  -2.861   0.124   4.854
  668    HA   LEU  57           HA       LEU  57  -1.305   2.146   3.658
  669    HB2  LEU  57           2HB      LEU  57  -2.127  -0.607   3.063
  670    HB3  LEU  57           1HB      LEU  57  -1.862   0.368   1.633
  671    HG   LEU  57           HG       LEU  57   0.398   0.551   2.007
  672   HD11  LEU  57          1HD1      LEU  57   0.349   1.503   4.222
  673   HD12  LEU  57          2HD1      LEU  57  -0.062  -0.066   4.913
  674   HD13  LEU  57          3HD1      LEU  57   1.515   0.180   4.161
  675   HD21  LEU  57          3HD2      LEU  57   1.106  -1.746   3.032
  676   HD22  LEU  57          1HD2      LEU  57  -0.624  -2.071   2.938
  677   HD23  LEU  57          2HD2      LEU  57   0.276  -1.661   1.480
  678    H    GLY  58           H        GLY  58  -4.646   1.356   3.471
  679    HA2  GLY  58           1HA      GLY  58  -5.192   2.529   0.928
  680    HA3  GLY  58           2HA      GLY  58  -6.375   2.103   2.154
  681    H    ASP  59           H        ASP  59  -4.938   3.788   4.174
  682    HA   ASP  59           HA       ASP  59  -6.288   6.258   3.416
  683    HB2  ASP  59           2HB      ASP  59  -6.551   5.014   5.693
  684    HB3  ASP  59           1HB      ASP  59  -5.025   5.795   6.094
  685    H    ILE  60           H        ILE  60  -3.424   5.127   2.834
  686    HA   ILE  60           HA       ILE  60  -2.062   7.696   3.260
  687    HB   ILE  60           HB       ILE  60  -0.684   5.024   3.038
  688   HG12  ILE  60          2HG1      ILE  60  -0.957   6.612   5.582
  689   HG13  ILE  60          1HG1      ILE  60  -2.155   5.404   5.123
  690   HG21  ILE  60          1HG2      ILE  60   0.229   7.824   3.569
  691   HG22  ILE  60          2HG2      ILE  60   1.181   6.437   4.097
  692   HG23  ILE  60          3HG2      ILE  60   0.824   6.664   2.383
  693   HD11  ILE  60          3HD1      ILE  60   0.038   4.906   6.619
  694   HD12  ILE  60          1HD1      ILE  60  -0.823   3.695   5.668
  695   HD13  ILE  60          2HD1      ILE  60   0.619   4.472   5.012
  696    H    GLY  61           H        GLY  61  -2.057   4.806   1.276
  697    HA2  GLY  61           1HA      GLY  61  -2.184   4.738  -1.088
  698    HA3  GLY  61           2HA      GLY  61  -1.764   6.447  -1.131
  699    H    THR  62           H        THR  62   0.003   4.333   0.912
  700    HA   THR  62           HA       THR  62   2.476   4.989  -0.309
  701    HB   THR  62           HB       THR  62   2.803   2.739   1.386
  702    HG1  THR  62           1HG      THR  62   1.661   3.789   3.264
  703   HG21  THR  62          3HG2      THR  62   4.185   4.884   1.094
  704   HG22  THR  62          1HG2      THR  62   4.046   4.219   2.722
  705   HG23  THR  62          2HG2      THR  62   3.065   5.606   2.249
  706    H    SER  63           H        SER  63   3.479   4.011  -1.942
  707    HA   SER  63           HA       SER  63   2.526   1.740  -3.277
  708    HB2  SER  63           2HB      SER  63   5.383   2.151  -3.611
  709    HB3  SER  63           1HB      SER  63   4.079   2.379  -4.779
  710    HG   SER  63           HG       SER  63   4.423   4.430  -4.515
  711    H    SER  64           H        SER  64   2.254  -0.042  -2.044
  712    HA   SER  64           HA       SER  64   4.157  -0.847  -0.062
  713    HB2  SER  64           2HB      SER  64   2.277  -2.914  -0.701
  714    HB3  SER  64           1HB      SER  64   2.356  -1.903   0.743
  715    HG   SER  64           HG       SER  64   1.196  -0.291  -0.467
  716    H    TYR  65           H        TYR  65   4.974  -3.137  -0.034
  717    HA   TYR  65           HA       TYR  65   5.815  -3.926  -2.744
  718    HB2  TYR  65           2HB      TYR  65   7.453  -3.765  -0.213
  719    HB3  TYR  65           1HB      TYR  65   7.966  -4.694  -1.619
  720    HD1  TYR  65           1HD      TYR  65   8.576  -3.552  -3.704
  721    HD2  TYR  65           2HD      TYR  65   7.532  -1.369  -0.212
  722    HE1  TYR  65           1HE      TYR  65   9.567  -1.526  -4.686
  723    HE2  TYR  65           2HE      TYR  65   8.509   0.666  -1.180
  724    HH   TYR  65           HH       TYR  65   9.333   1.608  -3.059
  725    H    THR  66           H        THR  66   6.229  -6.167  -3.043
  726    HA   THR  66           HA       THR  66   5.229  -7.931  -0.933
  727    HB   THR  66           HB       THR  66   3.377  -7.504  -2.537
  728    HG1  THR  66           1HG      THR  66   3.040  -9.823  -2.992
  729   HG21  THR  66          3HG2      THR  66   4.072  -9.102  -4.716
  730   HG22  THR  66          1HG2      THR  66   5.456  -8.038  -4.467
  731   HG23  THR  66          2HG2      THR  66   3.849  -7.352  -4.712
  732    H    LYS  67           H        LYS  67   5.805 -10.208  -1.365
  733    HA   LYS  67           HA       LYS  67   7.885 -10.793  -3.241
  734    HB2  LYS  67           2HB      LYS  67   8.927  -9.535  -1.188
  735    HB3  LYS  67           1HB      LYS  67   8.713 -11.078  -0.371
  736    HG2  LYS  67           2HG      LYS  67  10.055 -12.162  -2.132
  737    HG3  LYS  67           1HG      LYS  67  10.330 -10.576  -2.860
  738    HD2  LYS  67           2HD      LYS  67  11.496  -9.816  -0.902
  739    HD3  LYS  67           1HD      LYS  67  11.073 -11.288  -0.023
  740    HE2  LYS  67           2HE      LYS  67  13.112 -11.974  -0.662
  741    HE3  LYS  67           1HE      LYS  67  12.311 -12.330  -2.191
  742    HZ1  LYS  67           3HZ      LYS  67  13.088 -10.323  -3.123
  743    HZ2  LYS  67           1HZ      LYS  67  14.422 -11.006  -2.338
  744    HZ3  LYS  67           2HZ      LYS  67  13.595  -9.711  -1.625
  745    H    SER  68           H        SER  68   7.387 -12.072   0.015
  746    HA   SER  68           HA       SER  68   6.835 -14.690  -1.060
  747    HB2  SER  68           2HB      SER  68   6.521 -14.372   1.822
  748    HB3  SER  68           1HB      SER  68   7.641 -15.395   0.919
  749    HG   SER  68           HG       SER  68   9.143 -13.941   1.138
  750    H    GLY  69           H        GLY  69   4.863 -12.657  -1.615
  751    HA2  GLY  69           1HA      GLY  69   2.569 -12.622  -1.805
  752    HA3  GLY  69           2HA      GLY  69   2.514 -14.095  -0.852
  753    H    MET  70           H        MET  70   4.200 -11.462   0.549
  754    HA   MET  70           HA       MET  70   1.946 -11.053   2.392
  755    HB2  MET  70           2HB      MET  70   4.691 -10.220   3.180
  756    HB3  MET  70           1HB      MET  70   3.393 -10.884   4.162
  757    HG2  MET  70           2HG      MET  70   4.494 -12.755   2.201
  758    HG3  MET  70           1HG      MET  70   5.642 -12.214   3.424
  759    HE1  MET  70           3HE      MET  70   5.377 -14.987   5.461
  760    HE2  MET  70           1HE      MET  70   6.205 -13.547   4.865
  761    HE3  MET  70           2HE      MET  70   5.229 -13.461   6.332
  762    H    ILE  71           H        ILE  71   1.159  -9.048   2.711
  763    HA   ILE  71           HA       ILE  71   2.120  -6.906   1.014
  764    HB   ILE  71           HB       ILE  71   0.083  -6.169   2.983
  765   HG12  ILE  71          2HG1      ILE  71  -1.510  -7.596   1.232
  766   HG13  ILE  71          1HG1      ILE  71  -0.181  -8.708   1.554
  767   HG21  ILE  71          1HG2      ILE  71  -1.046  -5.321   0.984
  768   HG22  ILE  71          2HG2      ILE  71   0.642  -4.811   1.045
  769   HG23  ILE  71          3HG2      ILE  71   0.155  -6.121  -0.029
  770   HD11  ILE  71          3HD1      ILE  71  -2.202  -7.584   3.433
  771   HD12  ILE  71          1HD1      ILE  71  -1.677  -9.252   3.203
  772   HD13  ILE  71          2HD1      ILE  71  -0.627  -8.105   4.036
  773    H    LEU  72           H        LEU  72   3.720  -5.627   1.651
  774    HA   LEU  72           HA       LEU  72   3.894  -4.910   4.499
  775    HB2  LEU  72           2HB      LEU  72   5.889  -6.221   2.771
  776    HB3  LEU  72           1HB      LEU  72   6.500  -4.874   3.714
  777    HG   LEU  72           HG       LEU  72   5.360  -6.106   5.718
  778   HD11  LEU  72          1HD1      LEU  72   5.033  -8.384   5.565
  779   HD12  LEU  72          2HD1      LEU  72   4.347  -7.789   4.051
  780   HD13  LEU  72          3HD1      LEU  72   5.953  -8.519   4.064
  781   HD21  LEU  72          3HD2      LEU  72   7.707  -7.645   4.862
  782   HD22  LEU  72          1HD2      LEU  72   7.911  -5.892   4.832
  783   HD23  LEU  72          2HD2      LEU  72   7.438  -6.701   6.326
  784    H    CYS  73           H        CYS  73   4.702  -2.837   4.937
  785    HA   CYS  73           HA       CYS  73   4.289  -0.938   2.847
  786    HB2  CYS  73           2HB      CYS  73   4.723   0.769   4.500
  787    HB3  CYS  73           1HB      CYS  73   3.692  -0.465   5.209
  788    H    ARG  74           H        ARG  74   5.985   0.924   2.710
  789    HA   ARG  74           HA       ARG  74   8.107  -0.059   1.194
  790    HB2  ARG  74           2HB      ARG  74   6.990   2.271   1.216
  791    HB3  ARG  74           1HB      ARG  74   8.132   2.651   2.497
  792    HG2  ARG  74           2HG      ARG  74   9.757   1.589   0.570
  793    HG3  ARG  74           1HG      ARG  74   8.541   2.448  -0.381
  794    HD2  ARG  74           2HD      ARG  74   9.911   3.729   1.964
  795    HD3  ARG  74           1HD      ARG  74  10.630   3.744   0.354
  796    HE   ARG  74           HE       ARG  74   7.922   4.811   0.783
  797   HH11  ARG  74          2HH1      ARG  74  11.251   5.255  -0.225
  798   HH12  ARG  74          1HH1      ARG  74  10.973   6.858  -0.850
  799   HH21  ARG  74          2HH2      ARG  74   7.546   6.873  -0.083
  800   HH22  ARG  74          1HH2      ARG  74   8.859   7.771  -0.798
  801    H    ASN  75           H        ASN  75   8.057   1.197   4.504
  802    HA   ASN  75           HA       ASN  75  10.885   0.974   4.879
  803    HB2  ASN  75           2HB      ASN  75   9.282   2.533   6.113
  804    HB3  ASN  75           1HB      ASN  75   8.793   1.127   7.052
  805   HD21  ASN  75          1HD2      ASN  75  10.947   3.677   6.801
  806   HD22  ASN  75          2HD2      ASN  75  12.071   3.178   8.015
  807    H    ASP  76           H        ASP  76   8.086  -0.993   5.789
  808    HA   ASP  76           HA       ASP  76   9.518  -2.716   7.528
  809    HB2  ASP  76           2HB      ASP  76   6.802  -2.460   6.554
  810    HB3  ASP  76           1HB      ASP  76   7.298  -4.146   6.668
  811    H    TYR  77           H        TYR  77   8.672  -2.912   4.108
  812    HA   TYR  77           HA       TYR  77   9.286  -5.617   3.740
  813    HB2  TYR  77           2HB      TYR  77   8.116  -4.465   1.988
  814    HB3  TYR  77           1HB      TYR  77   9.437  -3.312   1.789
  815    HD1  TYR  77           1HD      TYR  77   9.100  -7.038   1.879
  816    HD2  TYR  77           2HD      TYR  77  10.676  -3.632  -0.131
  817    HE1  TYR  77           1HE      TYR  77  10.149  -8.508   0.214
  818    HE2  TYR  77           2HE      TYR  77  11.733  -5.098  -1.799
  819    HH   TYR  77           HH       TYR  77  12.548  -7.798  -1.603
  820    H    ILE  78           H        ILE  78  11.334  -2.742   3.527
  821    HA   ILE  78           HA       ILE  78  13.664  -4.102   2.655
  822    HB   ILE  78           HB       ILE  78  13.512  -1.507   4.200
  823   HG12  ILE  78          2HG1      ILE  78  13.639  -1.865   1.201
  824   HG13  ILE  78          1HG1      ILE  78  12.127  -1.630   2.073
  825   HG21  ILE  78          1HG2      ILE  78  15.751  -2.463   4.139
  826   HG22  ILE  78          2HG2      ILE  78  15.653  -2.614   2.385
  827   HG23  ILE  78          3HG2      ILE  78  15.665  -1.016   3.134
  828   HD11  ILE  78          3HD1      ILE  78  12.415   0.556   2.007
  829   HD12  ILE  78          1HD1      ILE  78  13.952   0.402   2.860
  830   HD13  ILE  78          2HD1      ILE  78  13.910   0.318   1.097
  831    H    ARG  79           H        ARG  79  12.327  -3.348   5.816
  832    HA   ARG  79           HA       ARG  79  14.585  -4.124   7.340
  833    HB2  ARG  79           2HB      ARG  79  11.655  -3.991   8.076
  834    HB3  ARG  79           1HB      ARG  79  12.950  -4.273   9.229
  835    HG2  ARG  79           2HG      ARG  79  13.538  -1.935   7.693
  836    HG3  ARG  79           1HG      ARG  79  11.912  -1.814   8.369
  837    HD2  ARG  79           2HD      ARG  79  12.691  -1.528  10.443
  838    HD3  ARG  79           1HD      ARG  79  13.839  -2.857  10.279
  839    HE   ARG  79           HE       ARG  79  15.357  -1.269   9.189
  840   HH11  ARG  79          2HH1      ARG  79  12.767  -0.023  11.208
  841   HH12  ARG  79          1HH1      ARG  79  13.506   1.535  11.409
  842   HH21  ARG  79          2HH2      ARG  79  16.324   0.799   9.453
  843   HH22  ARG  79          1HH2      ARG  79  15.535   1.994  10.440
  844    H    LEU  80           H        LEU  80  11.677  -5.848   6.290
  845    HA   LEU  80           HA       LEU  80  12.398  -8.233   7.727
  846    HB2  LEU  80           2HB      LEU  80  10.039  -7.206   6.806
  847    HB3  LEU  80           1HB      LEU  80  10.356  -8.464   5.624
  848    HG   LEU  80           HG       LEU  80  10.364  -8.981   8.597
  849   HD11  LEU  80          1HD1      LEU  80   8.140  -8.221   7.155
  850   HD12  LEU  80          2HD1      LEU  80   8.065  -9.981   7.141
  851   HD13  LEU  80          3HD1      LEU  80   8.145  -9.116   8.675
  852   HD21  LEU  80          3HD2      LEU  80  11.537 -10.625   7.226
  853   HD22  LEU  80          1HD2      LEU  80  10.061 -11.307   7.911
  854   HD23  LEU  80          2HD2      LEU  80  10.103 -10.815   6.219
  855    H    PHE  81           H        PHE  81  11.931  -7.576   4.233
  856    HA   PHE  81           HA       PHE  81  13.525  -9.997   3.717
  857    HB2  PHE  81           2HB      PHE  81  11.573  -8.638   1.848
  858    HB3  PHE  81           1HB      PHE  81  12.387 -10.174   1.575
  859    HD1  PHE  81           2HD      PHE  81  11.825 -12.116   3.086
  860    HD2  PHE  81           1HD      PHE  81   9.545  -8.527   2.988
  861    HE1  PHE  81           2HE      PHE  81   9.935 -13.292   4.135
  862    HE2  PHE  81           1HE      PHE  81   7.646  -9.698   4.034
  863    HZ   PHE  81           HZ       PHE  81   7.843 -12.084   4.607
  864    H    GLY  82           H        GLY  82  12.763  -7.519   1.366
  865    HA2  GLY  82           1HA      GLY  82  14.219  -5.869   0.498
  866    HA3  GLY  82           2HA      GLY  82  15.562  -6.662   1.313