*HEADER    IMMUNE SYSTEM                           28-MAR-12   2LRA              
*TITLE     NMR STRUCTURE OF SIGNAL SEQUENCE DELETED (SSD) RV0603 PROTEIN FROM    
*TITLE    2 MYCOBACTERIUM TUBERCULOSIS WITHOUT N-TERMINAL HIS-TAG                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: POSSIBLE EXPORTED PROTEIN;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 28-103;                                       
*COMPND   5 SYNONYM: RV0603-SSD;                                                 
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS;                     
*SOURCE   3 ORGANISM_TAXID: 1773;                                                
*SOURCE   4 GENE: RV0603;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: K12;                                       
*SOURCE   8 EXPRESSION_SYSTEM_VARIANT: BL21(DE3);                                
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PET-NH6                                    
*KEYWDS    SSD, IMMUNE SYSTEM                                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    S.TRIPATHI, S.PULAVARTI, R.YADAV, A.JAIN, P.PATHAK, A.MEHER, A.ARORA  
*REVDAT   1   22-MAY-13 2LRA    0                                                


  2 ALA  QB      3 MET  H       4.25            #peak 1763
  3 MET  H       3 MET  HG2     5.50            #peak 1862
  3 MET  H       3 MET  HG3     5.38            #peak 564 
  3 MET  H       3 MET  QB      3.57            #peak 570
  3 MET  HA      3 MET  HG3     4.17            #peak 943 
  3 MET  HA      4 ALA  H       3.45            #peak 901 
  3 MET  HA      5 PHE  HD1     4.00            #peak 84
  3 MET  HA      5 PHE  HE1     3.86            #peak 38
  3 MET  HG2     4 ALA  H       5.50            #peak 906 
  3 MET  HG2     5 PHE  HB2     5.50            #peak 2090
  3 MET  HG2     5 PHE  HE1     4.15            #peak 98 
  3 MET  HG3     4 ALA  H       3.82            #peak 831 
  3 MET  HG3     5 PHE  H       5.50            #peak 771 
  3 MET  HG3     5 PHE  HZ      4.99            #peak 151 
  3 MET  QB      3 MET  HG3     2.31            #peak 2810
  3 MET  QB      4 ALA  H       4.41            #peak 905
  3 MET  QB      4 ALA  QB      4.65            #peak 2816
  3 MET  QB      5 PHE  H       4.52            #peak 113
  3 MET  QB      5 PHE  HB2     4.50            #peak 2089
  3 MET  QB      5 PHE  HB3     5.34            #peak 2812
  3 MET  QB      5 PHE  HE1     4.64            #peak 40
  4 ALA  H       4 ALA  QB      2.58            #peak 1964
  4 ALA  H       5 PHE  HD1     5.50            #peak 178 
  4 ALA  H       5 PHE  HE1     5.50            #peak 95 
  4 ALA  H       5 PHE  HZ      5.50            #peak 150 
  4 ALA  HA      5 PHE  H       2.82            #peak 2989
  4 ALA  HA      6 ASP  H       5.50            #peak 505 
  4 ALA  QB      5 PHE  H       3.58            #peak 109 
  4 ALA  QB      5 PHE  HB2     5.50            #peak 2084
  4 ALA  QB      6 ASP  H       5.50            #peak 500 
  5 PHE  H       5 PHE  HB3     4.07            #peak 105 
  5 PHE  H       5 PHE  HD1     5.50            #peak 178 
  5 PHE  H       5 PHE  HE1     5.50            #peak 106 
  5 PHE  H      66 PHE  HD1     5.50            #peak 112 
  5 PHE  H      66 PHE  HE1     5.50            #peak 106 
  5 PHE  HA      5 PHE  HD1     5.50            #peak 182 
  5 PHE  HA      5 PHE  HD2     5.50            #peak 182 
  5 PHE  HA      5 PHE  HE2     5.50            #peak 216 
  5 PHE  HA     66 PHE  HD1     5.50            #peak 166 
  5 PHE  HA     66 PHE  HE1     5.50            #peak 102 
  5 PHE  HA      6 ASP  HB2     5.50            #peak 1312
  5 PHE  HA      6 ASP  HB3     5.50            #peak 1312
  5 PHE  HA      6 ASP  QB      4.77            #peak 1312
  5 PHE  HB2     5 PHE  HE2     5.40            #peak 14
  5 PHE  HB2    66 PHE  HD1     5.50            #peak 170 
  5 PHE  HB2    66 PHE  HE1     5.50            #peak 108 
  5 PHE  HB2     6 ASP  H       4.51            #peak 501 
  5 PHE  HB2     6 ASP  QB      4.37            #peak 343
  5 PHE  HB3     5 PHE  HE2     4.65            #peak 213 
  5 PHE  HB3    66 PHE  HD1     5.50            #peak 1044
  5 PHE  HB3    66 PHE  HE1     4.68            #peak 39 
  5 PHE  HB3     6 ASP  H       4.67            #peak 496 
  5 PHE  HB3     6 ASP  QB      5.12            #peak 1034
  5 PHE  HD2    15 ASP  QB      4.92            #peak 2436
  5 PHE  HD2    18 ARG  HB2     5.24            #peak 57 
  5 PHE  HD2    18 ARG  HB3     5.50            #peak 2067
  5 PHE  HD2    46 TYR  HE1     4.82            #peak 183 
  5 PHE  HD2    66 PHE  HZ      5.50            #peak 143 
  5 PHE  HE1    65 ASP  HA      4.48            #peak 112 
  5 PHE  HE1    65 ASP  HB2     5.50            #peak 1631
  5 PHE  HE1    65 ASP  HB3     4.69            #peak 98 
  5 PHE  HE1    66 PHE  H       4.60            #peak 35 
  5 PHE  HE1    66 PHE  HA      5.50            #peak 110 
  5 PHE  HE1    66 PHE  HB2     3.08            #peak 34 
  5 PHE  HE1    66 PHE  HB3     4.69            #peak 43 
  5 PHE  HE2    65 ASP  HA      4.43            #peak 17 
  5 PHE  HE2    66 PHE  H       3.91            #peak 146 
  6 ASP  H       6 ASP  QB      3.67            #peak 503
  6 ASP  H       7 GLY  H       3.61            #peak 502 
  6 ASP  H       7 GLY  HA2     5.50            #peak 504 
  6 ASP  H       7 GLY  HA3     5.50            #peak 504 
  6 ASP  HA      6 ASP  QB      2.61            #peak 341
  6 ASP  HA      7 GLY  H       3.48            #peak 846 
  6 ASP  HB2     7 GLY  H       5.50            #peak 849 
  6 ASP  HB3     7 GLY  H       5.50            #peak 849 
  7 GLY  H      18 ARG  HB2     5.50            #peak 55
  7 GLY  H      18 ARG  HB3     5.50            #peak 2065
  7 GLY  HA2     8 GLU  H       3.03            #peak 2445
  7 GLY  HA3     8 GLU  H       3.03            #peak 2444
  7 GLY  QA      8 GLU  H       2.42            #peak 2444
  8 GLU  H       8 GLU  HG2     5.46            #peak 48
  8 GLU  H       8 GLU  HG3     5.46            #peak 48
  8 GLU  H       8 GLU  QB      3.62            #peak 43
  8 GLU  H       8 GLU  QG      4.61            #peak 48
  8 GLU  HA      9 ASP  H       3.00            #peak 438 
  8 GLU  HB2     9 ASP  H       5.04            #peak 437 
  8 GLU  HB3     9 ASP  H       5.04            #peak 437 
  8 GLU  HG2     9 ASP  H       5.50            #peak 442 
  8 GLU  HG3     9 ASP  H       5.50            #peak 442 
  8 GLU  QB      9 ASP  H       4.37            #peak 437
  9 ASP  H      10 GLU  H       4.13            #peak 440 
  9 ASP  H       9 ASP  HB2     3.35            #peak 443 
  9 ASP  H       9 ASP  HB3     3.86            #peak 434 
  9 ASP  HA     10 GLU  H       3.27            #peak 802 
  9 ASP  HA      9 ASP  HB2     2.99            #peak 2673
  9 ASP  HB2    10 GLU  H       4.58            #peak 807 
  9 ASP  HB2    11 VAL  H       5.48            #peak 384 
  9 ASP  HB3    10 GLU  H       4.17            #peak 798 
  9 ASP  HB3    11 VAL  H       5.12            #peak 374 
  9 ASP  HB3    11 VAL  QG2     4.59            #peak 958 
 10 GLU  H      10 GLU  HB2     3.76            #peak 799 
 10 GLU  H      10 GLU  HB3     3.76            #peak 808 
 10 GLU  H      10 GLU  QG      2.84            #peak 803
 10 GLU  HA     10 GLU  HG2     4.17            #peak 846 
 10 GLU  HA     10 GLU  HG3     4.17            #peak 1790
 10 GLU  HA     10 GLU  QG      3.48            #peak 1790
 10 GLU  HA     11 VAL  H       2.93            #peak 376 
 10 GLU  HA     11 VAL  QG2     4.80            #peak 951 
 10 GLU  QB     10 GLU  QG      2.28            #peak 2830
 10 GLU  QB     11 VAL  QG2     4.73            #peak 2495
 10 GLU  QG     11 VAL  H       4.75            #peak 380
 11 VAL  H      11 VAL  QG1     5.50            #peak 1879
 11 VAL  H      11 VAL  QG2     3.46            #peak 381 
 11 VAL  HA     11 VAL  QG1     3.20            #peak 1970
 11 VAL  HA     11 VAL  QG2     3.46            #peak 1970
 11 VAL  HA     12 THR  H       2.67            #peak 759 
 11 VAL  HA     12 THR  QG2     3.88            #peak 1977
 11 VAL  HB     12 THR  H       4.12            #peak 762 
 11 VAL  QG1    12 THR  H       3.23            #peak 755 
 11 VAL  QG2    12 THR  H       5.50            #peak 957 
 12 THR  H      12 THR  HB      3.73            #peak 756 
 12 THR  H      12 THR  QG2     3.52            #peak 764 
 12 THR  H      13 GLY  H       5.50            #peak 1057
 12 THR  HA     12 THR  HB      2.51            #peak 2218
 12 THR  HA     12 THR  QG2     3.24            #peak 2995
 12 THR  HA     13 GLY  H       3.17            #peak 1058
 12 THR  HB     13 GLY  H       5.14            #peak 1052
 12 THR  QG2    13 GLY  H       4.27            #peak 1061
 13 GLY  H      14 PRO  HD2     5.02            #peak 1053
 13 GLY  H      14 PRO  HD3     5.02            #peak 1051
 13 GLY  H      16 ALA  QB      5.30            #peak 1050
 13 GLY  HA2    14 PRO  HD2     3.00            #peak 1687
 13 GLY  HA2    14 PRO  HD3     3.00            #peak 2601
 13 GLY  HA2    14 PRO  HG2     4.79            #peak 1748
 13 GLY  HA2    14 PRO  QD      2.40            #peak 2601
 13 GLY  HA3    14 PRO  QD      3.00            #peak 1688
 13 GLY  HA3    16 ALA  QB      4.61            #peak 1855   
 14 PRO  HA     15 ASP  H       3.48            #peak 165
 14 PRO  HA     16 ALA  H       5.50            #peak 625 
 14 PRO  HA     16 ALA  QB      5.40            #peak 614 
 14 PRO  HA     17 ASP  H       5.50            #peak 629 
 14 PRO  HD2    15 ASP  H       4.57            #peak 340 
 14 PRO  HD3    15 ASP  H       4.57            #peak 334 
 14 PRO  HG2    16 ALA  H       4.55            #peak 680 
 14 PRO  HG2    17 ASP  H       5.36            #peak 992 
 14 PRO  QD     15 ASP  H       3.99            #peak 334
 15 ASP  H      15 ASP  QB      3.39            #peak 342
 15 ASP  H      16 ALA  H       3.35            #peak 671 
 15 ASP  H      17 ASP  H       4.79            #peak 344 
 15 ASP  H      18 ARG  HG2     4.95            #peak 337 
 15 ASP  H      36 GLU  HA      5.50            #peak 1194
 15 ASP  H      37 THR  H       5.16            #peak 486 
 15 ASP  HA     16 ALA  H       3.43            #peak 675 
 15 ASP  HA     16 ALA  HA      5.33            #peak 1390
 15 ASP  HA     17 ASP  H       5.50            #peak 1481
 15 ASP  HA     18 ARG  H       3.33            #peak 224 
 15 ASP  HA     18 ARG  HA      5.50            #peak 1479
 15 ASP  HA     18 ARG  HB2     4.63            #peak 54 
 15 ASP  HA     18 ARG  HB3     4.80            #peak 2064
 15 ASP  HA     18 ARG  QD      3.47            #peak 1480
 15 ASP  HA     19 ALA  H       4.70            #peak 748 
 15 ASP  HA     19 ALA  QB      4.55            #peak 939 
 15 ASP  HB2    18 ARG  H       5.50            #peak 2427
 15 ASP  HB2    19 ALA  QB      5.50            #peak 2437
 15 ASP  HB2    46 TYR  HE1     4.74            #peak 127 
 15 ASP  HB3    18 ARG  H       5.50            #peak 2427
 15 ASP  HB3    19 ALA  QB      5.50            #peak 2437
 15 ASP  HB3    46 TYR  HE1     4.74            #peak 127 
 15 ASP  QB     16 ALA  H       4.43            #peak 679
 15 ASP  QB     18 ARG  HB2     4.76            #peak 2425
 15 ASP  QB     18 ARG  HG2     5.34            #peak 425
 15 ASP  QB     18 ARG  HG3     3.82            #peak 2976
 15 ASP  QB     19 ALA  H       5.34            #peak 2435
 15 ASP  QB     35 VAL  QQG     4.85            #peak 2227
 15 ASP  QB     37 THR  H       5.34            #peak 493
 15 ASP  QB     46 TYR  HE1     4.05            #peak 127
 15 ASP  QB     66 PHE  HE1     3.33            #peak 94
 15 ASP  QB     66 PHE  HZ      4.61            #peak 2431
 16 ALA  H      16 ALA  QB      3.01            #peak 667 
 16 ALA  H      17 ASP  H       3.27            #peak 990 
 16 ALA  H      17 ASP  HB2     4.80            #peak 673 
 16 ALA  H      17 ASP  HB3     5.50            #peak 666 
 16 ALA  H      18 ARG  H       4.75            #peak 670 
 16 ALA  H      18 ARG  HG2     4.78            #peak 678 
 16 ALA  H      19 ALA  QB      5.33            #peak 935 
 16 ALA  H      34 GLU  QB      5.34            #peak 2492
 16 ALA  H      35 VAL  QQG     4.29            #peak 2233
 16 ALA  HA     17 ASP  HA      4.81            #peak 2339
 16 ALA  HA     18 ARG  H       5.50            #peak 234  
 16 ALA  HA     19 ALA  H       3.89            #peak 380  
 16 ALA  HA     20 ARG  H       4.50            #peak 1042
 16 ALA  HA     20 ARG  HB2     5.45            #peak 1386
 16 ALA  HA     35 VAL  HB      4.32            #peak 1272
 16 ALA  HA     35 VAL  QQG     4.16            #peak 1385
 16 ALA  QB     17 ASP  H       3.36            #peak 983 
 16 ALA  QB     17 ASP  HA      4.35            #peak 2329
 16 ALA  QB     17 ASP  HB2     4.36            #peak 322 
 16 ALA  QB     18 ARG  H       5.38            #peak 320 
 16 ALA  QB     19 ALA  H       5.50            #peak 326 
 16 ALA  QB     34 GLU  QB      3.31            #peak 321
 16 ALA  QB     35 VAL  H       4.81            #peak 887 
 17 ASP  H      17 ASP  HB2     3.55            #peak 987 
 17 ASP  H      17 ASP  HB3     3.25            #peak 982 
 17 ASP  H      18 ARG  H       3.56            #peak 239 
 17 ASP  H      20 ARG  H       5.30            #peak 986 
 17 ASP  HA     17 ASP  HB2     2.83            #peak 2335  
 17 ASP  HA     18 ARG  H       3.51            #peak 77
 17 ASP  HA     18 ARG  HA      5.17            #peak 2341
 17 ASP  HA     19 ALA  H       5.15            #peak 748 
 17 ASP  HA     20 ARG  H       4.04            #peak 1044
 17 ASP  HA     20 ARG  HB3     3.17            #peak 2332
 17 ASP  HA     20 ARG  QD      3.87            #peak 2346
 17 ASP  HA     21 ALA  H       4.46            #peak 318 
 17 ASP  HA     21 ALA  QB      4.68            #peak 2329
 17 ASP  HB2    18 ARG  H       5.50            #peak 1288
 17 ASP  HB3    18 ARG  H       2.72            #peak 221 
 17 ASP  HB3    21 ALA  H       5.48            #peak 303 
 18 ARG  H      18 ARG  HB2     3.73            #peak 219 
 18 ARG  H      18 ARG  HB3     3.51            #peak 235 
 18 ARG  H      18 ARG  HG2     3.81            #peak 227 
 18 ARG  H      18 ARG  HG3     3.46            #peak 222 
 18 ARG  H      18 ARG  QD      2.68            #peak 238
 18 ARG  H      19 ALA  H       3.08            #peak 233 
 18 ARG  H      19 ALA  HA      5.50            #peak 234 
 18 ARG  H      19 ALA  QB      4.95            #peak 929 
 18 ARG  H      20 ARG  H       4.95            #peak 241 
 18 ARG  HA     18 ARG  HD2     4.75            #peak 2170
 18 ARG  HA     18 ARG  HD3     4.75            #peak 2175
 18 ARG  HA     18 ARG  HG2     3.67            #peak 2174
 18 ARG  HA     18 ARG  QD      3.96            #peak 2175
 18 ARG  HA     21 ALA  H       4.34            #peak 317 
 18 ARG  HA     21 ALA  QB      3.11            #peak 2789
 18 ARG  HA     66 PHE  HZ      5.50            #peak 144 
 18 ARG  HB2    18 ARG  HD2     4.13            #peak 175 
 18 ARG  HB2    18 ARG  HD3     4.13            #peak 1127
 18 ARG  HB2    18 ARG  QD      3.56            #peak 1127
 18 ARG  HB2    19 ALA  H       3.76            #peak 736 
 18 ARG  HB2    66 PHE  HD1     4.81            #peak 60 
 18 ARG  HB2    66 PHE  HE1     4.35            #peak 93 
 18 ARG  HB3    18 ARG  HD2     3.66            #peak 182 
 18 ARG  HB3    18 ARG  HD3     3.66            #peak 1133
 18 ARG  HB3    19 ALA  H       5.50            #peak 2066
 18 ARG  HB3    66 PHE  HD1     5.50            #peak 2070
 18 ARG  HB3    66 PHE  HE1     4.46            #peak 107 
 18 ARG  HD2    66 PHE  HE1     5.01            #peak 179 
 18 ARG  HD3    66 PHE  HE1     5.01            #peak 1129
 18 ARG  HG2    19 ALA  HA      4.63            #peak 1026
 18 ARG  HG2    20 ARG  H       5.50            #peak 1022
 18 ARG  HG3    19 ALA  H       3.91            #peak 753 
 18 ARG  QD     19 ALA  H       5.34            #peak 181
 18 ARG  QD     66 PHE  HE1     4.38            #peak 1129
 19 ALA  H      19 ALA  QB      3.12            #peak 741 
 19 ALA  H      20 ARG  H       3.30            #peak 752 
 19 ALA  H      21 ALA  H       4.21            #peak 313 
 19 ALA  H      21 ALA  QB      5.50            #peak 2791
 19 ALA  H      66 PHE  HE1     4.91            #peak 111 
 19 ALA  HA     21 ALA  H       4.79            #peak 1951
 19 ALA  HA     22 ALA  H       4.03            #peak 659 
 19 ALA  HA     66 PHE  HE2     3.29            #peak 12 
 19 ALA  QB     20 ARG  H       2.49            #peak 1034
 19 ALA  QB     21 ALA  H       5.28            #peak 929 
 19 ALA  QB     22 ALA  H       4.92            #peak 656 
 19 ALA  QB     35 VAL  H       4.11            #peak 927 
 19 ALA  QB     35 VAL  QQG     2.55            #peak 2225
 19 ALA  QB     47 GLY  H       4.70            #peak 620 
 19 ALA  QB     48 VAL  HA      4.39            #peak 932 
 19 ALA  QB     48 VAL  QQG     2.53            #peak 2381
 19 ALA  QB     66 PHE  HE1     4.25            #peak 926 
 19 ALA  QB     66 PHE  HE2     3.11            #peak 212 
 20 ARG  H      20 ARG  HB2     3.45            #peak 1041
 20 ARG  H      20 ARG  HB3     2.82            #peak 1034
 20 ARG  H      20 ARG  HG2     4.85            #peak 1047
 20 ARG  H      20 ARG  HG3     5.24            #peak 1047
 20 ARG  H      20 ARG  QD      4.59            #peak 1049
 20 ARG  H      21 ALA  H       3.31            #peak 1032
 20 ARG  H      32 ALA  QB      5.50            #peak 1661
 20 ARG  H      35 VAL  QQG     4.75            #peak 253
 20 ARG  HA     20 ARG  HD2     5.35            #peak 2050
 20 ARG  HA     20 ARG  HD3     5.35            #peak 2050
 20 ARG  HA     20 ARG  HG2     3.91            #peak 2049
 20 ARG  HA     20 ARG  HG3     4.20            #peak 2049
 20 ARG  HA     20 ARG  QD      4.62            #peak 2050
 20 ARG  HA     22 ALA  H       4.81            #peak 660 
 20 ARG  HA     23 ALA  H       4.22            #peak 978 
 20 ARG  HA     23 ALA  HA      5.44            #peak 2712
 20 ARG  HA     23 ALA  QB      2.88            #peak 2039
 20 ARG  HA     24 VAL  H       4.53            #peak 213 
 20 ARG  HA     32 ALA  QB      3.27            #peak 1657
 20 ARG  HA     48 VAL  QQG     3.03            #peak 2038
 20 ARG  HA     49 LEU  QD1     5.50            #peak 1102
 20 ARG  HB2    20 ARG  HD2     3.92            #peak 2965
 20 ARG  HB2    20 ARG  HD3     3.92            #peak 2965
 20 ARG  HB2    20 ARG  QD      3.41            #peak 2965
 20 ARG  HB2    35 VAL  H       3.42            #peak 891 
 20 ARG  HB2    48 VAL  QQG     4.65            #peak 1941
 20 ARG  HB2    49 LEU  H       4.85            #peak 174 
 20 ARG  HB2    49 LEU  HG      4.60            #peak 1944
 20 ARG  HB2    49 LEU  QD2     4.29            #peak 500 
 20 ARG  HB3    20 ARG  QD      3.24            #peak 2961
 20 ARG  HB3    21 ALA  H       4.49            #peak 308 
 20 ARG  HB3    32 ALA  QB      4.22            #peak 916 
 20 ARG  HB3    35 VAL  H       5.50            #peak 912 
 20 ARG  HD2    32 ALA  QB      4.57            #peak 1663
 20 ARG  HD3    32 ALA  QB      4.57            #peak 1663
 20 ARG  HG2    32 ALA  QB      2.52            #peak 1662
 20 ARG  HG2    48 VAL  QQG     5.44            #peak 2393
 20 ARG  HG3    32 ALA  QB      2.79            #peak 1662
 20 ARG  HG3    33 GLY  H       2.85            #peak 178 
 20 ARG  HG3    33 GLY  QA      4.57            #peak 2638
 20 ARG  HG3    34 GLU  H       4.62            #peak 550 
 20 ARG  HG3    35 VAL  H       5.50            #peak 2890
 20 ARG  HG3    48 VAL  QQG     5.44            #peak 2393
 20 ARG  HG3    49 LEU  H       5.50            #peak 2890
 20 ARG  HG3    49 LEU  QD2     4.17            #peak 2888
 20 ARG  QD     21 ALA  H       5.26            #peak 323
 20 ARG  QD     32 ALA  QB      3.78            #peak 1663
 21 ALA  H      21 ALA  QB      2.90            #peak 320  
 21 ALA  H      22 ALA  H       2.90            #peak 298
 21 ALA  H      23 ALA  H       4.48            #peak 319 
 21 ALA  H      24 VAL  H       5.15            #peak 304 
 21 ALA  HA     23 ALA  H       4.76            #peak 970   
 21 ALA  HA     24 VAL  H       4.07            #peak 203 
 21 ALA  HA     24 VAL  HB      4.03            #peak 793 
 21 ALA  HA     24 VAL  QQG     3.37            #peak 799
 21 ALA  HA     25 GLN  HE21    5.50            #peak 324 
 21 ALA  HA     25 GLN  HE22    5.50            #peak 728 
 21 ALA  QB     22 ALA  H       3.31            #peak 662 
 21 ALA  QB     22 ALA  HA      3.92            #peak 1759
 22 ALA  H      22 ALA  QB      3.05            #peak 653 
 22 ALA  H      23 ALA  H       3.21            #peak 661 
 22 ALA  H      24 VAL  H       4.69            #peak 652 
 22 ALA  HA     25 GLN  QB      3.19            #peak 1755
 22 ALA  HA     25 GLN  QG      4.60            #peak 1589
 22 ALA  QB     23 ALA  H       3.36            #peak 968   
 22 ALA  QB     23 ALA  HA      4.45            #peak 271
 22 ALA  QB     24 VAL  H       5.50            #peak 2312
 23 ALA  H      23 ALA  QB      2.40            #peak 1967
 23 ALA  H      24 VAL  H       3.33            #peak 217 
 23 ALA  H      25 GLN  H       4.22            #peak 587 
 23 ALA  H      26 ALA  H       4.91            #peak 927 
 23 ALA  H      32 ALA  QB      5.18            #peak 1659
 23 ALA  H      48 VAL  QQG     4.14            #peak 977
 23 ALA  H      50 VAL  QG1     5.50            #peak 1922
 23 ALA  H      50 VAL  QG2     5.50            #peak 890 
 23 ALA  H      50 VAL  QQG     4.64            #peak 890
 23 ALA  HA     24 VAL  HA      5.08            #peak 2707
 23 ALA  HA     25 GLN  H       4.84            #peak 588 
 23 ALA  HA     26 ALA  H       4.03            #peak 928 
 23 ALA  HA     26 ALA  QB      3.09            #peak 2319
 23 ALA  HA     27 VAL  H       5.39            #peak 588 
 23 ALA  HA     48 VAL  QQG     2.99            #peak 2709
 23 ALA  HA     50 VAL  HB      5.50            #peak 2950
 23 ALA  HA     50 VAL  QG1     4.63            #peak 1924
 23 ALA  HA     50 VAL  QG2     4.63            #peak 2711
 23 ALA  HA     50 VAL  QQG     3.41            #peak 2711
 23 ALA  QB     24 VAL  H       3.76            #peak 207   
 23 ALA  QB     24 VAL  QQG     4.04            #peak 1079
 23 ALA  QB     33 GLY  H       5.50            #peak 1666
 23 ALA  QB     48 VAL  H       5.50            #peak 949 
 23 ALA  QB     48 VAL  HB      4.36            #peak 375 
 23 ALA  QB     48 VAL  QG1     2.97            #peak 1675
 23 ALA  QB     48 VAL  QG2     2.97            #peak 1669
 23 ALA  QB     48 VAL  QQG     2.35            #peak 1669
 23 ALA  QB     50 VAL  QG1     2.84            #peak 1668
 23 ALA  QB     50 VAL  QG2     2.84            #peak 1668
 23 ALA  QB     51 THR  H       5.50            #peak 1666
 24 VAL  H      24 VAL  HB      3.13            #peak 197 
 24 VAL  H      24 VAL  QG1     3.83            #peak 216 
 24 VAL  H      24 VAL  QG2     3.83            #peak 204 
 24 VAL  H      24 VAL  QQG     3.03            #peak 216
 24 VAL  H      25 GLN  H       3.21            #peak 575 
 24 VAL  H      26 ALA  H       4.40            #peak 916   
 24 VAL  H      26 ALA  QB      5.50            #peak 2312
 24 VAL  H      27 VAL  H       4.96            #peak 876
 24 VAL  H      27 VAL  QQG     4.99            #peak 1771
 24 VAL  H      32 ALA  QB      4.14            #peak 207 
 24 VAL  H      50 VAL  QQG     5.43            #peak 1911
 24 VAL  HA     24 VAL  QG1     3.20            #peak 2505
 24 VAL  HA     24 VAL  QG2     3.20            #peak 1571
 24 VAL  HA     24 VAL  QQG     2.75            #peak 1571
 24 VAL  HA     26 ALA  H       4.48            #peak 922 
 24 VAL  HA     27 VAL  H       4.75            #peak 718 
 24 VAL  HA     27 VAL  HB      4.24            #peak 2803
 24 VAL  HA     27 VAL  QQG     2.84            #peak 1575
 24 VAL  HA     50 VAL  QQG     2.84            #peak 1570
 24 VAL  HB     25 GLN  H       5.50            #peak 515 
 24 VAL  HB     25 GLN  HE21    5.50            #peak 513 
 24 VAL  HB     25 GLN  HE22    5.50            #peak 735 
 24 VAL  QG1    25 GLN  H       4.11            #peak 586 
 24 VAL  QG1    32 ALA  H       4.78            #peak 2510
 24 VAL  QG1    32 ALA  QB      3.80            #peak 2506
 24 VAL  QG2    25 GLN  H       4.11            #peak 579 
 24 VAL  QG2    32 ALA  H       4.78            #peak 1462
 24 VAL  QG2    32 ALA  QB      3.80            #peak 1456
 24 VAL  QQG    25 GLN  H       3.54            #peak 579
 24 VAL  QQG    25 GLN  HA      3.85            #peak 389
 24 VAL  QQG    26 ALA  H       5.06            #peak 1460
 24 VAL  QQG    27 VAL  QQG     3.07            #peak 1777
 24 VAL  QQG    30 GLY  H       4.22            #peak 291
 24 VAL  QQG    30 GLY  QA      4.31            #peak 2501
 24 VAL  QQG    31 THR  H       5.44            #peak 2228
 24 VAL  QQG    32 ALA  H       4.10            #peak 1462
 24 VAL  QQG    32 ALA  QB      2.94            #peak 2506
 24 VAL  QQG    33 GLY  H       5.44            #peak 2500
 25 GLN  H      25 GLN  HE21    3.72            #peak 329 
 25 GLN  H      25 GLN  HE22    3.86            #peak 732 
 25 GLN  H      25 GLN  HG2     4.54            #peak 582 
 25 GLN  H      25 GLN  HG3     4.54            #peak 574 
 25 GLN  H      25 GLN  QB      2.39            #peak 584
 25 GLN  H      26 ALA  H       2.74            #peak 923 
 25 GLN  HA     25 GLN  HE21    5.50            #peak 324 
 25 GLN  HA     25 GLN  HE22    5.50            #peak 728 
 25 GLN  HA     25 GLN  HG2     3.70            #peak 1583
 25 GLN  HA     25 GLN  HG3     3.70            #peak 386 
 25 GLN  HA     25 GLN  QG      3.13            #peak 386    
 25 GLN  HA     27 VAL  H       4.42            #peak 820
 25 GLN  HA     29 GLY  H       5.50            #peak 590 
 25 GLN  HB2    26 ALA  H       4.44            #peak 919 
 25 GLN  HB3    26 ALA  H       4.44            #peak 919 
 25 GLN  QB     25 GLN  HE21    2.39            #peak 332
 25 GLN  QB     25 GLN  QG      2.31            #peak 2399
 25 GLN  QB     26 ALA  H       3.72            #peak 919
 25 GLN  QG     26 ALA  H       5.20            #peak 915
 26 ALA  H      26 ALA  QB      2.97            #peak 924 
 26 ALA  H      27 VAL  H       2.94            #peak 923 
 26 ALA  H      50 VAL  QQG     4.01            #peak 918   
 26 ALA  QB     27 VAL  H       3.60            #peak 722 
 26 ALA  QB     27 VAL  HA      4.31            #peak 817 
 26 ALA  QB     27 VAL  QQG     5.50            #peak 2474
 26 ALA  QB     50 VAL  QQG     3.36            #peak 2315
 27 VAL  H      27 VAL  HB      3.00            #peak 727 
 27 VAL  H      27 VAL  QQG     3.30            #peak 714
 27 VAL  H      28 PRO  HD2     4.84            #peak 716 
 27 VAL  H      28 PRO  HD3     5.18            #peak 708 
 27 VAL  H      30 GLY  H       5.50            #peak 713 
 27 VAL  HA     27 VAL  HB      2.70            #peak 822 
 27 VAL  HA     27 VAL  QQG     2.39            #peak 815
 27 VAL  HA     28 PRO  HB3     4.85            #peak 1120
 27 VAL  HA     28 PRO  HD2     2.47            #peak 1205
 27 VAL  HA     28 PRO  HD3     2.76            #peak 164 
 27 VAL  HA     29 GLY  H       5.50            #peak 813 
 27 VAL  HA     52 ARG  QD      3.44            #peak 2418
 27 VAL  HA     52 ARG  QG      4.65            #peak 817
 27 VAL  HB     30 GLY  H       4.91            #peak 301 
 27 VAL  HB     30 GLY  QA      5.09            #peak 2800
 27 VAL  HB     50 VAL  QQG     2.40            #peak 2802
 27 VAL  HB     51 THR  H       5.50            #peak 2798
 27 VAL  QG1    31 THR  HB      5.05            #peak 1743
 27 VAL  QG1    51 THR  HB      5.50            #peak 1732
 27 VAL  QG2    51 THR  HB      5.50            #peak 1732
 27 VAL  QQG    28 PRO  HD2     3.89            #peak 1208
 27 VAL  QQG    30 GLY  H       2.40            #peak 297
 27 VAL  QQG    30 GLY  QA      3.69            #peak 1831
 27 VAL  QQG    31 THR  HB      4.48            #peak 1743
 27 VAL  QQG    32 ALA  H       4.89            #peak 735
 27 VAL  QQG    50 VAL  HB      3.84            #peak 1788
 27 VAL  QQG    52 ARG  H       5.34            #peak 720
 27 VAL  QQG    52 ARG  HA      3.12            #peak 727
 27 VAL  QQG    52 ARG  QD      2.71            #peak 407
 27 VAL  QQG    52 ARG  QG      3.02            #peak 736
 27 VAL  QQG    53 PRO  QD      3.60            #peak 168
 28 PRO  HA     29 GLY  H       3.05            #peak 598 
 28 PRO  HA     29 GLY  QA      4.37            #peak 626
 28 PRO  HA     30 GLY  H       5.50            #peak 2241
 28 PRO  HB2    53 PRO  QD      4.66            #peak 171
 28 PRO  HD2    52 ARG  HB2     5.50            #peak 534 
 28 PRO  HD2    52 ARG  HB3     5.50            #peak 534 
 28 PRO  HG2    52 ARG  HA      4.28            #peak 550 
 28 PRO  HG2    53 PRO  QD      2.49            #peak 173
 28 PRO  HG3    53 PRO  QD      4.01            #peak 2604
 29 GLY  H      30 GLY  H       3.25            #peak 591 
 30 GLY  H      31 THR  H       4.43            #peak 638 
 30 GLY  HA2    31 THR  H       3.47            #peak 646 
 30 GLY  HA3    31 THR  H       3.47            #peak 640 
 30 GLY  QA     31 THR  H       2.98            #peak 640 
 30 GLY  QA     50 VAL  QQG     3.90            #peak 550
 31 THR  H      31 THR  HB      3.22            #peak 645 
 31 THR  H      31 THR  QG2     4.09            #peak 639 
 31 THR  H      32 ALA  H       4.68            #peak 650 
 31 THR  H      50 VAL  QQG     3.69            #peak 642
 31 THR  H      51 THR  H       4.21            #peak 878 
 31 THR  H      51 THR  HB      5.50            #peak 1730
 31 THR  HA     31 THR  QG2     3.37            #peak 2780
 31 THR  HA     32 ALA  H       2.92            #peak 966 
 31 THR  HB     32 ALA  H       4.39            #peak 961 
 31 THR  HB     51 THR  H       5.50            #peak 4 
 31 THR  QG2    32 ALA  H       4.24            #peak 955 
 32 ALA  H      32 ALA  QB      3.52            #peak 960 
 32 ALA  H      33 GLY  H       4.71            #peak 954 
 32 ALA  H      50 VAL  QQG     5.40            #peak 957
 32 ALA  HA     33 GLY  H       3.06            #peak 195 
 32 ALA  HA     49 LEU  QQD     4.98            #peak 2020
 32 ALA  HA     50 VAL  QQG     5.40            #peak 891
 32 ALA  QB     33 GLY  H       3.75            #peak 189 
 32 ALA  QB     49 LEU  HG      4.53            #peak 1656
 32 ALA  QB     50 VAL  QQG     2.64            #peak 1655
 33 GLY  H      34 GLU  H       4.60            #peak 552 
 33 GLY  H      48 VAL  QQG     5.06            #peak 1332
 33 GLY  H      49 LEU  H       5.23            #peak 164 
 33 GLY  H      49 LEU  H       5.23            #peak 179 
 33 GLY  H      49 LEU  QB      5.34            #peak 161
 33 GLY  H      49 LEU  QD1     4.17            #peak 184 
 33 GLY  H      49 LEU  QD2     4.17            #peak 16 
 33 GLY  H      50 VAL  HA      5.50            #peak 183 
 33 GLY  HA2    34 GLU  H       3.55            #peak 554 
 33 GLY  HA3    34 GLU  H       3.55            #peak 563 
 33 GLY  QA     34 GLU  H       3.02            #peak 563
 34 GLU  H      34 GLU  HG2     5.35            #peak 559 
 34 GLU  H      34 GLU  HG3     5.35            #peak 559 
 34 GLU  H      34 GLU  QB      3.55            #peak 553
 34 GLU  H      34 GLU  QG      4.55            #peak 559
 34 GLU  H      35 VAL  H       4.86            #peak 561 
 34 GLU  H      49 LEU  QD1     4.42            #peak 557  
 34 GLU  HA     34 GLU  HB2     3.01            #peak 1561
 34 GLU  HA     34 GLU  HB3     3.01            #peak 1566
 34 GLU  HA     34 GLU  QG      3.61            #peak 1563
 34 GLU  HA     35 VAL  H       2.89            #peak 894 
 34 GLU  HB3    35 VAL  H       4.69            #peak 686
 34 GLU  HG2    35 VAL  H       5.50            #peak 888 
 34 GLU  QB     35 VAL  H       4.05            #peak 891   
 34 GLU  QG     35 VAL  H       4.83            #peak 681
 35 VAL  H      35 VAL  HB      3.92            #peak 891 
 35 VAL  H      35 VAL  QG1     4.09            #peak 885 
 35 VAL  H      35 VAL  QG2     4.09            #peak 896 
 35 VAL  H      35 VAL  QQG     3.32            #peak 885
 35 VAL  H      36 GLU  H       4.80            #peak 886 
 35 VAL  HA     35 VAL  QG1     3.76            #peak 249 
 35 VAL  HA     35 VAL  QG2     3.76            #peak 2235
 35 VAL  HA     35 VAL  QQG     2.95            #peak 249
 35 VAL  HA     36 GLU  H       2.64            #peak 99   
 35 VAL  HB     36 GLU  H       3.00            #peak 93 
 35 VAL  QG1    36 GLU  H       4.21            #peak 96 
 35 VAL  QG1    47 GLY  H       4.90            #peak 246 
 35 VAL  QG1    48 VAL  HA      3.88            #peak 249 
 35 VAL  QG2    36 GLU  H       4.21            #peak 2226
 35 VAL  QG2    47 GLY  H       4.90            #peak 635 
 35 VAL  QG2    48 VAL  HA      3.88            #peak 2235
 35 VAL  QQG    36 GLU  H       3.69            #peak 2226
 35 VAL  QQG    36 GLU  HA      4.75            #peak 1200
 35 VAL  QQG    46 TYR  HA      5.44            #peak 2224
 35 VAL  QQG    47 GLY  H       3.89            #peak 635
 35 VAL  QQG    48 VAL  HA      3.19            #peak 249
 35 VAL  QQG    48 VAL  QQG     3.37            #peak 2390
 35 VAL  QQG    49 LEU  H       2.55            #peak 160
 35 VAL  QQG    49 LEU  HG      5.44            #peak 2008
 35 VAL  QQG    49 LEU  QD2     2.86            #peak 244
 36 GLU  H      36 GLU  HB2     3.56            #peak 97 
 36 GLU  H      36 GLU  HB3     3.56            #peak 93  
 36 GLU  H      36 GLU  HG2     5.41            #peak 90 
 36 GLU  H      36 GLU  HG3     5.31            #peak 90 
 36 GLU  H      36 GLU  QB      3.56            #peak 134
 36 GLU  H      36 GLU  QG      4.33            #peak 90
 36 GLU  H      37 THR  H       4.65            #peak 92 
 36 GLU  HA     36 GLU  HG2     4.12            #peak 2408   
 36 GLU  HA     36 GLU  HG3     4.12            #peak 581
 36 GLU  HA     37 THR  H       2.97            #peak 488 
 36 GLU  HB2    37 THR  H       4.20            #peak 491 
 36 GLU  HB3    37 THR  H       4.20            #peak 479 
 36 GLU  HG2    37 THR  H       5.30            #peak 487 
 36 GLU  HG3    37 THR  H       5.30            #peak 487  
 36 GLU  HG3    47 GLY  H       5.50            #peak 496
 36 GLU  QB     37 THR  H       3.50            #peak 491  
 36 GLU  QG     37 THR  H       4.61            #peak 487
 37 THR  H      37 THR  HB      3.73            #peak 485 
 37 THR  H      37 THR  QG2     3.70            #peak 483 
 37 THR  H      38 GLU  H       4.53            #peak 835 
 37 THR  HA     37 THR  QG2     2.92            #peak 637 
 37 THR  HA     38 GLU  H       4.13            #peak 839 
 37 THR  HA     46 TYR  HA      4.77            #peak 147
 37 THR  HA     46 TYR  HD1     3.90            #peak 62 
 37 THR  HA     46 TYR  HE1     5.50            #peak 2018
 37 THR  HA     47 GLY  H       4.39            #peak 630 
 37 THR  HB     38 GLU  H       4.20            #peak 834 
 37 THR  HB     46 TYR  HA      4.53            #peak 141 
 37 THR  HB     46 TYR  HD1     4.50            #peak 998 
 37 THR  QG2    38 GLU  H       3.87            #peak 832 
 37 THR  QG2    46 TYR  H       4.84            #peak 633 
 37 THR  QG2    46 TYR  HA      3.78            #peak 137 
 37 THR  QG2    46 TYR  HD1     2.40            #peak 639 
 37 THR  QG2    46 TYR  HE1     3.14            #peak 20 
 38 GLU  H      38 GLU  HG2     4.48            #peak 838 
 38 GLU  H      38 GLU  HG3     4.48            #peak 838 
 38 GLU  H      38 GLU  QB      3.69            #peak 842
 38 GLU  H      38 GLU  QG      3.89            #peak 838
 38 GLU  H      39 THR  H       4.71            #peak 36 
 38 GLU  H      46 TYR  HA      4.18            #peak 831 
 38 GLU  H      46 TYR  HB3     5.50            #peak 841 
 38 GLU  H      47 GLY  H       4.88            #peak 836 
 38 GLU  HA     38 GLU  QG      2.53            #peak 2956
 38 GLU  HA     39 THR  H       2.99            #peak 39 
 38 GLU  HB2    44 ALA  QB      4.27            #peak 2874
 38 GLU  HB3    44 ALA  QB      4.27            #peak 2874
 38 GLU  HG2    47 GLY  H       5.50            #peak 900 
 38 GLU  HG3    47 GLY  H       5.50            #peak 900 
 38 GLU  QB     38 GLU  QG      2.18            #peak 2879
 38 GLU  QB     39 THR  H       4.06            #peak 34
 38 GLU  QB     40 GLY  H       5.34            #peak 431
 38 GLU  QB     44 ALA  QB      3.63            #peak 2874
 38 GLU  QG     39 THR  H       4.63            #peak 1927
 38 GLU  QG     44 ALA  HA      5.25            #peak 1932
 38 GLU  QG     44 ALA  QB      3.40            #peak 897
 38 GLU  QG     45 ALA  H       4.73            #peak 904
 38 GLU  QG     45 ALA  HA      4.30            #peak 2797
 38 GLU  QG     46 TYR  HA      3.72            #peak 140
 39 THR  H      39 THR  HB      4.19            #peak 31 
 39 THR  H      39 THR  QG2     4.09            #peak 38 
 39 THR  HA     39 THR  HB      2.78            #peak 703 
 39 THR  HA     39 THR  QG2     3.16            #peak 1739
 39 THR  HB     40 GLY  H       4.17            #peak 423 
 39 THR  QG2    40 GLY  H       4.25            #peak 430 
 41 GLU  H      41 GLU  HB2     3.75            #peak 793 
 41 GLU  H      41 GLU  HB3     3.75            #peak 789   
 41 GLU  H      41 GLU  HG2     5.50            #peak 790 
 41 GLU  H      41 GLU  HG3     5.50            #peak 790 
 41 GLU  H      41 GLU  QB      3.35            #peak 317
 41 GLU  H      41 GLU  QG      4.74            #peak 790
 41 GLU  HA     41 GLU  HG2     4.24            #peak 2627
 41 GLU  HA     41 GLU  HG3     4.24            #peak 2627
 41 GLU  HA     41 GLU  QG      3.61            #peak 2627
 41 GLU  HA     42 GLY  H       3.27            #peak 1094
 41 GLU  HB2    42 GLY  H       4.74            #peak 1093
 41 GLU  HB3    42 GLY  H       4.74            #peak 1088
 41 GLU  HG2    42 GLY  H       5.50            #peak 1089
 41 GLU  HG3    42 GLY  H       5.50            #peak 1089  
 41 GLU  QB     41 GLU  QG      4.08            #peak 109
 41 GLU  QB     42 GLY  H       4.12            #peak 1093
 42 GLY  H      43 ALA  QB      5.47            #peak 2303
 42 GLY  HA2    43 ALA  H       3.53            #peak 370 
 42 GLY  HA3    43 ALA  H       3.53            #peak 370 
 42 GLY  QA     43 ALA  H       3.04            #peak 370
 43 ALA  H      43 ALA  QB      4.41            #peak 373 
 43 ALA  H      44 ALA  H       3.48            #peak 701 
 43 ALA  QB     44 ALA  H       4.65            #peak 705 
 43 ALA  QB     63 ASP  HB2     4.50            #peak 969 
 43 ALA  QB     69 LEU  HG      3.39            #peak 2302
 43 ALA  QB     69 LEU  QD1     3.20            #peak 759 
 44 ALA  H      44 ALA  QB      2.99            #peak 699 
 44 ALA  H      45 ALA  H       4.65            #peak 706 
 44 ALA  H      69 LEU  HG      4.40            #peak 707 
 44 ALA  H      69 LEU  QD1     5.50            #peak 1800
 44 ALA  HA     45 ALA  H       3.20            #peak 1023
 44 ALA  HA     46 TYR  H       3.98            #peak 272 
 44 ALA  HA     61 HIS  HB2     5.50            #peak 1257
 44 ALA  HA     61 HIS  HB3     4.61            #peak 1250   
 44 ALA  HA     61 HIS  QB      5.50            #peak 742
 44 ALA  HA     62 LEU  H       5.06            #peak 1006
 44 ALA  HA     62 LEU  HB2     5.50            #peak 2199
 44 ALA  HA     63 ASP  H       4.37            #peak 252 
 44 ALA  HA     63 ASP  HA      4.21            #peak 1267
 44 ALA  HA     63 ASP  HB2     4.45            #peak 1255
 44 ALA  HA     63 ASP  HB3     4.65            #peak 1262
 44 ALA  HA     69 LEU  HB2     4.94            #peak 1884
 44 ALA  HA     69 LEU  HG      3.64            #peak 1266
 44 ALA  QB     45 ALA  H       3.85            #peak 1017
 44 ALA  QB     46 TYR  H       4.27            #peak 263 
 44 ALA  QB     61 HIS  HA      3.74            #peak 233 
 44 ALA  QB     61 HIS  HB2     3.89            #peak 228 
 44 ALA  QB     61 HIS  HB3     3.04            #peak 222 
 44 ALA  QB     61 HIS  HD2     3.58            #peak 243 
 44 ALA  QB     62 LEU  H       4.47            #peak 999 
 44 ALA  QB     69 LEU  HB2     4.58            #peak 848 
 44 ALA  QB     69 LEU  HB3     4.91            #peak 848 
 44 ALA  QB     69 LEU  HG      2.92            #peak 236 
 44 ALA  QB     69 LEU  QD1     3.44            #peak 748 
 45 ALA  H      45 ALA  QB      3.50            #peak 1022
 45 ALA  H      46 TYR  H       3.07            #peak 281 
 45 ALA  H      62 LEU  HB3     5.25            #peak 1021
 45 ALA  H      63 ASP  HA      3.89            #peak 1029
 45 ALA  H      63 ASP  HB2     5.08            #peak 1020
 45 ALA  H      63 ASP  HB3     5.08            #peak 1026
 45 ALA  QB     46 TYR  H       3.47            #peak 270 
 45 ALA  QB     63 ASP  HA      4.29            #peak 3012
 45 ALA  QB     63 ASP  HB2     5.50            #peak 1181
 45 ALA  QB     63 ASP  HB3     5.47            #peak 1184
 45 ALA  QB     64 ARG  H       4.70            #peak 1183
 45 ALA  QB     64 ARG  HB2     4.99            #peak 2747
 45 ALA  QB     64 ARG  HG2     3.33            #peak 1716
 46 TYR  H      46 TYR  HB2     3.79            #peak 273 
 46 TYR  H      46 TYR  HB3     4.00            #peak 279
 46 TYR  H      46 TYR  HD2     4.53            #peak 55 
 46 TYR  H      46 TYR  HE2     4.49            #peak 271
 46 TYR  H      47 GLY  H       4.62            #peak 274 
 46 TYR  H      62 LEU  H       3.78            #peak 280 
 46 TYR  H      62 LEU  HB2     3.67            #peak 277 
 46 TYR  H      62 LEU  HB3     4.20            #peak 269 
 46 TYR  H      62 LEU  HG      5.50            #peak 91
 46 TYR  H      63 ASP  H       4.64            #peak 265 
 46 TYR  H      63 ASP  HA      4.44            #peak 283 
 46 TYR  HA     46 TYR  HD1     3.00            #peak 226 
 46 TYR  HA     46 TYR  HE1     5.50            #peak 114 
 46 TYR  HA     47 GLY  H       3.20            #peak 618 
 46 TYR  HA     62 LEU  HB3     5.50            #peak 1142
 46 TYR  HB2    46 TYR  HD2     2.55            #peak 1550
 46 TYR  HB2    47 GLY  H       4.25            #peak 628 
 46 TYR  HB2    62 LEU  H       4.52            #peak 1007
 46 TYR  HB2    62 LEU  HB2     3.65            #peak 2200
 46 TYR  HB2    62 LEU  HB3     3.71            #peak 1542
 46 TYR  HB2    62 LEU  HG      3.67            #peak 97
 46 TYR  HB2    62 LEU  QD2     4.74            #peak 2120
 46 TYR  HB2    66 PHE  HA      4.46            #peak 2576
 46 TYR  HB2    66 PHE  HE2     4.36            #peak 210 
 46 TYR  HB2    66 PHE  HZ      4.41            #peak 1543
 46 TYR  HB3    46 TYR  HD1     2.40            #peak 2624
 46 TYR  HB3    46 TYR  HE1     4.92            #peak 129 
 46 TYR  HB3    47 GLY  H       3.83            #peak 637 
 46 TYR  HB3    47 GLY  HA3     5.41            #peak 2621
 46 TYR  HB3    62 LEU  H       5.50            #peak 1014
 46 TYR  HB3    62 LEU  HB2     3.70            #peak 2619
 46 TYR  HB3    62 LEU  HB3     4.54            #peak 2615
 46 TYR  HB3    62 LEU  HG      4.35            #peak 2608
 46 TYR  HB3    66 PHE  HA      5.50            #peak 2621
 46 TYR  HB3    66 PHE  HE1     5.47            #peak 2611
 46 TYR  HB3    66 PHE  HZ      3.61            #peak 2616
 46 TYR  HD1    47 GLY  H       4.81            #peak 624 
 46 TYR  HD1    66 PHE  HZ      4.26            #peak 147 
 46 TYR  HD2    62 LEU  HB2     3.17            #peak 237 
 46 TYR  HD2    62 LEU  HB3     3.07            #peak 232 
 46 TYR  HD2    64 ARG  HA      4.16            #peak 57
 46 TYR  HD2    66 PHE  H       4.55            #peak 151 
 46 TYR  HE2    62 LEU  HB2     5.50            #peak 126 
 46 TYR  HE2    62 LEU  HB3     5.02            #peak 1143
 46 TYR  HE2    64 ARG  HA      3.40            #peak 869 
 46 TYR  HE2    64 ARG  HB2     5.00            #peak 131 
 46 TYR  HE2    64 ARG  HB3     4.35            #peak 119 
 46 TYR  HE2    65 ASP  H       5.50            #peak 937 
 46 TYR  HE2    66 PHE  H       4.00            #peak 130 
 46 TYR  HE2    66 PHE  HA      4.09            #peak 2573
 46 TYR  HE2    66 PHE  HB2     5.50            #peak 463 
 47 GLY  H      48 VAL  HA      4.88            #peak 634 
 47 GLY  H      62 LEU  HB2     5.23            #peak 631 
 47 GLY  H      62 LEU  QD2     5.50            #peak 2112
 47 GLY  HA2    48 VAL  H       3.41            #peak 944 
 47 GLY  HA2    61 HIS  HA      3.33            #peak 2277
 47 GLY  HA2    61 HIS  HD2     4.18            #peak 244 
 47 GLY  HA2    62 LEU  H       4.45            #peak 1000
 47 GLY  HA3    61 HIS  HA      4.49            #peak 2286
 47 GLY  HA3    61 HIS  HD2     4.46            #peak 252 
 47 GLY  HA3    62 LEU  H       4.27            #peak 1013
 47 GLY  HA3    62 LEU  QD2     4.12            #peak 2124
 48 VAL  H      48 VAL  HB      3.52            #peak 943 
 48 VAL  H      48 VAL  QG1     4.67            #peak 951 
 48 VAL  H      48 VAL  QG2     4.67            #peak 1342
 48 VAL  H      48 VAL  QQG     3.41            #peak 951
 48 VAL  H      49 LEU  H       4.76            #peak 175 
 48 VAL  H      60 VAL  HB      4.28            #peak 947 
 48 VAL  H      61 HIS  HA      4.60            #peak 950 
 48 VAL  HA     48 VAL  QG1     3.67            #peak 2387
 48 VAL  HA     48 VAL  QG2     3.67            #peak 1336
 48 VAL  HA     48 VAL  QQG     3.09            #peak 1336
 48 VAL  HA     49 LEU  H       3.17            #peak 164 
 48 VAL  HB     60 VAL  H       4.27            #peak 360 
 48 VAL  HB     60 VAL  HB      4.56            #peak 373 
 48 VAL  QQG    49 LEU  H       3.54            #peak 169
 48 VAL  QQG    49 LEU  HA      3.41            #peak 1175
 48 VAL  QQG    49 LEU  HB3     5.22            #peak 1344
 48 VAL  QQG    60 VAL  H       2.69            #peak 367
 48 VAL  QQG    60 VAL  HA      4.81            #peak 1341
 48 VAL  QQG    60 VAL  QQG     2.64            #peak 2231  
 49 LEU  H      49 LEU  HB2     3.86            #peak 178
 49 LEU  H      49 LEU  HB3     3.00            #peak 176 
 49 LEU  H      49 LEU  HG      4.01            #peak 170 
 49 LEU  H      49 LEU  QD1     4.26            #peak 1089
 49 LEU  H      49 LEU  QD2     5.50            #peak 15 
 49 LEU  H      50 VAL  H       4.72            #peak 534 
 49 LEU  H      50 VAL  QQG     5.44            #peak 1909
 49 LEU  HA     49 LEU  HG      3.95            #peak 2010
 49 LEU  HA     49 LEU  QD1     3.51            #peak 1095
 49 LEU  HA     49 LEU  QD2     5.12            #peak 20 
 49 LEU  HA     50 VAL  H       2.83            #peak 540 
 49 LEU  HA     50 VAL  QQG     3.79            #peak 1175
 49 LEU  HB2    49 LEU  HG      3.00            #peak 2150
 49 LEU  HB2    49 LEU  QD1     2.40            #peak 1108
 49 LEU  HB2    49 LEU  QD2     2.70            #peak 24 
 49 LEU  HB2    50 VAL  H       3.54            #peak 538
 49 LEU  HB2    57 ARG  QD      4.35            #peak 4
 49 LEU  HB3    49 LEU  HG      2.70            #peak 2016
 49 LEU  HB3    49 LEU  QD1     3.25            #peak 125
 49 LEU  HB3    49 LEU  QD2     2.40            #peak 29 
 49 LEU  HB3    50 VAL  H       5.50            #peak 127
 49 LEU  QD1    57 ARG  HA      4.65            #peak 1103  
 49 LEU  QD1    57 ARG  HG2     4.38            #peak 2935
 49 LEU  QD1    57 ARG  HG3     4.63            #peak 2935
 49 LEU  QD1    57 ARG  QD      3.08            #peak 1086  
 49 LEU  QQD    57 ARG  QB      4.07            #peak 700
 49 LEU  QQD    60 VAL  H       5.50            #peak 302
 50 VAL  H      50 VAL  HB      3.65            #peak 549 
 50 VAL  H      50 VAL  QQG     3.11            #peak 543
 50 VAL  H      51 THR  H       4.81            #peak 877 
 50 VAL  H      51 THR  HA      5.50            #peak 2774
 50 VAL  H      57 ARG  HB2     5.50            #peak 2000
 50 VAL  H      57 ARG  HB3     5.50            #peak 983 
 50 VAL  H      57 ARG  HG3     3.63            #peak 533 
 50 VAL  H      58 VAL  H       3.97            #peak 778 
 50 VAL  H      59 GLU  H       5.50            #peak 537 
 50 VAL  H      59 GLU  HA      5.50            #peak 548 
 50 VAL  H      60 VAL  H       5.24            #peak 537 
 50 VAL  HA     50 VAL  QG1     3.71            #peak 1914
 50 VAL  HA     50 VAL  QG2     3.71            #peak 880 
 50 VAL  HA     50 VAL  QQG     2.88            #peak 880
 50 VAL  HA     51 THR  H       3.42            #peak 876 
 50 VAL  QG1    51 THR  H       4.13            #peak 1910
 50 VAL  QG2    51 THR  H       4.33            #peak 882 
 50 VAL  QQG    51 THR  H       2.93            #peak 882
 50 VAL  QQG    57 ARG  HG3     4.62            #peak 2932
 50 VAL  QQG    58 VAL  HA      5.44            #peak 1923
 50 VAL  QQG    59 GLU  H       5.44            #peak 1921
 50 VAL  QQG    60 VAL  H       5.44            #peak 1921
 51 THR  H      51 THR  HB      3.69            #peak 4 
 51 THR  H      51 THR  QG2     3.80            #peak 872 
 51 THR  H      52 ARG  H       4.54            #peak 871 
 51 THR  H      57 ARG  HG3     5.50            #peak 2936
 51 THR  H      57 ARG  QD      5.34            #peak 1080
 51 THR  HA     51 THR  QG2     3.29            #peak 699
 51 THR  HA     52 ARG  H       3.19            #peak 84 
 51 THR  HA     57 ARG  HA      2.91            #peak 2140
 51 THR  HA     58 VAL  H       4.18            #peak 784
 51 THR  HB     52 ARG  H       4.61            #peak 75 
 51 THR  QG2    52 ARG  H       3.38            #peak 71 
 51 THR  QG2    53 PRO  HA      4.67            #peak 589 
 51 THR  QG2    53 PRO  QD      5.28            #peak 1509
 51 THR  QG2    54 ASP  H       5.01            #peak 467 
 51 THR  QG2    55 GLY  H       4.05            #peak 823 
 51 THR  QG2    55 GLY  HA2     3.41            #peak 2292   
 51 THR  QG2    57 ARG  H       5.19            #peak 409 
 51 THR  QG2    57 ARG  HA      3.62            #peak 2129
 51 THR  QG2    57 ARG  HB2     3.60            #peak 691 
 51 THR  QG2    57 ARG  QD      3.73            #peak 685
 51 THR  QG2    58 VAL  H       5.13            #peak 692 
 52 ARG  H      52 ARG  HD2     5.50            #peak 80 
 52 ARG  H      52 ARG  HD3     5.50            #peak 80 
 52 ARG  H      52 ARG  QD      4.84            #peak 80
 52 ARG  H      52 ARG  QG      4.12            #peak 82
 52 ARG  H      55 GLY  H       4.86            #peak 78 
 52 ARG  H      56 THR  H       4.27            #peak 16 
 52 ARG  H      57 ARG  HA      4.06            #peak 77 
 52 ARG  H      58 VAL  QQG     4.94            #peak 2759
 52 ARG  HA     52 ARG  HD2     3.93            #peak 2419
 52 ARG  HA     52 ARG  HD3     3.53            #peak 2419
 52 ARG  HA     52 ARG  QD      3.40            #peak 2419
 52 ARG  HA     52 ARG  QG      3.68            #peak 1381
 52 ARG  HA     53 PRO  HD2     3.29            #peak 2601
 52 ARG  HA     53 PRO  HD3     2.79            #peak 1374
 52 ARG  HB2    53 PRO  HD2     4.63            #peak 2535
 52 ARG  HB2    53 PRO  HD3     4.63            #peak 2528
 52 ARG  HB2    54 ASP  H       4.66            #peak 476 
 52 ARG  HB2    55 GLY  H       5.05            #peak 829 
 52 ARG  HB2    56 THR  H       5.01            #peak 28 
 52 ARG  HB2    56 THR  HB      5.50            #peak 533 
 52 ARG  HB3    53 PRO  HD2     4.63            #peak 2597
 52 ARG  HB3    53 PRO  HD3     4.63            #peak 2528
 52 ARG  HB3    54 ASP  H       4.66            #peak 476 
 52 ARG  HB3    55 GLY  H       5.05            #peak 829 
 52 ARG  HB3    56 THR  H       5.01            #peak 28 
 52 ARG  HB3    56 THR  HB      5.50            #peak 533
 52 ARG  HG2    54 ASP  H       5.50            #peak 478
 52 ARG  HG2    56 THR  H       5.50            #peak 24 
 52 ARG  HG3    54 ASP  H       5.50            #peak 478
 52 ARG  HG3    56 THR  H       5.50            #peak 24 
 52 ARG  QB     52 ARG  QD      2.62            #peak 2423
 52 ARG  QB     53 PRO  QD      4.68            #peak 2597
 52 ARG  QB     54 ASP  H       4.65            #peak 476  
 52 ARG  QB     55 GLY  H       4.23            #peak 829
 52 ARG  QB     56 THR  H       4.15            #peak 28
 52 ARG  QB     56 THR  HB      4.75            #peak 533     
 52 ARG  QD     56 THR  HB      4.45            #peak 1260
 52 ARG  QG     52 ARG  QD      2.24            #peak 416
 52 ARG  QG     53 PRO  QD      4.00            #peak 2651   
 52 ARG  QG     56 THR  H       5.50            #peak 857
 53 PRO  HD2    54 ASP  H       4.22            #peak 477 
 53 PRO  HD3    54 ASP  H       4.22            #peak 471 
 53 PRO  QB     54 ASP  H       4.07            #peak 465
 53 PRO  QD     54 ASP  H       3.70            #peak 477
 53 PRO  QD     55 GLY  H       5.35            #peak 605
 54 ASP  H      54 ASP  HB2     3.68            #peak 463 
 54 ASP  H      54 ASP  HB3     3.68            #peak 470 
 54 ASP  H      54 ASP  QB      3.23            #peak 470
 54 ASP  H      55 GLY  H       3.80            #peak 825 
 54 ASP  H      56 THR  H       4.26            #peak 462 
 54 ASP  H      56 THR  HB      5.27            #peak 2216
 54 ASP  H      56 THR  QG2     4.60            #peak 1168
 54 ASP  HB2    55 GLY  H       5.06            #peak 820 
 54 ASP  HB3    55 GLY  H       5.06            #peak 826 
 54 ASP  QB     55 GLY  H       4.34            #peak 826
 54 ASP  QB     56 THR  H       4.08            #peak 15
 54 ASP  QB     56 THR  HB      3.81            #peak 2213
 55 GLY  H      56 THR  H       3.19            #peak 26   
 55 GLY  H      56 THR  QG2     4.77            #peak 119
 55 GLY  HA2    56 THR  H       3.35            #peak 14 
 56 THR  H      56 THR  HB      3.01            #peak 25 
 56 THR  H      56 THR  QG2     2.85            #peak 20 
 56 THR  H      57 ARG  H       4.54            #peak 19 
 56 THR  HA     56 THR  HB      2.70            #peak 2212
 56 THR  HA     56 THR  QG2     3.21            #peak 1165
 56 THR  HA     57 ARG  H       2.77            #peak 408 
 56 THR  HA     57 ARG  HA      4.52            #peak 220 
 56 THR  HA     57 ARG  HB2     4.52            #peak 219 
 56 THR  HA     57 ARG  HB3     4.94            #peak 216 
 56 THR  HB     57 ARG  H       5.50            #peak 2214  
 56 THR  QG2    57 ARG  H       3.74            #peak 413 
 57 ARG  H      57 ARG  HB2     3.79            #peak 416  
 57 ARG  H      57 ARG  HB3     3.78            #peak 40
 57 ARG  H      57 ARG  HG2     4.73            #peak 420 
 57 ARG  H      57 ARG  HG3     4.53            #peak 420 
 57 ARG  H      57 ARG  QD      4.51            #peak 411
 57 ARG  H      58 VAL  H       4.63            #peak 777 
 57 ARG  H      74 ALA  H       5.00            #peak 387 
 57 ARG  H      74 ALA  QB      5.50            #peak 409 
 57 ARG  HA     57 ARG  HD2     5.23            #peak 2132
 57 ARG  HA     57 ARG  HD3     5.23            #peak 2132
 57 ARG  HA     57 ARG  HG3     4.09            #peak 2940
 57 ARG  HA     57 ARG  QD      4.57            #peak 2132
 57 ARG  HA     58 VAL  H       3.12            #peak 782 
 57 ARG  HA     58 VAL  QQG     3.94            #peak 2133
 57 ARG  HB2    57 ARG  QD      3.52            #peak 9
 57 ARG  HB2    74 ALA  H       5.50            #peak 399 
 57 ARG  HB2    74 ALA  QB      4.74            #peak 1993
 57 ARG  HB3    57 ARG  HG2     2.40            #peak 987 
 57 ARG  HB3    57 ARG  QD      3.50            #peak 974
 57 ARG  HB3    74 ALA  QB      3.02            #peak 431 
 57 ARG  HD2    58 VAL  H       5.50            #peak 776 
 57 ARG  HD2    74 ALA  QB      5.50            #peak 427 
 57 ARG  HD3    58 VAL  H       5.50            #peak 776 
 57 ARG  HD3    74 ALA  QB      5.50            #peak 427 
 57 ARG  HG3    58 VAL  H       4.13            #peak 786 
 57 ARG  QD     74 ALA  QB      4.69            #peak 427
 58 VAL  H      58 VAL  HB      3.75            #peak 779 
 58 VAL  H      58 VAL  QQG     3.89            #peak 783
 58 VAL  H      59 GLU  H       4.76            #peak 1080
 58 VAL  H      74 ALA  QB      4.60            #peak 436 
 58 VAL  HA     58 VAL  QG1     3.28            #peak 784 
 58 VAL  HA     58 VAL  QG2     3.28            #peak 784 
 58 VAL  HA     58 VAL  QQG     2.75            #peak 784
 58 VAL  HA     59 GLU  H       2.99            #peak 1084
 58 VAL  HA     73 PRO  HB2     5.50            #peak 2669
 58 VAL  HA     73 PRO  HB3     5.50            #peak 2669
 58 VAL  HA     73 PRO  QB      4.81            #peak 2669
 58 VAL  HA     74 ALA  H       4.28            #peak 404 
 58 VAL  HA     74 ALA  QB      3.77            #peak 438 
 58 VAL  QG1    73 PRO  HA      4.48            #peak 2731
 58 VAL  QG1    74 ALA  H       5.50            #peak 777 
 58 VAL  QG2    73 PRO  HA      4.48            #peak 2731
 58 VAL  QG2    74 ALA  H       5.50            #peak 777 
 58 VAL  QQG    59 GLU  H       3.17            #peak 1075
 58 VAL  QQG    60 VAL  HA      4.32            #peak 2767
 58 VAL  QQG    73 PRO  HA      3.71            #peak 2731
 59 GLU  H      59 GLU  HG2     4.95            #peak 1081
 59 GLU  H      59 GLU  HG3     4.95            #peak 1081
 59 GLU  H      59 GLU  QG      4.24            #peak 1081
 59 GLU  H      72 GLU  H       4.31            #peak 1070
 59 GLU  H      73 PRO  HA      5.50            #peak 2732
 59 GLU  H      74 ALA  H       4.11            #peak 405 
 59 GLU  H      74 ALA  HA      5.50            #peak 1489
 59 GLU  H      74 ALA  QB      4.39            #peak 1071   
 59 GLU  HA     59 GLU  HG2     4.13            #peak 2378
 59 GLU  HA     59 GLU  HG3     4.13            #peak 1492
 59 GLU  HA     60 VAL  H       3.21            #peak 361    
 59 GLU  HG2    60 VAL  H       5.50            #peak 366 
 59 GLU  HG2    73 PRO  HA      5.50            #peak 2728
 59 GLU  HG2    74 ALA  HA      5.50            #peak 1487
 59 GLU  HG3    60 VAL  H       5.50            #peak 366 
 59 GLU  HG3    73 PRO  HA      5.50            #peak 2728
 59 GLU  HG3    74 ALA  HA      5.50            #peak 2589
 59 GLU  QB     74 ALA  H       5.34            #peak 399
 59 GLU  QB     74 ALA  QB      2.86            #peak 434
 59 GLU  QG     74 ALA  HA      4.63            #peak 1487
 60 VAL  H      60 VAL  HB      3.88            #peak 358 
 60 VAL  H      60 VAL  QQG     3.39            #peak 363
 60 VAL  H      61 HIS  H       4.71            #peak 685 
 60 VAL  HA     60 VAL  QG1     3.39            #peak 2457
 60 VAL  HA     60 VAL  QG2     3.39            #peak 2457
 60 VAL  HA     60 VAL  QQG     2.90            #peak 2457
 60 VAL  HA     61 HIS  H       3.05            #peak 696 
 60 VAL  HA     61 HIS  HD2     5.36            #peak 2461
 60 VAL  HA     71 THR  HA      3.12            #peak 2456
 60 VAL  HA     71 THR  QG2     3.70            #peak 2460
 60 VAL  HA     72 GLU  H       3.97            #peak 874 
 60 VAL  HB     61 HIS  H       4.39            #peak 689 
 60 VAL  HB     61 HIS  HA      5.50            #peak 2283
 60 VAL  HB     70 ASP  H       5.50            #peak 452 
 60 VAL  HB     71 THR  HA      5.32            #peak 1409
 60 VAL  QG1    71 THR  HA      4.54            #peak 2229
 60 VAL  QG2    71 THR  HA      4.54            #peak 2229
 60 VAL  QQG    61 HIS  H       3.66            #peak 695
 60 VAL  QQG    61 HIS  HA      4.21            #peak 2276
 60 VAL  QQG    62 LEU  HA      5.44            #peak 361
 60 VAL  QQG    69 LEU  H       5.42            #peak 2370
 60 VAL  QQG    71 THR  HA      3.93            #peak 2229
 60 VAL  QQG    71 THR  QG2     3.02            #peak 248
 61 HIS  H      61 HIS  HB2     3.56            #peak 686 
 61 HIS  H      61 HIS  HB3     3.85            #peak 682 
 61 HIS  H      61 HIS  HD2     5.50            #peak 248 
 61 HIS  H      62 LEU  H       4.66            #peak 697 
 61 HIS  H      68 VAL  HA      5.14            #peak 688 
 61 HIS  H      69 LEU  HB2     5.24            #peak 692 
 61 HIS  H      69 LEU  HB3     5.50            #peak 692 
 61 HIS  H      70 ASP  H       4.04            #peak 455 
 61 HIS  H      71 THR  HA      4.03            #peak 691 
 61 HIS  HA     61 HIS  HD2     3.74            #peak 250 
 61 HIS  HA     69 LEU  HB2     4.30            #peak 2282
 61 HIS  HA     70 ASP  H       5.50            #peak 458 
 61 HIS  HB2    62 LEU  H       4.44            #peak 1005
 61 HIS  HB2    62 LEU  QD1     5.50            #peak 2116
 61 HIS  HB2    62 LEU  QD2     5.50            #peak 2116
 61 HIS  HB2    68 VAL  HA      5.27            #peak 1235
 61 HIS  HB2    69 LEU  H       5.14            #peak 57 
 61 HIS  HB2    69 LEU  HB2     4.28            #peak 1891
 61 HIS  HB2    69 LEU  HB3     4.43            #peak 1891
 61 HIS  HB2    69 LEU  HG      4.40            #peak 1238
 61 HIS  HB2    70 ASP  H       4.03            #peak 450 
 61 HIS  HB3    61 HIS  HD2     3.96            #peak 242 
 61 HIS  HB3    62 LEU  H       4.22            #peak 998 
 61 HIS  HB3    62 LEU  QD2     5.50            #peak 2113
 61 HIS  HB3    68 VAL  HA      5.50            #peak 71
 61 HIS  HB3    69 LEU  H       5.32            #peak 51
 61 HIS  HB3    69 LEU  HA      5.10            #peak 349 
 61 HIS  HB3    69 LEU  HB2     4.92            #peak 1886
 61 HIS  HB3    69 LEU  HB3     5.26            #peak 1886
 61 HIS  HB3    69 LEU  HG      3.39            #peak 212 
 61 HIS  HD2    62 LEU  H       5.50            #peak 253 
 61 HIS  HE1    70 ASP  QB      4.88            #peak 192
 61 HIS  HE1    72 GLU  HG2     5.50            #peak 199 
 61 HIS  HE1    72 GLU  HG3     5.50            #peak 199 
 61 HIS  HE1    72 GLU  QB      5.34            #peak 2255
 62 LEU  H      62 LEU  HB2     4.02            #peak 1010
 62 LEU  H      62 LEU  HB3     3.95            #peak 1004
 62 LEU  H      62 LEU  HG      4.55            #peak 996 
 62 LEU  H      62 LEU  QD2     4.90            #peak 1009
 62 LEU  H      63 ASP  H       4.55            #peak 1001
 62 LEU  H      68 VAL  HA      5.50            #peak 83 
 62 LEU  HA     62 LEU  HG      3.91            #peak 107 
 62 LEU  HA     62 LEU  QD1     2.40            #peak 119 
 62 LEU  HA     63 ASP  H       3.23            #peak 244 
 62 LEU  HA     66 PHE  HA      4.21            #peak 117 
 62 LEU  HA     68 VAL  HA      3.25            #peak 69 
 62 LEU  HA     68 VAL  HB      5.50            #peak 2105
 62 LEU  HA     69 LEU  H       4.05            #peak 50 
 62 LEU  HA     69 LEU  HB2     4.21            #peak 114 
 62 LEU  HA     69 LEU  HG      4.97            #peak 2837
 62 LEU  HA     70 ASP  H       5.50            #peak 458 
 62 LEU  HB2    62 LEU  QD2     3.96            #peak 2123
 62 LEU  HB2    63 ASP  H       3.94            #peak 257 
 62 LEU  HB2    66 PHE  HA      3.76            #peak 2207
 62 LEU  HB2    66 PHE  HD2     5.50            #peak 172 
 62 LEU  HB2    66 PHE  HE2     4.06            #peak 222 
 62 LEU  HB3    62 LEU  HG      2.83            #peak 94 
 62 LEU  HB3    62 LEU  QD1     3.24            #peak 2115
 62 LEU  HB3    63 ASP  H       3.33            #peak 251 
 62 LEU  HB3    66 PHE  H       4.17            #peak 139 
 62 LEU  HB3    66 PHE  HA      3.02            #peak 2572
 62 LEU  HB3    66 PHE  HB2     5.09            #peak 456 
 62 LEU  HB3    66 PHE  HB3     4.56            #peak 1508
 62 LEU  HB3    66 PHE  HD2     2.64            #peak 1158
 62 LEU  HB3    66 PHE  HE2     4.00            #peak 215 
 62 LEU  HB3    68 VAL  HA      5.20            #peak 1139
 62 LEU  HG     66 PHE  HA      3.73            #peak 2563
 62 LEU  HG     66 PHE  HB3     4.77            #peak 1500
 62 LEU  HG     66 PHE  HD2     3.94            #peak 102 
 62 LEU  HG     66 PHE  HE2     3.06            #peak 205 
 62 LEU  HG     66 PHE  HZ      5.50            #peak 133 
 62 LEU  QD1    63 ASP  H       4.06            #peak 253 
 62 LEU  QD1    66 PHE  HA      4.21            #peak 2580
 62 LEU  QD1    66 PHE  HB2     5.50            #peak 465 
 62 LEU  QD1    66 PHE  HB3     5.37            #peak 2118
 62 LEU  QD1    66 PHE  HD2     5.30            #peak 1073
 62 LEU  QD1    67 ARG  HA      4.29            #peak 2929
 62 LEU  QD1    68 VAL  HA      2.55            #peak 84 
 62 LEU  QD1    69 LEU  H       5.50            #peak 2112
 62 LEU  QD1    70 ASP  H       4.97            #peak 456 
 62 LEU  QD2    66 PHE  HE2     3.78            #peak 214 
 62 LEU  QD2    70 ASP  H       5.50            #peak 2117
 63 ASP  H      63 ASP  HB2     4.01            #peak 249 
 63 ASP  H      63 ASP  HB3     3.83            #peak 256 
 63 ASP  H      64 ARG  H       4.63            #peak 602 
 63 ASP  H      66 PHE  H       4.41            #peak 136 
 63 ASP  H      66 PHE  HA      4.48            #peak 258 
 63 ASP  H      67 ARG  H       3.67            #peak 522 
 63 ASP  H      68 VAL  HA      5.45            #peak 252 
 63 ASP  H      69 LEU  H       4.73            #peak 245 
 63 ASP  HA     64 ARG  H       3.46            #peak 617 
 63 ASP  HA     69 LEU  HG      4.10            #peak 2853
 63 ASP  HA     69 LEU  QD2     5.14            #peak 3012
 63 ASP  HB2    64 ARG  H       3.11            #peak 606 
 63 ASP  HB2    64 ARG  HG3     4.46            #peak 967 
 63 ASP  HB2    65 ASP  H       4.34            #peak 935 
 63 ASP  HB2    69 LEU  HB2     5.50            #peak 1890
 63 ASP  HB2    69 LEU  HG      4.56            #peak 972 
 63 ASP  HB2    69 LEU  QD2     2.79            #peak 963 
 63 ASP  HB3    64 ARG  H       3.79            #peak 613 
 63 ASP  HB3    65 ASP  H       5.50            #peak 1979
 63 ASP  HB3    66 PHE  H       5.50            #peak 1979
 63 ASP  HB3    67 ARG  H       5.50            #peak 336 
 63 ASP  HB3    69 LEU  HG      4.21            #peak 2849
 63 ASP  HB3    69 LEU  QD2     2.40            #peak 1985
 64 ARG  H      64 ARG  HB2     3.28            #peak 615 
 64 ARG  H      64 ARG  HB3     3.81            #peak 604 
 64 ARG  H      64 ARG  HD2     5.50            #peak 616 
 64 ARG  H      64 ARG  HD3     5.50            #peak 616 
 64 ARG  H      64 ARG  HG2     2.77            #peak 610 
 64 ARG  H      64 ARG  HG3     2.85            #peak 610 
 64 ARG  H      64 ARG  QD      4.81            #peak 616
 64 ARG  H      65 ASP  H       3.55            #peak 939 
 64 ARG  H      66 PHE  H       4.52            #peak 144 
 64 ARG  HA     64 ARG  HD2     5.50            #peak 872 
 64 ARG  HA     64 ARG  HD3     5.50            #peak 872 
 64 ARG  HA     64 ARG  HG2     2.85            #peak 867 
 64 ARG  HA     64 ARG  QD      4.82            #peak 872
 64 ARG  HA     66 PHE  H       5.50            #peak 870 
 64 ARG  HB2    64 ARG  HG3     2.40            #peak 2754
 64 ARG  HB3    64 ARG  HD2     4.08            #peak 2855
 64 ARG  HB3    64 ARG  HD3     4.08            #peak 2855
 64 ARG  HB3    64 ARG  HG2     2.70            #peak 769  
 64 ARG  HB3    64 ARG  QD      3.49            #peak 2855  
 64 ARG  HB3    65 ASP  H       4.25            #peak 933  
 64 ARG  HG3    65 ASP  H       3.73            #peak 667   
 64 ARG  QG     65 ASP  H       4.15            #peak 2364   
 64 ARG  QG     66 PHE  H       5.15            #peak 2367   
 64 ARG  QG     69 LEU  QQD     5.00            #peak 2484
 65 ASP  H      65 ASP  HB2     3.67            #peak 938     
 65 ASP  H      65 ASP  HB3     3.75            #peak 571     
 65 ASP  H      67 ARG  QB      5.34            #peak 930
 65 ASP  HA     66 PHE  HB3     5.44            #peak 2682
 65 ASP  HA     66 PHE  HD1     5.50            #peak 175 
 65 ASP  HA     67 ARG  H       4.78            #peak 530 
 65 ASP  HB2    67 ARG  H       4.80            #peak 519 
 65 ASP  HB2    67 ARG  HA      5.50            #peak 349 
 65 ASP  HB3    66 PHE  H       4.77            #peak 134 
 66 PHE  H      66 PHE  HB2     3.48            #peak 143 
 66 PHE  H      66 PHE  HB3     4.02            #peak 142 
 66 PHE  H      66 PHE  HD1     5.50            #peak 161 
 66 PHE  H      66 PHE  HD2     5.50            #peak 161 
 66 PHE  H      67 ARG  H       3.25            #peak 520 
 66 PHE  H      67 ARG  QB      4.36            #peak 131
 66 PHE  HA     66 PHE  HD2     4.31            #peak 2582
 66 PHE  HA     66 PHE  HE1     5.50            #peak 110 
 66 PHE  HB2    67 ARG  H       5.39            #peak 519 
 66 PHE  HB3    67 ARG  H       4.83            #peak 526 
 67 ARG  H      67 ARG  HB2     3.56            #peak 517 
 67 ARG  H      67 ARG  HB3     3.56            #peak 531 
 67 ARG  H      67 ARG  HD2     5.50            #peak 528 
 67 ARG  H      67 ARG  HD3     5.50            #peak 528 
 67 ARG  H      67 ARG  HG2     5.50            #peak 1225
 67 ARG  H      67 ARG  HG3     5.50            #peak 1225
 67 ARG  H      67 ARG  QB      3.03            #peak 517
 67 ARG  HA     67 ARG  HD2     5.04            #peak 2360
 67 ARG  HA     67 ARG  HD3     5.04            #peak 354 
 67 ARG  HA     67 ARG  QG      3.10            #peak 2927
 67 ARG  HA     68 VAL  H       2.86            #peak 859 
 67 ARG  HD2    68 VAL  H       5.50            #peak 867 
 67 ARG  HD3    68 VAL  H       5.50            #peak 867 
 67 ARG  QB     67 ARG  QD      3.30            #peak 2271
 67 ARG  QB     68 VAL  H       3.96            #peak 866
 67 ARG  QG     68 VAL  H       2.53            #peak 864
 67 ARG  QG     68 VAL  HB      5.19            #peak 2013
 67 ARG  QG     68 VAL  QQG     3.41            #peak 3003
 68 VAL  H      68 VAL  HB      3.04            #peak 865 
 68 VAL  H      68 VAL  QQG     3.31            #peak 870
 68 VAL  H      69 LEU  H       4.56            #peak 858 
 68 VAL  HA     68 VAL  HB      2.40            #peak 2254
 68 VAL  HA     68 VAL  QG1     3.45            #peak 86 
 68 VAL  HA     68 VAL  QG2     3.45            #peak 2998
 68 VAL  HA     68 VAL  QQG     2.41            #peak 86
 68 VAL  HA     69 LEU  H       3.35            #peak 49 
 68 VAL  HA     69 LEU  HB2     4.30            #peak 77    
 68 VAL  HA     69 LEU  HG      5.50            #peak 1897
 68 VAL  HA     70 ASP  H       4.23            #peak 444 
 68 VAL  HB     69 LEU  H       4.73            #peak 61 
 68 VAL  HB     70 ASP  H       5.50            #peak 452 
 68 VAL  QQG    69 LEU  H       2.69            #peak 66
 68 VAL  QQG    70 ASP  H       2.74            #peak 454
 68 VAL  QQG    70 ASP  QB      5.28            #peak 1708
 69 LEU  H      69 LEU  HB2     3.85            #peak 60 
 69 LEU  H      69 LEU  HG      5.12            #peak 2840
 69 LEU  H      69 LEU  QD2     3.97            #peak 1796
 69 LEU  H      70 ASP  H       3.36            #peak 446 
 69 LEU  HA     69 LEU  HG      3.75            #peak 2852
 69 LEU  HA     69 LEU  QD1     2.71            #peak 1806
 69 LEU  HA     69 LEU  QD2     2.82            #peak 1806
 69 LEU  HB2    69 LEU  QD2     2.60            #peak 757 
 69 LEU  HB2    70 ASP  H       3.61            #peak 448 
 69 LEU  HB3    69 LEU  QD1     2.77            #peak 757 
 69 LEU  HB3    70 ASP  H       3.80            #peak 448 
 69 LEU  HB3    70 ASP  QB      4.17            #peak 850
 69 LEU  QD2    70 ASP  QB      5.34            #peak 1708
 70 ASP  H      70 ASP  QB      3.70            #peak 453
 70 ASP  H      71 THR  H       4.41            #peak 813 
 70 ASP  HA     71 THR  H       2.98            #peak 817 
 70 ASP  HB2    71 THR  H       4.26            #peak 814 
 70 ASP  HB3    71 THR  H       4.26            #peak 811 
 70 ASP  QB     71 THR  H       3.67            #peak 811
 71 THR  H      71 THR  HB      3.98            #peak 812 
 71 THR  H      71 THR  QG2     3.92            #peak 818 
 71 THR  H      72 GLU  H       4.31            #peak 810 
 71 THR  HA     71 THR  QG2     3.30            #peak 242 
 71 THR  HA     72 GLU  H       2.72            #peak 7  
 71 THR  HA     72 GLU  QB      5.34            #peak 1871
 71 THR  HB     72 GLU  H       4.50            #peak 401
 71 THR  QG2    72 GLU  H       4.33            #peak 11 
 72 GLU  H      72 GLU  HG2     5.10            #peak 10 
 72 GLU  H      72 GLU  HG3     5.10            #peak 10 
 72 GLU  H      72 GLU  QB      3.70            #peak 2
 72 GLU  H      72 GLU  QG      4.37            #peak 10
 72 GLU  HA     73 PRO  HD2     2.93            #peak 641 
 72 GLU  HA     73 PRO  HD3     2.99            #peak 1693
 72 GLU  QB     73 PRO  HA      4.69            #peak 2258
 72 GLU  QB     73 PRO  HD2     2.47            #peak 650
 73 PRO  HA     74 ALA  H       2.75            #peak 395 
 73 PRO  HA     74 ALA  QB      4.43            #peak 2718
 73 PRO  HD2    74 ALA  H       5.50            #peak 391 
 73 PRO  HD3    74 ALA  H       5.50            #peak 398 
 73 PRO  HG2    74 ALA  H       4.58            #peak 400 
 73 PRO  HG3    74 ALA  H       5.26            #peak 390 
 74 ALA  H      74 ALA  QB      3.46            #peak 388 
 74 ALA  HA     75 ASP  H       3.16            #peak 768 
 74 ALA  QB     75 ASP  H       3.55            #peak 435 
 75 ASP  H      75 ASP  QB      2.98            #peak 765
 75 ASP  QB     76 GLY  H       4.26            #peak 1062
 77 ASP  H      77 ASP  QB      3.45            #peak 349     
 77 ASP  HA     77 ASP  QB      3.40            #peak 2053
 78 GLY  QA     79 GLY  H       3.02            #peak 124
 79 GLY  H      80 LEU  H       4.39            #peak 508 
 80 LEU  H      80 LEU  HG      5.50            #peak 2409
 80 LEU  H      80 LEU  QB      3.64            #peak 399
 80 LEU  H      80 LEU  QD1     4.56            #peak 1361
 80 LEU  H      80 LEU  QD2     4.00            #peak 302 
 80 LEU  HA     80 LEU  QD1     4.02            #peak 2514
 80 LEU  HA     80 LEU  QD2     3.67            #peak 2511
 80 LEU  HB2    80 LEU  HG      2.90            #peak 1249
 80 LEU  QB     80 LEU  QQD     2.29            #peak 306    
 81 GLU  HA     81 GLU  QB      2.51            #peak 2971
##############
31 THR  N  51 THR  O 3.0
31 THR  H  51 THR  O 2.0
31 THR  O  51 THR  N 3.0
31 THR  O  51 THR  H 2.0
33 GLY  N  49 LEU  O 3.0
33 GLY  H  49 LEU  O 2.0
   2   ALA  PHI    -142.5   -76.8
   2   ALA  PSI      88.4   181.8
   3   MET  PHI    -157.6   -17.6
   3   MET  PSI      78.6   186.1
   4   ALA  PHI    -169.1   -29.1
   4   ALA  PSI      67.8   207.8
   5   PHE  PHI    -184.0   -44.0
   5   PHE  PSI      59.2   199.2
   8   GLU  PHI    -170.0   -30.0
   8   GLU  PSI      50.6   190.6
   9   ASP  PHI    -108.6   -64.6
   9   ASP  PSI     -8.8     4.6
  10   GLU  PHI    -158.8   -35.7
  11   VAL  PHI    -162.5   -59.9
  11   VAL  PSI      78.7   185.1
  12   THR  PHI    -162.4   -94.5
  13   GLY  PSI      66.2   206.2
  15   ASP  PHI     -96.6   -42.6
  15   ASP  PSI     -57.0     7.5
  16   ALA  PHI     -81.9   -41.9
  16   ALA  PSI     -62.2   -22.2
  17   ASP  PHI     -85.2   -45.2
  17   ASP  PSI     -56.8   -16.8
  18   ARG  PHI     -84.0   -44.0
  18   ARG  PSI     -62.8   -22.8
  19   ALA  PHI     -83.7   -43.7
  19   ALA  PSI     -61.6   -21.6
  20   ARG  PHI     -81.1   -41.1
  20   ARG  PSI     -65.9   -25.9
  21   ALA  PHI     -80.1   -40.1
  21   ALA  PSI     -57.2   -17.2
  22   ALA  PHI     -85.6   -45.6
  22   ALA  PSI     -66.1    -8.2
  23   ALA  PHI     -85.0   -45.0
  23   ALA  PSI     -61.6   -17.6
  24   VAL  PHI     -82.8   -42.8
  24   VAL  PSI     -59.4   -11.2
  25   GLN  PHI    -111.2   -38.0
  25   GLN  PSI     -53.8   -13.8
  26   ALA  PHI    -116.0   -67.4
  26   ALA  PSI     -33.8    30.0
  27   VAL  PHI    -163.3   -77.6
  27   VAL  PSI      37.2   164.7
  30   GLY  PHI    -236.3   -96.3
  30   GLY  PSI     106.3   214.3
  31   THR  PHI    -151.5   -78.4
  31   THR  PSI     106.8   155.8
  32   ALA  PHI    -150.7   -55.0
  32   ALA  PSI     100.6   150.3
  33   GLY  PHI    -149.8   -87.9
  33   GLY  PSI     102.4   160.4
  34   GLU  PHI    -145.0   -55.4
  34   GLU  PSI     106.5   158.4
  35   VAL  PHI    -145.0   -91.9
  35   VAL  PSI     113.0   153.0
  36   GLU  PHI    -147.1  -107.1
  36   GLU  PSI     114.4   155.8
  37   THR  PHI    -169.0   -75.1
  37   THR  PSI     105.3   175.6
  38   GLU  PHI    -173.9   -68.2
  38   GLU  PSI      85.9   191.0
  39   THR  PHI    -193.8   -62.7
  39   THR  PSI     118.6   173.4
  41   GLU  PHI    -168.7   -33.7
  41   GLU  PSI     114.7   177.1
  44   ALA  PHI    -176.7   -36.7
  44   ALA  PSI      73.8   197.4
  46   TYR  PHI    -159.4  -115.7
  46   TYR  PSI     133.8   173.8
  47   GLY  PHI    -147.1  -107.1
  47   GLY  PSI     114.4   155.8
  48   VAL  PHI    -157.8   -80.6
  48   VAL  PSI      95.7   156.3
  49   LEU  PHI    -134.6   -79.3
  49   LEU  PSI      99.3   143.2
  50   VAL  PHI    -146.6   -92.4
  50   VAL  PSI     102.2   158.9
  51   THR  PHI    -136.1   -92.7
  51   THR  PSI      95.1   142.9
  52   ARG  PHI    -152.0   -12.0
  52   ARG  PSI      74.5   214.5
  54   ASP  PHI    -108.6   -64.6
  54   ASP  PSI     -26.8    22.6
  55   GLY  PHI      63.0   122.5
  55   GLY  PSI     -32.7    31.8
  56   THR  PHI    -155.9   -61.4
  56   THR  PSI      79.6   219.6
  57   ARG  PHI    -158.6  -104.1
  57   ARG  PSI     120.6   171.7
  58   VAL  PHI    -169.2   -99.5
  58   VAL  PSI     114.8   164.8
  59   GLU  PHI    -136.9   -79.2
  59   GLU  PSI      99.1   139.9
  60   VAL  PHI    -136.4   -86.1
  60   VAL  PSI     108.8   148.8
  61   HIS  PHI    -152.7   -79.8
  61   HIS  PSI      97.5   157.7
  62   LEU  PHI    -149.8  -109.8
  62   LEU  PSI     130.0   170.0
  63   ASP  PHI    -146.6   -92.4
  65   ASP  PHI    -126.4   -77.3
  65   ASP  PSI      -1.2    38.8
  66   PHE  PHI      39.2    79.2
  66   PHE  PSI       3.3    59.6
  68   VAL  PHI    -115.9   -56.5
  68   VAL  PSI      59.3   199.3
  69   LEU  PHI    -115.2   -70.0
  69   LEU  PSI     -63.8    -3.6
  70   ASP  PHI    -194.4  -119.9
  70   ASP  PSI     139.8   179.8
  71   THR  PHI    -167.8   -88.6
  71   THR  PSI     109.6   182.4
  72   GLU  PHI    -161.3   -54.4
  72   GLU  PSI      48.1   178.5
  74   ALA  PHI    -142.5   -76.8
  74   ALA  PSI      88.4   181.8
  75   ASP  PHI    -167.7   -88.0
  75   ASP  PSI     109.6   182.4    
  77   ASP  PHI     -96.6   -42.6
  77   ASP  PSI     -57.0     7.5
  79   GLY  PHI    -184.9   -44.9
  79   GLY  PSI      75.1   215.1
  80   LEU  PHI    -158.7   -40.9
  80   LEU  PSI      93.1   155.7

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1HT      GLY   1   8.666   3.098  16.021
    2    H2   GLY   1           2HT      GLY   1   7.280   3.803  16.692
    3    H3   GLY   1           3HT      GLY   1   7.182   3.000  15.204
    4    HA2  GLY   1           1HA      GLY   1   7.696   1.797  17.867
    5    HA3  GLY   1           2HA      GLY   1   6.264   1.576  16.869
    6    H    ALA   2           H        ALA   2   6.198  -0.272  15.804
    7    HA   ALA   2           HA       ALA   2   8.660  -1.788  15.427
    8    HB1  ALA   2           1HB      ALA   2   7.214  -3.641  14.816
    9    HB2  ALA   2           2HB      ALA   2   5.810  -2.576  14.825
   10    HB3  ALA   2           3HB      ALA   2   6.663  -2.921  16.329
   11    H    MET   3           H        MET   3   9.716  -1.878  13.566
   12    HA   MET   3           HA       MET   3   8.848  -0.240  11.368
   13    HB2  MET   3           2HB      MET   3  11.242  -0.585  12.202
   14    HB3  MET   3           1HB      MET   3  11.193  -2.135  11.376
   15    HG2  MET   3           2HG      MET   3  12.274  -0.497   9.989
   16    HG3  MET   3           1HG      MET   3  10.742  -0.976   9.262
   17    HE1  MET   3           3HE      MET   3  12.543   1.652   8.574
   18    HE2  MET   3           1HE      MET   3  11.273   2.852   8.346
   19    HE3  MET   3           2HE      MET   3  11.079   1.231   7.682
   20    H    ALA   4           H        ALA   4   7.963  -0.872   9.462
   21    HA   ALA   4           HA       ALA   4   6.738  -3.459   9.411
   22    HB1  ALA   4           1HB      ALA   4   6.698  -1.295   7.320
   23    HB2  ALA   4           2HB      ALA   4   5.563  -1.450   8.661
   24    HB3  ALA   4           3HB      ALA   4   5.620  -2.687   7.404
   25    H    PHE   5           H        PHE   5   9.033  -4.414   9.409
   26    HA   PHE   5           HA       PHE   5   9.388  -5.481   6.715
   27    HB2  PHE   5           2HB      PHE   5  11.672  -4.418   8.403
   28    HB3  PHE   5           1HB      PHE   5  11.890  -5.477   7.018
   29    HD1  PHE   5           2HD      PHE   5  11.191  -4.645   4.735
   30    HD2  PHE   5           1HD      PHE   5  11.457  -2.110   8.145
   31    HE1  PHE   5           2HE      PHE   5  11.312  -2.682   3.263
   32    HE2  PHE   5           1HE      PHE   5  11.576  -0.144   6.675
   33    HZ   PHE   5           HZ       PHE   5  11.505  -0.427   4.231
   34    H    ASP   6           H        ASP   6   8.410  -7.390   7.462
   35    HA   ASP   6           HA       ASP   6  10.048  -8.907   9.372
   36    HB2  ASP   6           2HB      ASP   6   7.977  -8.019  10.471
   37    HB3  ASP   6           1HB      ASP   6   7.027  -8.965   9.333
   38    H    GLY   7           H        GLY   7   7.064  -9.614   7.546
   39    HA2  GLY   7           2HA      GLY   7   7.244 -10.884   5.461
   40    HA3  GLY   7           1HA      GLY   7   8.592 -11.739   6.186
   41    H    GLU   8           H        GLU   8   5.094 -11.284   6.303
   42    HA   GLU   8           HA       GLU   8   4.620 -13.617   7.893
   43    HB2  GLU   8           2HB      GLU   8   2.940 -11.829   7.673
   44    HB3  GLU   8           1HB      GLU   8   2.793 -12.173   5.958
   45    HG2  GLU   8           2HG      GLU   8   0.946 -13.093   7.273
   46    HG3  GLU   8           1HG      GLU   8   1.855 -14.340   6.423
   47    H    ASP   9           H        ASP   9   3.886 -15.665   7.149
   48    HA   ASP   9           HA       ASP   9   5.478 -16.386   4.814
   49    HB2  ASP   9           2HB      ASP   9   4.272 -18.104   6.992
   50    HB3  ASP   9           1HB      ASP   9   5.299 -18.696   5.690
   51    H    GLU  10           H        GLU  10   2.244 -15.793   5.400
   52    HA   GLU  10           HA       GLU  10   1.262 -17.979   3.748
   53    HB2  GLU  10           2HB      GLU  10  -0.974 -17.158   4.318
   54    HB3  GLU  10           1HB      GLU  10   0.005 -17.420   5.755
   55    HG2  GLU  10           2HG      GLU  10   0.469 -15.006   5.847
   56    HG3  GLU  10           1HG      GLU  10  -0.586 -14.774   4.453
   57    H    VAL  11           H        VAL  11   2.674 -15.180   3.005
   58    HA   VAL  11           HA       VAL  11   0.862 -14.618   0.751
   59    HB   VAL  11           HB       VAL  11   1.910 -12.382   0.624
   60   HG11  VAL  11          1HG1      VAL  11   0.749 -13.026   3.332
   61   HG12  VAL  11          2HG1      VAL  11  -0.171 -12.684   1.865
   62   HG13  VAL  11          3HG1      VAL  11   0.832 -11.427   2.591
   63   HG21  VAL  11          3HG2      VAL  11   3.318 -13.247   3.147
   64   HG22  VAL  11          1HG2      VAL  11   3.287 -11.599   2.520
   65   HG23  VAL  11          2HG2      VAL  11   4.069 -12.880   1.593
   66    H    THR  12           H        THR  12   1.863 -14.061  -1.295
   67    HA   THR  12           HA       THR  12   4.368 -15.526  -1.690
   68    HB   THR  12           HB       THR  12   2.473 -16.252  -3.069
   69    HG1  THR  12           1HG      THR  12   4.688 -15.016  -4.352
   70   HG21  THR  12          3HG2      THR  12   1.595 -14.789  -4.840
   71   HG22  THR  12          1HG2      THR  12   2.560 -13.455  -4.207
   72   HG23  THR  12          2HG2      THR  12   1.261 -14.142  -3.234
   73    H    GLY  13           H        GLY  13   3.240 -12.370  -1.399
   74    HA2  GLY  13           2HA      GLY  13   5.346 -11.295  -3.152
   75    HA3  GLY  13           1HA      GLY  13   3.941 -10.398  -2.592
   76    HA   PRO  14           HA       PRO  14   7.698 -10.154   0.417
   77    HB2  PRO  14           2HB      PRO  14   9.250  -8.205  -0.679
   78    HB3  PRO  14           1HB      PRO  14   9.508  -9.928  -0.970
   79    HG2  PRO  14           2HG      PRO  14   8.176  -7.892  -2.701
   80    HG3  PRO  14           1HG      PRO  14   9.249  -9.223  -3.160
   81    HD2  PRO  14           2HD      PRO  14   6.535  -9.317  -3.418
   82    HD3  PRO  14           1HD      PRO  14   7.547 -10.754  -3.171
   83    H    ASP  15           H        ASP  15   7.161  -7.176  -1.446
   84    HA   ASP  15           HA       ASP  15   6.722  -5.593   0.884
   85    HB2  ASP  15           2HB      ASP  15   6.168  -3.808  -0.721
   86    HB3  ASP  15           1HB      ASP  15   7.651  -4.641  -1.180
   87    H    ALA  16           H        ALA  16   4.746  -7.416  -1.274
   88    HA   ALA  16           HA       ALA  16   2.233  -6.313  -0.919
   89    HB1  ALA  16           1HB      ALA  16   1.343  -8.473  -1.557
   90    HB2  ALA  16           2HB      ALA  16   2.889  -9.243  -1.197
   91    HB3  ALA  16           3HB      ALA  16   2.765  -8.092  -2.528
   92    H    ASP  17           H        ASP  17   4.130  -8.235   1.251
   93    HA   ASP  17           HA       ASP  17   1.932  -8.735   3.065
   94    HB2  ASP  17           2HB      ASP  17   3.508 -10.471   3.040
   95    HB3  ASP  17           1HB      ASP  17   4.870  -9.359   3.069
   96    H    ARG  18           H        ARG  18   4.962  -6.875   3.144
   97    HA   ARG  18           HA       ARG  18   4.711  -6.005   5.792
   98    HB2  ARG  18           2HB      ARG  18   6.111  -4.274   3.810
   99    HB3  ARG  18           1HB      ARG  18   6.596  -4.722   5.431
  100    HG2  ARG  18           2HG      ARG  18   6.713  -6.478   2.992
  101    HG3  ARG  18           1HG      ARG  18   8.075  -5.674   3.766
  102    HD2  ARG  18           2HD      ARG  18   7.477  -6.993   5.853
  103    HD3  ARG  18           1HD      ARG  18   6.400  -7.939   4.823
  104    HE   ARG  18           HE       ARG  18   9.336  -7.775   4.543
  105   HH11  ARG  18          1HH1      ARG  18   6.313  -9.497   4.044
  106   HH12  ARG  18          2HH1      ARG  18   7.073 -10.849   3.253
  107   HH21  ARG  18          1HH2      ARG  18  10.325  -9.558   3.533
  108   HH22  ARG  18          2HH2      ARG  18   9.352 -10.876   2.954
  109    H    ALA  19           H        ALA  19   3.811  -4.411   2.751
  110    HA   ALA  19           HA       ALA  19   2.971  -1.996   4.030
  111    HB1  ALA  19           1HB      ALA  19   3.774  -2.041   1.718
  112    HB2  ALA  19           2HB      ALA  19   2.158  -1.346   1.836
  113    HB3  ALA  19           3HB      ALA  19   2.368  -2.997   1.252
  114    H    ARG  20           H        ARG  20   1.382  -4.925   2.966
  115    HA   ARG  20           HA       ARG  20  -1.281  -3.983   3.106
  116    HB2  ARG  20           2HB      ARG  20  -0.585  -6.015   1.886
  117    HB3  ARG  20           1HB      ARG  20  -0.225  -6.796   3.417
  118    HG2  ARG  20           2HG      ARG  20  -2.606  -6.610   4.035
  119    HG3  ARG  20           1HG      ARG  20  -2.935  -5.912   2.444
  120    HD2  ARG  20           2HD      ARG  20  -2.181  -7.914   1.354
  121    HD3  ARG  20           1HD      ARG  20  -1.651  -8.601   2.887
  122    HE   ARG  20           HE       ARG  20  -4.459  -8.180   2.098
  123   HH11  ARG  20          1HH1      ARG  20  -2.033  -9.769   4.070
  124   HH12  ARG  20          2HH1      ARG  20  -3.137 -10.984   4.667
  125   HH21  ARG  20          1HH2      ARG  20  -5.904  -9.764   2.876
  126   HH22  ARG  20          2HH2      ARG  20  -5.347 -10.966   4.003
  127    H    ALA  21           H        ALA  21   0.825  -5.636   5.433
  128    HA   ALA  21           HA       ALA  21  -1.037  -5.992   7.490
  129    HB1  ALA  21           1HB      ALA  21   1.925  -5.476   7.737
  130    HB2  ALA  21           2HB      ALA  21   1.171  -7.048   7.469
  131    HB3  ALA  21           3HB      ALA  21   0.884  -6.179   8.976
  132    H    ALA  22           H        ALA  22   1.013  -3.228   6.695
  133    HA   ALA  22           HA       ALA  22   0.329  -1.680   8.977
  134    HB1  ALA  22           1HB      ALA  22   2.355  -1.248   7.681
  135    HB2  ALA  22           2HB      ALA  22   1.339   0.191   7.772
  136    HB3  ALA  22           3HB      ALA  22   1.374  -0.771   6.294
  137    H    ALA  23           H        ALA  23  -1.023  -2.026   5.757
  138    HA   ALA  23           HA       ALA  23  -2.773   0.174   5.790
  139    HB1  ALA  23           1HB      ALA  23  -3.050  -2.445   4.329
  140    HB2  ALA  23           2HB      ALA  23  -2.184  -1.021   3.751
  141    HB3  ALA  23           3HB      ALA  23  -3.932  -0.960   3.969
  142    H    VAL  24           H        VAL  24  -3.234  -3.204   6.755
  143    HA   VAL  24           HA       VAL  24  -5.966  -3.144   7.289
  144    HB   VAL  24           HB       VAL  24  -3.852  -4.733   8.761
  145   HG11  VAL  24          1HG1      VAL  24  -5.695  -6.328   9.195
  146   HG12  VAL  24          2HG1      VAL  24  -6.830  -5.161   8.513
  147   HG13  VAL  24          3HG1      VAL  24  -5.933  -4.767   9.981
  148   HG21  VAL  24          3HG2      VAL  24  -5.465  -5.406   6.305
  149   HG22  VAL  24          1HG2      VAL  24  -4.409  -6.524   7.168
  150   HG23  VAL  24          2HG2      VAL  24  -3.729  -5.103   6.373
  151    H    GLN  25           H        GLN  25  -3.279  -1.976   9.159
  152    HA   GLN  25           HA       GLN  25  -4.790  -1.650  11.586
  153    HB2  GLN  25           2HB      GLN  25  -2.033  -0.686  10.810
  154    HB3  GLN  25           1HB      GLN  25  -2.718  -0.589  12.428
  155    HG2  GLN  25           2HG      GLN  25  -2.814  -2.973  12.599
  156    HG3  GLN  25           1HG      GLN  25  -2.330  -3.157  10.916
  157   HE21  GLN  25          1HE2      GLN  25  -0.336  -1.031  11.088
  158   HE22  GLN  25          2HE2      GLN  25   0.989  -1.705  11.962
  159    H    ALA  26           H        ALA  26  -4.496   0.098   8.725
  160    HA   ALA  26           HA       ALA  26  -4.958   2.680  10.036
  161    HB1  ALA  26           1HB      ALA  26  -4.340   2.087   7.144
  162    HB2  ALA  26           2HB      ALA  26  -3.178   2.609   8.364
  163    HB3  ALA  26           3HB      ALA  26  -4.485   3.686   7.872
  164    H    VAL  27           H        VAL  27  -6.509   0.293   7.998
  165    HA   VAL  27           HA       VAL  27  -8.851   2.061   7.809
  166    HB   VAL  27           HB       VAL  27  -7.991   1.458   5.619
  167   HG11  VAL  27          1HG1      VAL  27  -8.012  -0.843   4.807
  168   HG12  VAL  27          2HG1      VAL  27  -8.472  -1.407   6.412
  169   HG13  VAL  27          3HG1      VAL  27  -6.900  -0.646   6.163
  170   HG21  VAL  27          3HG2      VAL  27 -10.384   1.770   5.850
  171   HG22  VAL  27          1HG2      VAL  27 -10.586   0.065   6.248
  172   HG23  VAL  27          2HG2      VAL  27 -10.038   0.535   4.639
  173    HA   PRO  28           HA       PRO  28 -10.634  -0.725  10.764
  174    HB2  PRO  28           2HB      PRO  28 -13.060   0.484  10.913
  175    HB3  PRO  28           1HB      PRO  28 -11.615   1.120  11.706
  176    HG2  PRO  28           2HG      PRO  28 -12.894   1.958   9.137
  177    HG3  PRO  28           1HG      PRO  28 -12.186   2.961  10.415
  178    HD2  PRO  28           2HD      PRO  28 -10.889   2.371   8.099
  179    HD3  PRO  28           1HD      PRO  28 -10.046   2.672   9.632
  180    H    GLY  29           H        GLY  29 -10.821  -2.637   9.631
  181    HA2  GLY  29           2HA      GLY  29 -11.913  -4.370   8.613
  182    HA3  GLY  29           1HA      GLY  29 -13.398  -3.540   9.047
  183    H    GLY  30           H        GLY  30 -10.888  -2.312   6.898
  184    HA2  GLY  30           2HA      GLY  30 -12.956  -2.000   4.845
  185    HA3  GLY  30           1HA      GLY  30 -11.414  -1.156   4.896
  186    H    THR  31           H        THR  31 -11.949  -2.038   2.537
  187    HA   THR  31           HA       THR  31 -11.127  -4.763   2.090
  188    HB   THR  31           HB       THR  31 -11.468  -2.524   0.082
  189    HG1  THR  31           1HG      THR  31 -13.290  -3.789   1.598
  190   HG21  THR  31          3HG2      THR  31 -11.821  -4.359  -1.515
  191   HG22  THR  31          1HG2      THR  31 -11.482  -5.528  -0.240
  192   HG23  THR  31          2HG2      THR  31 -10.215  -4.429  -0.789
  193    H    ALA  32           H        ALA  32  -9.066  -5.368   2.188
  194    HA   ALA  32           HA       ALA  32  -7.009  -3.488   1.237
  195    HB1  ALA  32           1HB      ALA  32  -6.707  -5.445   3.517
  196    HB2  ALA  32           2HB      ALA  32  -6.943  -3.707   3.694
  197    HB3  ALA  32           3HB      ALA  32  -5.480  -4.324   2.926
  198    H    GLY  33           H        GLY  33  -5.611  -4.271  -0.225
  199    HA2  GLY  33           2HA      GLY  33  -5.674  -7.178  -0.759
  200    HA3  GLY  33           1HA      GLY  33  -5.702  -5.989  -2.054
  201    H    GLU  34           H        GLU  34  -3.743  -7.989  -1.890
  202    HA   GLU  34           HA       GLU  34  -1.377  -7.066  -0.668
  203    HB2  GLU  34           2HB      GLU  34  -0.300  -8.610  -2.498
  204    HB3  GLU  34           1HB      GLU  34  -1.199  -9.291  -1.154
  205    HG2  GLU  34           2HG      GLU  34  -1.830 -10.454  -3.114
  206    HG3  GLU  34           1HG      GLU  34  -3.186  -9.438  -2.641
  207    H    VAL  35           H        VAL  35   0.386  -5.985  -1.471
  208    HA   VAL  35           HA       VAL  35  -0.326  -4.117  -3.615
  209    HB   VAL  35           HB       VAL  35   1.138  -2.513  -2.604
  210   HG11  VAL  35          1HG1      VAL  35  -1.075  -2.637  -1.651
  211   HG12  VAL  35          2HG1      VAL  35   0.094  -2.250  -0.387
  212   HG13  VAL  35          3HG1      VAL  35  -0.552  -3.886  -0.522
  213   HG21  VAL  35          3HG2      VAL  35   1.927  -4.690  -0.671
  214   HG22  VAL  35          1HG2      VAL  35   2.396  -2.994  -0.542
  215   HG23  VAL  35          2HG2      VAL  35   2.949  -3.960  -1.910
  216    H    GLU  36           H        GLU  36   1.347  -3.393  -5.062
  217    HA   GLU  36           HA       GLU  36   3.530  -5.340  -5.377
  218    HB2  GLU  36           2HB      GLU  36   3.376  -5.054  -7.790
  219    HB3  GLU  36           1HB      GLU  36   1.827  -5.576  -7.146
  220    HG2  GLU  36           2HG      GLU  36   1.101  -3.179  -7.194
  221    HG3  GLU  36           1HG      GLU  36   2.595  -2.816  -8.057
  222    H    THR  37           H        THR  37   5.488  -4.482  -6.342
  223    HA   THR  37           HA       THR  37   6.188  -1.980  -5.165
  224    HB   THR  37           HB       THR  37   8.384  -2.403  -6.467
  225    HG1  THR  37           1HG      THR  37   7.074  -4.065  -7.790
  226   HG21  THR  37          3HG2      THR  37   8.143  -2.842  -4.083
  227   HG22  THR  37          1HG2      THR  37   9.107  -4.102  -4.854
  228   HG23  THR  37          2HG2      THR  37   7.422  -4.413  -4.432
  229    H    GLU  38           H        GLU  38   6.055  -0.031  -6.006
  230    HA   GLU  38           HA       GLU  38   5.297   0.370  -8.758
  231    HB2  GLU  38           2HB      GLU  38   5.972   2.371  -6.588
  232    HB3  GLU  38           1HB      GLU  38   5.305   2.772  -8.166
  233    HG2  GLU  38           2HG      GLU  38   3.343   1.308  -7.578
  234    HG3  GLU  38           1HG      GLU  38   3.986   1.255  -5.936
  235    H    THR  39           H        THR  39   6.667   2.699  -9.399
  236    HA   THR  39           HA       THR  39   8.973   1.667 -10.598
  237    HB   THR  39           HB       THR  39   9.509   4.135 -11.000
  238    HG1  THR  39           1HG      THR  39   8.213   4.746  -9.060
  239   HG21  THR  39          3HG2      THR  39   6.768   3.126 -11.775
  240   HG22  THR  39          1HG2      THR  39   8.272   2.778 -12.625
  241   HG23  THR  39          2HG2      THR  39   7.649   4.428 -12.573
  242    H    GLY  40           H        GLY  40  11.033   1.491  -9.945
  243    HA2  GLY  40           2HA      GLY  40  11.626   1.637  -7.191
  244    HA3  GLY  40           1HA      GLY  40  12.784   1.329  -8.476
  245    H    GLU  41           H        GLU  41  12.674   3.666  -9.904
  246    HA   GLU  41           HA       GLU  41  14.102   5.435  -8.118
  247    HB2  GLU  41           2HB      GLU  41  14.958   4.942 -10.385
  248    HB3  GLU  41           1HB      GLU  41  13.531   5.702 -11.077
  249    HG2  GLU  41           2HG      GLU  41  14.190   7.818  -9.974
  250    HG3  GLU  41           1HG      GLU  41  15.675   7.031  -9.440
  251    H    GLY  42           H        GLY  42  13.037   6.859  -6.946
  252    HA2  GLY  42           2HA      GLY  42  11.611   9.000  -7.689
  253    HA3  GLY  42           1HA      GLY  42  10.383   7.739  -7.706
  254    H    ALA  43           H        ALA  43   9.298   8.887  -6.006
  255    HA   ALA  43           HA       ALA  43  10.636   8.736  -3.390
  256    HB1  ALA  43           1HB      ALA  43   9.738  10.934  -4.012
  257    HB2  ALA  43           2HB      ALA  43   8.922  10.276  -2.593
  258    HB3  ALA  43           3HB      ALA  43   8.128  10.230  -4.168
  259    H    ALA  44           H        ALA  44   7.705   7.834  -5.137
  260    HA   ALA  44           HA       ALA  44   6.751   6.235  -2.893
  261    HB1  ALA  44           1HB      ALA  44   5.126   7.555  -4.156
  262    HB2  ALA  44           2HB      ALA  44   4.783   5.830  -4.290
  263    HB3  ALA  44           3HB      ALA  44   5.553   6.683  -5.627
  264    H    ALA  45           H        ALA  45   7.604   4.295  -2.636
  265    HA   ALA  45           HA       ALA  45   8.514   2.810  -5.003
  266    HB1  ALA  45           1HB      ALA  45  10.189   3.210  -3.257
  267    HB2  ALA  45           2HB      ALA  45   9.865   1.490  -3.475
  268    HB3  ALA  45           3HB      ALA  45   9.175   2.351  -2.098
  269    H    TYR  46           H        TYR  46   6.226   2.786  -2.414
  270    HA   TYR  46           HA       TYR  46   5.261   0.149  -3.304
  271    HB2  TYR  46           2HB      TYR  46   5.059   1.164  -0.463
  272    HB3  TYR  46           1HB      TYR  46   4.691  -0.451  -1.051
  273    HD1  TYR  46           1HD      TYR  46   6.537  -2.004  -1.637
  274    HD2  TYR  46           2HD      TYR  46   7.292   1.824   0.062
  275    HE1  TYR  46           1HE      TYR  46   8.830  -2.705  -1.069
  276    HE2  TYR  46           2HE      TYR  46   9.581   1.134   0.622
  277    HH   TYR  46           HH       TYR  46  10.834  -0.956   1.021
  278    H    GLY  47           H        GLY  47   3.147   0.088  -3.855
  279    HA2  GLY  47           2HA      GLY  47   1.505   2.438  -3.137
  280    HA3  GLY  47           1HA      GLY  47   1.288   1.490  -4.604
  281    H    VAL  48           H        VAL  48   0.150   2.017  -1.537
  282    HA   VAL  48           HA       VAL  48  -0.727  -0.742  -1.112
  283    HB   VAL  48           HB       VAL  48  -1.047   1.634   0.727
  284   HG11  VAL  48          1HG1      VAL  48  -2.642  -0.131   1.160
  285   HG12  VAL  48          2HG1      VAL  48  -1.431  -0.081   2.442
  286   HG13  VAL  48          3HG1      VAL  48  -1.348  -1.326   1.195
  287   HG21  VAL  48          3HG2      VAL  48   0.846   0.707   1.976
  288   HG22  VAL  48          1HG2      VAL  48   1.313   1.177   0.341
  289   HG23  VAL  48          2HG2      VAL  48   1.060  -0.524   0.733
  290    H    LEU  49           H        LEU  49  -2.573  -1.255  -2.104
  291    HA   LEU  49           HA       LEU  49  -4.563   0.793  -2.601
  292    HB2  LEU  49           2HB      LEU  49  -5.727  -0.975  -3.878
  293    HB3  LEU  49           1HB      LEU  49  -4.084  -0.697  -4.418
  294    HG   LEU  49           HG       LEU  49  -3.792  -2.758  -2.605
  295   HD11  LEU  49          1HD1      LEU  49  -6.298  -3.251  -4.206
  296   HD12  LEU  49          2HD1      LEU  49  -6.217  -3.031  -2.458
  297   HD13  LEU  49          3HD1      LEU  49  -5.451  -4.432  -3.207
  298   HD21  LEU  49          3HD2      LEU  49  -3.419  -4.144  -4.589
  299   HD22  LEU  49          1HD2      LEU  49  -2.669  -2.556  -4.751
  300   HD23  LEU  49          2HD2      LEU  49  -4.180  -2.907  -5.591
  301    H    VAL  50           H        VAL  50  -6.068   1.257  -1.177
  302    HA   VAL  50           HA       VAL  50  -7.289  -0.934   0.348
  303    HB   VAL  50           HB       VAL  50  -7.477   0.565   2.347
  304   HG11  VAL  50          1HG1      VAL  50  -4.682  -0.162   1.490
  305   HG12  VAL  50          2HG1      VAL  50  -5.842  -1.228   2.281
  306   HG13  VAL  50          3HG1      VAL  50  -5.197   0.169   3.144
  307   HG21  VAL  50          3HG2      VAL  50  -7.082   2.712   1.294
  308   HG22  VAL  50          1HG2      VAL  50  -5.447   2.223   0.854
  309   HG23  VAL  50          2HG2      VAL  50  -5.877   2.427   2.553
  310    H    THR  51           H        THR  51  -9.458  -0.573   0.941
  311    HA   THR  51           HA       THR  51 -10.729   1.766  -0.299
  312    HB   THR  51           HB       THR  51 -11.714  -1.071  -0.636
  313    HG1  THR  51           1HG      THR  51  -9.814   0.295  -1.952
  314   HG21  THR  51          3HG2      THR  51 -12.648   1.526  -1.875
  315   HG22  THR  51          1HG2      THR  51 -13.510   0.603  -0.647
  316   HG23  THR  51          2HG2      THR  51 -13.274  -0.078  -2.258
  317    H    ARG  52           H        ARG  52 -12.064   2.739   1.068
  318    HA   ARG  52           HA       ARG  52 -12.927   1.414   3.487
  319    HB2  ARG  52           2HB      ARG  52 -13.374   4.174   2.361
  320    HB3  ARG  52           1HB      ARG  52 -14.267   3.607   3.762
  321    HG2  ARG  52           2HG      ARG  52 -12.505   4.797   4.677
  322    HG3  ARG  52           1HG      ARG  52 -11.967   3.123   4.787
  323    HD2  ARG  52           2HD      ARG  52 -10.602   3.416   2.790
  324    HD3  ARG  52           1HD      ARG  52 -11.175   5.077   2.628
  325    HE   ARG  52           HE       ARG  52  -9.805   4.322   5.106
  326   HH11  ARG  52          1HH1      ARG  52  -9.703   6.037   2.045
  327   HH12  ARG  52          2HH1      ARG  52  -8.347   7.023   2.501
  328   HH21  ARG  52          1HH2      ARG  52  -8.044   5.601   5.702
  329   HH22  ARG  52          2HH2      ARG  52  -7.402   6.780   4.590
  330    HA   PRO  53           HA       PRO  53 -16.590  -0.435   1.919
  331    HB2  PRO  53           2HB      PRO  53 -18.250  -0.037   4.099
  332    HB3  PRO  53           1HB      PRO  53 -17.085  -1.355   3.934
  333    HG2  PRO  53           2HG      PRO  53 -16.824   1.236   5.396
  334    HG3  PRO  53           1HG      PRO  53 -16.271  -0.382   5.868
  335    HD2  PRO  53           2HD      PRO  53 -14.567   1.444   4.910
  336    HD3  PRO  53           1HD      PRO  53 -14.399  -0.276   4.495
  337    H    ASP  54           H        ASP  54 -16.486   2.842   2.857
  338    HA   ASP  54           HA       ASP  54 -19.137   3.634   2.259
  339    HB2  ASP  54           2HB      ASP  54 -16.591   5.263   2.132
  340    HB3  ASP  54           1HB      ASP  54 -18.228   5.908   2.188
  341    H    GLY  55           H        GLY  55 -16.695   2.490   0.261
  342    HA2  GLY  55           2HA      GLY  55 -16.983   2.137  -2.059
  343    HA3  GLY  55           1HA      GLY  55 -18.126   3.475  -2.094
  344    H    THR  56           H        THR  56 -14.979   3.618  -0.568
  345    HA   THR  56           HA       THR  56 -14.061   5.369  -2.735
  346    HB   THR  56           HB       THR  56 -14.756   6.858  -0.984
  347    HG1  THR  56           1HG      THR  56 -13.010   7.981  -1.296
  348   HG21  THR  56          3HG2      THR  56 -12.995   5.252   0.865
  349   HG22  THR  56          1HG2      THR  56 -14.756   5.342   0.906
  350   HG23  THR  56          2HG2      THR  56 -13.792   6.771   1.279
  351    H    ARG  57           H        ARG  57 -12.278   4.690  -3.592
  352    HA   ARG  57           HA       ARG  57 -10.544   2.851  -2.084
  353    HB2  ARG  57           2HB      ARG  57 -11.421   1.845  -4.077
  354    HB3  ARG  57           1HB      ARG  57 -10.995   3.249  -5.040
  355    HG2  ARG  57           2HG      ARG  57  -8.625   2.759  -4.711
  356    HG3  ARG  57           1HG      ARG  57  -9.059   1.340  -3.753
  357    HD2  ARG  57           2HD      ARG  57 -10.063   0.278  -5.623
  358    HD3  ARG  57           1HD      ARG  57  -9.986   1.753  -6.585
  359    HE   ARG  57           HE       ARG  57  -7.385   1.234  -6.020
  360   HH11  ARG  57          1HH1      ARG  57  -9.980  -0.683  -7.378
  361   HH12  ARG  57          2HH1      ARG  57  -8.937  -1.595  -8.433
  362   HH21  ARG  57          1HH2      ARG  57  -5.998   0.056  -7.390
  363   HH22  ARG  57          2HH2      ARG  57  -6.652  -1.193  -8.417
  364    H    VAL  58           H        VAL  58  -8.572   3.464  -1.547
  365    HA   VAL  58           HA       VAL  58  -7.354   5.761  -2.922
  366    HB   VAL  58           HB       VAL  58  -7.461   5.332   0.076
  367   HG11  VAL  58          1HG1      VAL  58  -6.199   7.424   0.256
  368   HG12  VAL  58          2HG1      VAL  58  -6.048   7.482  -1.500
  369   HG13  VAL  58          3HG1      VAL  58  -5.278   6.181  -0.592
  370   HG21  VAL  58          3HG2      VAL  58  -9.522   6.269  -0.770
  371   HG22  VAL  58          1HG2      VAL  58  -8.627   7.497  -1.668
  372   HG23  VAL  58          2HG2      VAL  58  -8.616   7.512   0.095
  373    H    GLU  59           H        GLU  59  -5.177   5.528  -3.320
  374    HA   GLU  59           HA       GLU  59  -3.958   3.099  -2.213
  375    HB2  GLU  59           2HB      GLU  59  -2.291   3.296  -4.073
  376    HB3  GLU  59           1HB      GLU  59  -3.932   2.937  -4.581
  377    HG2  GLU  59           2HG      GLU  59  -4.244   5.261  -5.242
  378    HG3  GLU  59           1HG      GLU  59  -2.606   5.637  -4.704
  379    H    VAL  60           H        VAL  60  -2.505   3.290  -0.739
  380    HA   VAL  60           HA       VAL  60  -1.553   5.918   0.033
  381    HB   VAL  60           HB       VAL  60  -0.876   3.267   1.306
  382   HG11  VAL  60          1HG1      VAL  60  -0.826   6.078   2.378
  383   HG12  VAL  60          2HG1      VAL  60   0.575   5.090   1.964
  384   HG13  VAL  60          3HG1      VAL  60  -0.471   4.623   3.307
  385   HG21  VAL  60          3HG2      VAL  60  -3.299   3.500   1.234
  386   HG22  VAL  60          1HG2      VAL  60  -3.175   5.105   1.955
  387   HG23  VAL  60          2HG2      VAL  60  -2.703   3.683   2.884
  388    H    HIS  61           H        HIS  61   0.273   6.720  -0.729
  389    HA   HIS  61           HA       HIS  61   2.168   4.923  -2.017
  390    HB2  HIS  61           2HB      HIS  61   1.869   7.917  -2.015
  391    HB3  HIS  61           1HB      HIS  61   3.251   7.100  -2.743
  392    HD1  HIS  61           1HD      HIS  61  -0.136   8.208  -3.501
  393    HD2  HIS  61           2HD      HIS  61   2.411   5.193  -4.828
  394    HE1  HIS  61           1HE      HIS  61  -1.090   7.416  -5.685
  395    HE2  HIS  61           2HE      HIS  61   0.309   5.426  -6.311
  396    H    LEU  62           H        LEU  62   3.847   4.196  -1.053
  397    HA   LEU  62           HA       LEU  62   4.719   5.451   1.460
  398    HB2  LEU  62           2HB      LEU  62   4.150   2.725   0.622
  399    HB3  LEU  62           1HB      LEU  62   5.734   2.868   1.359
  400    HG   LEU  62           HG       LEU  62   4.888   3.274   3.442
  401   HD11  LEU  62          1HD1      LEU  62   2.792   4.408   3.919
  402   HD12  LEU  62          2HD1      LEU  62   2.361   4.390   2.210
  403   HD13  LEU  62          3HD1      LEU  62   3.723   5.364   2.765
  404   HD21  LEU  62          3HD2      LEU  62   2.535   1.958   2.106
  405   HD22  LEU  62          1HD2      LEU  62   2.903   1.927   3.831
  406   HD23  LEU  62          2HD2      LEU  62   3.983   1.131   2.684
  407    H    ASP  63           H        ASP  63   6.934   5.632   1.897
  408    HA   ASP  63           HA       ASP  63   8.527   5.926  -0.522
  409    HB2  ASP  63           2HB      ASP  63   9.938   7.359   0.713
  410    HB3  ASP  63           1HB      ASP  63   8.317   7.728   1.287
  411    H    ARG  64           H        ARG  64  11.070   5.687   0.689
  412    HA   ARG  64           HA       ARG  64  11.501   2.941   0.177
  413    HB2  ARG  64           2HB      ARG  64  13.426   4.874   1.463
  414    HB3  ARG  64           1HB      ARG  64  13.821   3.422   0.555
  415    HG2  ARG  64           2HG      ARG  64  12.951   4.444  -1.481
  416    HG3  ARG  64           1HG      ARG  64  12.527   5.899  -0.578
  417    HD2  ARG  64           2HD      ARG  64  14.917   6.160   0.021
  418    HD3  ARG  64           1HD      ARG  64  15.290   4.781  -1.011
  419    HE   ARG  64           HE       ARG  64  13.992   7.197  -2.106
  420   HH11  ARG  64          1HH1      ARG  64  16.578   4.831  -2.119
  421   HH12  ARG  64          2HH1      ARG  64  17.333   5.471  -3.552
  422   HH21  ARG  64          1HH2      ARG  64  14.974   8.043  -3.988
  423   HH22  ARG  64          2HH2      ARG  64  16.403   7.287  -4.627
  424    H    ASP  65           H        ASP  65  10.597   4.564   3.034
  425    HA   ASP  65           HA       ASP  65  11.535   2.292   4.665
  426    HB2  ASP  65           2HB      ASP  65  11.286   5.198   5.472
  427    HB3  ASP  65           1HB      ASP  65  11.643   3.880   6.583
  428    H    PHE  66           H        PHE  66   8.935   3.108   3.224
  429    HA   PHE  66           HA       PHE  66   6.739   2.645   3.497
  430    HB2  PHE  66           2HB      PHE  66   7.871   1.273   5.902
  431    HB3  PHE  66           1HB      PHE  66   6.125   1.424   5.730
  432    HD1  PHE  66           2HD      PHE  66   5.043   0.527   3.659
  433    HD2  PHE  66           1HD      PHE  66   9.052  -0.378   4.735
  434    HE1  PHE  66           2HE      PHE  66   4.997  -1.415   2.162
  435    HE2  PHE  66           1HE      PHE  66   9.015  -2.328   3.235
  436    HZ   PHE  66           HZ       PHE  66   6.979  -2.838   1.948
  437    H    ARG  67           H        ARG  67   7.898   5.183   4.462
  438    HA   ARG  67           HA       ARG  67   6.057   5.904   6.610
  439    HB2  ARG  67           2HB      ARG  67   8.440   6.805   6.414
  440    HB3  ARG  67           1HB      ARG  67   7.856   7.768   5.065
  441    HG2  ARG  67           2HG      ARG  67   6.273   8.887   6.506
  442    HG3  ARG  67           1HG      ARG  67   6.770   7.883   7.869
  443    HD2  ARG  67           2HD      ARG  67   9.106   8.793   7.508
  444    HD3  ARG  67           1HD      ARG  67   8.376   9.968   6.414
  445    HE   ARG  67           HE       ARG  67   7.118   9.888   9.000
  446   HH11  ARG  67          1HH1      ARG  67   9.708  11.273   7.094
  447   HH12  ARG  67          2HH1      ARG  67   9.956  12.622   8.164
  448   HH21  ARG  67          1HH2      ARG  67   7.440  11.648  10.422
  449   HH22  ARG  67          2HH2      ARG  67   8.668  12.821  10.069
  450    H    VAL  68           H        VAL  68   4.184   7.001   6.305
  451    HA   VAL  68           HA       VAL  68   2.970   6.899   3.771
  452    HB   VAL  68           HB       VAL  68   1.587   6.765   5.731
  453   HG11  VAL  68          1HG1      VAL  68   2.441   9.584   6.374
  454   HG12  VAL  68          2HG1      VAL  68   2.898   8.129   7.259
  455   HG13  VAL  68          3HG1      VAL  68   1.215   8.656   7.237
  456   HG21  VAL  68          3HG2      VAL  68   0.559   7.711   3.730
  457   HG22  VAL  68          1HG2      VAL  68   1.012   9.332   4.255
  458   HG23  VAL  68          2HG2      VAL  68  -0.151   8.395   5.193
  459    H    LEU  69           H        LEU  69   3.495   8.095   2.098
  460    HA   LEU  69           HA       LEU  69   4.544  10.770   2.408
  461    HB2  LEU  69           2HB      LEU  69   3.850   9.196  -0.076
  462    HB3  LEU  69           1HB      LEU  69   4.659  10.752  -0.063
  463    HG   LEU  69           HG       LEU  69   5.752   8.175   1.068
  464   HD11  LEU  69          1HD1      LEU  69   5.733   8.254  -1.373
  465   HD12  LEU  69          2HD1      LEU  69   7.375   8.343  -0.736
  466   HD13  LEU  69          3HD1      LEU  69   6.581   9.801  -1.332
  467   HD21  LEU  69          3HD2      LEU  69   6.965  10.934   0.933
  468   HD22  LEU  69          1HD2      LEU  69   7.813   9.466   1.420
  469   HD23  LEU  69          2HD2      LEU  69   6.474  10.074   2.394
  470    H    ASP  70           H        ASP  70   1.699   9.270   0.873
  471    HA   ASP  70           HA       ASP  70  -0.077  11.304   1.682
  472    HB2  ASP  70           2HB      ASP  70   1.289  12.550  -0.069
  473    HB3  ASP  70           1HB      ASP  70   0.594  11.458  -1.262
  474    H    THR  71           H        THR  71  -2.229  11.005   0.778
  475    HA   THR  71           HA       THR  71  -2.590   8.395  -0.527
  476    HB   THR  71           HB       THR  71  -4.716   8.178   0.855
  477    HG1  THR  71           1HG      THR  71  -3.741  10.541   1.825
  478   HG21  THR  71          3HG2      THR  71  -2.060   8.096   2.284
  479   HG22  THR  71          1HG2      THR  71  -2.763   6.806   1.308
  480   HG23  THR  71          2HG2      THR  71  -3.533   7.287   2.820
  481    H    GLU  72           H        GLU  72  -3.353   8.838  -2.490
  482    HA   GLU  72           HA       GLU  72  -5.517  10.821  -2.715
  483    HB2  GLU  72           2HB      GLU  72  -4.951  10.840  -5.166
  484    HB3  GLU  72           1HB      GLU  72  -3.711  11.497  -4.109
  485    HG2  GLU  72           2HG      GLU  72  -3.495   8.631  -4.804
  486    HG3  GLU  72           1HG      GLU  72  -3.187   9.799  -6.089
  487    HA   PRO  73           HA       PRO  73  -8.420   7.599  -3.637
  488    HB2  PRO  73           2HB      PRO  73  -9.641   9.552  -5.499
  489    HB3  PRO  73           1HB      PRO  73 -10.351   8.725  -4.109
  490    HG2  PRO  73           2HG      PRO  73  -9.738  11.319  -3.996
  491    HG3  PRO  73           1HG      PRO  73  -9.504  10.257  -2.594
  492    HD2  PRO  73           2HD      PRO  73  -7.484  11.304  -4.543
  493    HD3  PRO  73           1HD      PRO  73  -7.359  11.117  -2.780
  494    H    ALA  74           H        ALA  74  -8.310   5.958  -5.008
  495    HA   ALA  74           HA       ALA  74  -7.026   6.424  -7.611
  496    HB1  ALA  74           1HB      ALA  74  -7.225   3.861  -6.032
  497    HB2  ALA  74           2HB      ALA  74  -5.824   4.932  -6.071
  498    HB3  ALA  74           3HB      ALA  74  -6.336   4.098  -7.538
  499    H    ASP  75           H        ASP  75  -8.216   6.251  -9.362
  500    HA   ASP  75           HA       ASP  75 -10.742   4.735  -9.223
  501    HB2  ASP  75           2HB      ASP  75 -11.670   6.199 -10.864
  502    HB3  ASP  75           1HB      ASP  75 -10.867   7.236  -9.690
  503    H    GLY  76           H        GLY  76 -11.393   4.051 -11.615
  504    HA2  GLY  76           2HA      GLY  76  -8.992   2.876 -12.871
  505    HA3  GLY  76           1HA      GLY  76 -10.394   1.883 -12.503
  506    H    ASP  77           H        ASP  77 -10.504   5.186 -13.720
  507    HA   ASP  77           HA       ASP  77 -12.026   4.186 -16.019
  508    HB2  ASP  77           2HB      ASP  77 -13.009   6.010 -14.669
  509    HB3  ASP  77           1HB      ASP  77 -11.627   7.030 -15.050
  510    H    GLY  78           H        GLY  78  -8.945   5.376 -15.196
  511    HA2  GLY  78           2HA      GLY  78  -8.321   6.437 -17.808
  512    HA3  GLY  78           1HA      GLY  78  -7.215   6.268 -16.455
  513    H    GLY  79           H        GLY  79  -8.674   4.659 -19.196
  514    HA2  GLY  79           2HA      GLY  79  -7.037   2.284 -18.888
  515    HA3  GLY  79           1HA      GLY  79  -8.121   2.644 -20.227
  516    H    LEU  80           H        LEU  80  -6.004   1.641 -21.213
  517    HA   LEU  80           HA       LEU  80  -4.515   3.900 -22.286
  518    HB2  LEU  80           2HB      LEU  80  -2.338   2.871 -21.957
  519    HB3  LEU  80           1HB      LEU  80  -3.122   3.168 -20.422
  520    HG   LEU  80           HG       LEU  80  -3.167   0.447 -21.714
  521   HD11  LEU  80          1HD1      LEU  80  -1.103   1.574 -19.825
  522   HD12  LEU  80          2HD1      LEU  80  -0.840   1.106 -21.505
  523   HD13  LEU  80          3HD1      LEU  80  -1.241  -0.118 -20.302
  524   HD21  LEU  80          3HD2      LEU  80  -4.761   0.872 -19.892
  525   HD22  LEU  80          1HD2      LEU  80  -3.426   1.353 -18.847
  526   HD23  LEU  80          2HD2      LEU  80  -3.535  -0.308 -19.429
  527    H    GLU  81           H        GLU  81  -4.770   3.755 -24.378
  528    HA   GLU  81           HA       GLU  81  -3.853   1.572 -25.900
  529    HB2  GLU  81           2HB      GLU  81  -6.024   0.598 -25.118
  530    HB3  GLU  81           1HB      GLU  81  -6.862   1.919 -25.924
  531    HG2  GLU  81           2HG      GLU  81  -6.037   1.182 -28.070
  532    HG3  GLU  81           1HG      GLU  81  -5.079  -0.082 -27.299
  Start of MODEL    2
    1    H1   GLY   1           1HT      GLY   1   4.269  -0.541  16.399
    2    H2   GLY   1           2HT      GLY   1   2.967   0.410  16.928
    3    H3   GLY   1           3HT      GLY   1   4.553   0.836  17.354
    4    HA2  GLY   1           1HA      GLY   1   3.422   0.849  14.613
    5    HA3  GLY   1           2HA      GLY   1   3.741   2.270  15.600
    6    H    ALA   2           H        ALA   2   5.478  -0.666  14.540
    7    HA   ALA   2           HA       ALA   2   7.849   1.022  14.077
    8    HB1  ALA   2           1HB      ALA   2   9.164  -1.024  14.201
    9    HB2  ALA   2           2HB      ALA   2   7.693  -1.980  14.377
   10    HB3  ALA   2           3HB      ALA   2   8.166  -0.851  15.646
   11    H    MET   3           H        MET   3   9.241   0.170  12.200
   12    HA   MET   3           HA       MET   3   7.674   0.197   9.822
   13    HB2  MET   3           2HB      MET   3  10.618  -0.256  10.309
   14    HB3  MET   3           1HB      MET   3   9.908  -0.240   8.704
   15    HG2  MET   3           2HG      MET   3  10.848   1.896   9.089
   16    HG3  MET   3           1HG      MET   3   9.096   2.077   9.172
   17    HE1  MET   3           3HE      MET   3   9.345   4.441  10.324
   18    HE2  MET   3           1HE      MET   3  11.099   4.294  10.209
   19    HE3  MET   3           2HE      MET   3  10.350   4.735  11.742
   20    H    ALA   4           H        ALA   4   6.757  -1.462   8.822
   21    HA   ALA   4           HA       ALA   4   7.110  -4.103   9.913
   22    HB1  ALA   4           1HB      ALA   4   4.870  -3.261   9.426
   23    HB2  ALA   4           2HB      ALA   4   5.223  -4.726   8.509
   24    HB3  ALA   4           3HB      ALA   4   5.282  -3.154   7.714
   25    H    PHE   5           H        PHE   5   9.430  -4.014   9.077
   26    HA   PHE   5           HA       PHE   5   9.556  -5.088   6.354
   27    HB2  PHE   5           2HB      PHE   5  11.732  -4.287   8.296
   28    HB3  PHE   5           1HB      PHE   5  12.047  -5.061   6.747
   29    HD1  PHE   5           2HD      PHE   5  10.865  -3.856   4.693
   30    HD2  PHE   5           1HD      PHE   5  11.841  -1.999   8.395
   31    HE1  PHE   5           2HE      PHE   5  10.846  -1.655   3.591
   32    HE2  PHE   5           1HE      PHE   5  11.820   0.203   7.301
   33    HZ   PHE   5           HZ       PHE   5  11.325   0.377   4.897
   34    H    ASP   6           H        ASP   6   9.305  -7.169   6.120
   35    HA   ASP   6           HA       ASP   6   9.050  -9.377   6.540
   36    HB2  ASP   6           2HB      ASP   6  11.523  -9.285   6.938
   37    HB3  ASP   6           1HB      ASP   6  11.189  -9.076   8.656
   38    H    GLY   7           H        GLY   7   7.085  -9.655   7.324
   39    HA2  GLY   7           2HA      GLY   7   6.483  -8.861  10.067
   40    HA3  GLY   7           1HA      GLY   7   5.312  -9.300   8.832
   41    H    GLU   8           H        GLU   8   4.485 -11.307   8.858
   42    HA   GLU   8           HA       GLU   8   5.648 -13.141  10.838
   43    HB2  GLU   8           2HB      GLU   8   3.290 -12.239  11.164
   44    HB3  GLU   8           1HB      GLU   8   2.823 -13.217   9.781
   45    HG2  GLU   8           2HG      GLU   8   3.420 -15.233  10.926
   46    HG3  GLU   8           1HG      GLU   8   4.099 -14.318  12.273
   47    H    ASP   9           H        ASP   9   4.817 -15.516  10.286
   48    HA   ASP   9           HA       ASP   9   6.344 -16.251   7.985
   49    HB2  ASP   9           2HB      ASP   9   6.411 -17.539  10.071
   50    HB3  ASP   9           1HB      ASP   9   4.705 -17.928   9.901
   51    H    GLU  10           H        GLU  10   3.112 -15.395   8.343
   52    HA   GLU  10           HA       GLU  10   1.857 -17.222   6.588
   53    HB2  GLU  10           2HB      GLU  10   1.109 -14.364   7.252
   54    HB3  GLU  10           1HB      GLU  10   0.072 -15.512   6.417
   55    HG2  GLU  10           2HG      GLU  10   1.118 -15.819   9.221
   56    HG3  GLU  10           1HG      GLU  10  -0.504 -15.292   8.780
   57    H    VAL  11           H        VAL  11   2.891 -17.537   4.674
   58    HA   VAL  11           HA       VAL  11   3.884 -15.298   3.149
   59    HB   VAL  11           HB       VAL  11   3.792 -18.221   2.380
   60   HG11  VAL  11          1HG1      VAL  11   5.328 -15.910   1.202
   61   HG12  VAL  11          2HG1      VAL  11   4.000 -16.785   0.442
   62   HG13  VAL  11          3HG1      VAL  11   5.530 -17.604   0.753
   63   HG21  VAL  11          3HG2      VAL  11   6.019 -16.594   3.598
   64   HG22  VAL  11          1HG2      VAL  11   6.164 -18.253   3.017
   65   HG23  VAL  11          2HG2      VAL  11   5.117 -17.886   4.387
   66    H    THR  12           H        THR  12   1.888 -14.206   2.810
   67    HA   THR  12           HA       THR  12   0.244 -15.374   0.681
   68    HB   THR  12           HB       THR  12  -0.953 -14.320   2.565
   69    HG1  THR  12           1HG      THR  12  -1.373 -12.562   0.392
   70   HG21  THR  12          3HG2      THR  12   0.389 -11.772   1.654
   71   HG22  THR  12          1HG2      THR  12   0.691 -12.616   3.172
   72   HG23  THR  12          2HG2      THR  12  -0.884 -11.884   2.868
   73    H    GLY  13           H        GLY  13   2.891 -13.438   1.227
   74    HA2  GLY  13           2HA      GLY  13   3.564 -12.925  -1.389
   75    HA3  GLY  13           1HA      GLY  13   2.653 -11.516  -0.849
   76    HA   PRO  14           HA       PRO  14   7.242 -12.124   0.886
   77    HB2  PRO  14           2HB      PRO  14   8.084 -10.466  -1.418
   78    HB3  PRO  14           1HB      PRO  14   8.868 -11.873  -0.696
   79    HG2  PRO  14           2HG      PRO  14   7.580 -11.993  -3.052
   80    HG3  PRO  14           1HG      PRO  14   7.631 -13.363  -1.932
   81    HD2  PRO  14           2HD      PRO  14   5.415 -11.489  -2.558
   82    HD3  PRO  14           1HD      PRO  14   5.351 -13.194  -2.075
   83    H    ASP  15           H        ASP  15   6.834  -9.239  -1.122
   84    HA   ASP  15           HA       ASP  15   7.118  -7.534   1.218
   85    HB2  ASP  15           2HB      ASP  15   7.128  -5.696  -0.487
   86    HB3  ASP  15           1HB      ASP  15   8.390  -6.899  -0.732
   87    H    ALA  16           H        ALA  16   4.696  -8.815  -0.808
   88    HA   ALA  16           HA       ALA  16   2.696  -6.875  -0.661
   89    HB1  ALA  16           1HB      ALA  16   1.140  -8.635  -1.219
   90    HB2  ALA  16           2HB      ALA  16   2.312  -9.863  -0.740
   91    HB3  ALA  16           3HB      ALA  16   2.627  -8.845  -2.145
   92    H    ASP  17           H        ASP  17   3.313  -9.664   1.470
   93    HA   ASP  17           HA       ASP  17   1.144  -9.290   3.208
   94    HB2  ASP  17           2HB      ASP  17   2.254 -11.339   3.441
   95    HB3  ASP  17           1HB      ASP  17   3.840 -10.581   3.538
   96    H    ARG  18           H        ARG  18   4.330  -7.841   3.203
   97    HA   ARG  18           HA       ARG  18   4.296  -6.953   5.878
   98    HB2  ARG  18           2HB      ARG  18   5.889  -5.647   3.686
   99    HB3  ARG  18           1HB      ARG  18   6.305  -5.818   5.384
  100    HG2  ARG  18           2HG      ARG  18   6.322  -7.933   3.251
  101    HG3  ARG  18           1HG      ARG  18   7.682  -7.315   4.186
  102    HD2  ARG  18           2HD      ARG  18   6.564  -8.252   6.235
  103    HD3  ARG  18           1HD      ARG  18   5.408  -9.036   5.159
  104    HE   ARG  18           HE       ARG  18   8.212  -9.575   4.605
  105   HH11  ARG  18          1HH1      ARG  18   5.228 -10.731   6.077
  106   HH12  ARG  18          2HH1      ARG  18   5.852 -12.339   6.343
  107   HH21  ARG  18          1HH2      ARG  18   8.993 -11.685   4.917
  108   HH22  ARG  18          2HH2      ARG  18   7.987 -12.881   5.677
  109    H    ALA  19           H        ALA  19   3.511  -5.338   2.814
  110    HA   ALA  19           HA       ALA  19   2.823  -2.881   4.177
  111    HB1  ALA  19           1HB      ALA  19   2.277  -2.033   1.960
  112    HB2  ALA  19           2HB      ALA  19   2.487  -3.646   1.283
  113    HB3  ALA  19           3HB      ALA  19   3.868  -2.795   1.972
  114    H    ARG  20           H        ARG  20   1.184  -5.700   2.959
  115    HA   ARG  20           HA       ARG  20  -1.430  -4.629   2.816
  116    HB2  ARG  20           2HB      ARG  20  -0.889  -6.724   1.725
  117    HB3  ARG  20           1HB      ARG  20  -0.484  -7.462   3.268
  118    HG2  ARG  20           2HG      ARG  20  -2.826  -7.259   3.969
  119    HG3  ARG  20           1HG      ARG  20  -3.217  -6.539   2.403
  120    HD2  ARG  20           2HD      ARG  20  -2.727  -8.530   1.247
  121    HD3  ARG  20           1HD      ARG  20  -1.912  -9.235   2.642
  122    HE   ARG  20           HE       ARG  20  -4.681  -8.670   3.137
  123   HH11  ARG  20          1HH1      ARG  20  -2.510 -10.985   1.635
  124   HH12  ARG  20          2HH1      ARG  20  -3.543 -12.343   1.953
  125   HH21  ARG  20          1HH2      ARG  20  -6.050 -10.451   3.514
  126   HH22  ARG  20          2HH2      ARG  20  -5.563 -12.046   3.014
  127    H    ALA  21           H        ALA  21   0.431  -6.099   5.420
  128    HA   ALA  21           HA       ALA  21  -1.604  -6.228   7.354
  129    HB1  ALA  21           1HB      ALA  21   1.350  -5.789   7.756
  130    HB2  ALA  21           2HB      ALA  21   0.541  -7.351   7.625
  131    HB3  ALA  21           3HB      ALA  21   0.207  -6.295   8.996
  132    H    ALA  22           H        ALA  22   0.462  -3.596   6.299
  133    HA   ALA  22           HA       ALA  22  -0.335  -1.779   8.363
  134    HB1  ALA  22           1HB      ALA  22   1.816  -1.572   7.162
  135    HB2  ALA  22           2HB      ALA  22   0.854  -0.097   7.091
  136    HB3  ALA  22           3HB      ALA  22   0.928  -1.167   5.693
  137    H    ALA  23           H        ALA  23  -1.360  -2.495   5.078
  138    HA   ALA  23           HA       ALA  23  -3.139  -0.397   4.653
  139    HB1  ALA  23           1HB      ALA  23  -4.218  -1.873   3.020
  140    HB2  ALA  23           2HB      ALA  23  -3.331  -3.248   3.685
  141    HB3  ALA  23           3HB      ALA  23  -2.459  -1.934   2.890
  142    H    VAL  24           H        VAL  24  -3.844  -3.662   5.899
  143    HA   VAL  24           HA       VAL  24  -6.562  -3.077   6.482
  144    HB   VAL  24           HB       VAL  24  -5.628  -5.370   6.113
  145   HG11  VAL  24          1HG1      VAL  24  -3.634  -5.226   7.470
  146   HG12  VAL  24          2HG1      VAL  24  -4.650  -6.561   8.015
  147   HG13  VAL  24          3HG1      VAL  24  -4.611  -5.052   8.929
  148   HG21  VAL  24          3HG2      VAL  24  -7.080  -6.480   7.748
  149   HG22  VAL  24          1HG2      VAL  24  -7.861  -5.077   7.017
  150   HG23  VAL  24          2HG2      VAL  24  -7.207  -4.970   8.651
  151    H    GLN  25           H        GLN  25  -3.718  -2.166   8.012
  152    HA   GLN  25           HA       GLN  25  -4.827  -2.003  10.692
  153    HB2  GLN  25           2HB      GLN  25  -2.282  -2.301   9.720
  154    HB3  GLN  25           1HB      GLN  25  -2.315  -0.582  10.088
  155    HG2  GLN  25           2HG      GLN  25  -1.444  -1.763  11.968
  156    HG3  GLN  25           1HG      GLN  25  -3.041  -1.145  12.387
  157   HE21  GLN  25          1HE2      GLN  25  -2.569  -3.927  10.323
  158   HE22  GLN  25          2HE2      GLN  25  -3.196  -5.097  11.441
  159    H    ALA  26           H        ALA  26  -4.497  -0.065   7.861
  160    HA   ALA  26           HA       ALA  26  -5.078   2.394   9.369
  161    HB1  ALA  26           1HB      ALA  26  -3.010   2.416   8.037
  162    HB2  ALA  26           2HB      ALA  26  -4.177   3.617   7.477
  163    HB3  ALA  26           3HB      ALA  26  -3.962   2.112   6.583
  164    H    VAL  27           H        VAL  27  -6.931   0.200   8.245
  165    HA   VAL  27           HA       VAL  27  -8.868   2.132   7.228
  166    HB   VAL  27           HB       VAL  27  -7.927   0.995   5.249
  167   HG11  VAL  27          1HG1      VAL  27  -7.328  -1.146   6.174
  168   HG12  VAL  27          2HG1      VAL  27  -8.452  -1.376   4.834
  169   HG13  VAL  27          3HG1      VAL  27  -9.021  -1.518   6.497
  170   HG21  VAL  27          3HG2      VAL  27 -10.058   0.328   4.237
  171   HG22  VAL  27          1HG2      VAL  27 -10.196   1.820   5.168
  172   HG23  VAL  27          2HG2      VAL  27 -10.798   0.303   5.838
  173    HA   PRO  28           HA       PRO  28 -11.147   0.036  10.410
  174    HB2  PRO  28           2HB      PRO  28 -13.433   1.465  10.207
  175    HB3  PRO  28           1HB      PRO  28 -11.968   2.108  10.956
  176    HG2  PRO  28           2HG      PRO  28 -13.057   2.576   8.211
  177    HG3  PRO  28           1HG      PRO  28 -12.313   3.729   9.333
  178    HD2  PRO  28           2HD      PRO  28 -10.991   2.597   7.226
  179    HD3  PRO  28           1HD      PRO  28 -10.186   3.144   8.711
  180    H    GLY  29           H        GLY  29 -11.147  -1.913   9.051
  181    HA2  GLY  29           2HA      GLY  29 -12.380  -3.733   8.367
  182    HA3  GLY  29           1HA      GLY  29 -13.832  -2.803   8.701
  183    H    GLY  30           H        GLY  30 -11.389  -1.646   6.502
  184    HA2  GLY  30           2HA      GLY  30 -13.345  -1.862   4.326
  185    HA3  GLY  30           1HA      GLY  30 -11.944  -0.798   4.350
  186    H    THR  31           H        THR  31 -12.199  -2.071   2.090
  187    HA   THR  31           HA       THR  31 -11.031  -4.693   2.102
  188    HB   THR  31           HB       THR  31 -11.543  -2.836  -0.231
  189    HG1  THR  31           1HG      THR  31 -13.234  -4.904  -0.101
  190   HG21  THR  31          3HG2      THR  31 -11.473  -4.893  -1.581
  191   HG22  THR  31          1HG2      THR  31 -11.036  -5.812  -0.142
  192   HG23  THR  31          2HG2      THR  31  -9.933  -4.592  -0.776
  193    H    ALA  32           H        ALA  32  -8.973  -4.826   2.718
  194    HA   ALA  32           HA       ALA  32  -7.006  -2.937   1.667
  195    HB1  ALA  32           1HB      ALA  32  -6.657  -5.148   3.691
  196    HB2  ALA  32           2HB      ALA  32  -6.940  -3.448   4.069
  197    HB3  ALA  32           3HB      ALA  32  -5.454  -3.936   3.249
  198    H    GLY  33           H        GLY  33  -5.876  -3.429  -0.097
  199    HA2  GLY  33           2HA      GLY  33  -6.038  -6.196  -1.080
  200    HA3  GLY  33           1HA      GLY  33  -5.742  -4.777  -2.072
  201    H    GLU  34           H        GLU  34  -4.184  -7.108  -2.178
  202    HA   GLU  34           HA       GLU  34  -1.765  -6.640  -0.698
  203    HB2  GLU  34           2HB      GLU  34  -2.232  -8.504  -3.031
  204    HB3  GLU  34           1HB      GLU  34  -0.862  -8.535  -1.926
  205    HG2  GLU  34           2HG      GLU  34  -2.618  -8.874  -0.087
  206    HG3  GLU  34           1HG      GLU  34  -3.710  -9.279  -1.409
  207    H    VAL  35           H        VAL  35   0.278  -6.169  -1.679
  208    HA   VAL  35           HA       VAL  35   0.011  -4.407  -4.016
  209    HB   VAL  35           HB       VAL  35   1.502  -2.783  -2.902
  210   HG11  VAL  35          1HG1      VAL  35  -1.013  -3.418  -1.364
  211   HG12  VAL  35          2HG1      VAL  35  -0.901  -2.431  -2.823
  212   HG13  VAL  35          3HG1      VAL  35  -0.146  -1.883  -1.325
  213   HG21  VAL  35          3HG2      VAL  35   1.107  -4.516  -0.466
  214   HG22  VAL  35          1HG2      VAL  35   1.920  -2.953  -0.507
  215   HG23  VAL  35          2HG2      VAL  35   2.612  -4.329  -1.367
  216    H    GLU  36           H        GLU  36   1.921  -4.038  -5.203
  217    HA   GLU  36           HA       GLU  36   4.128  -5.891  -4.630
  218    HB2  GLU  36           2HB      GLU  36   4.761  -5.692  -6.982
  219    HB3  GLU  36           1HB      GLU  36   3.106  -6.261  -6.827
  220    HG2  GLU  36           2HG      GLU  36   2.231  -4.150  -7.462
  221    HG3  GLU  36           1HG      GLU  36   3.817  -3.387  -7.343
  222    H    THR  37           H        THR  37   6.307  -5.047  -5.066
  223    HA   THR  37           HA       THR  37   6.631  -2.494  -3.836
  224    HB   THR  37           HB       THR  37   8.655  -4.317  -5.149
  225    HG1  THR  37           1HG      THR  37   7.334  -4.880  -3.107
  226   HG21  THR  37          3HG2      THR  37   9.087  -1.970  -3.301
  227   HG22  THR  37          1HG2      THR  37   9.502  -2.028  -5.014
  228   HG23  THR  37          2HG2      THR  37  10.335  -3.080  -3.868
  229    H    GLU  38           H        GLU  38   6.308  -0.650  -4.869
  230    HA   GLU  38           HA       GLU  38   6.393  -0.352  -7.688
  231    HB2  GLU  38           2HB      GLU  38   6.433   1.767  -5.526
  232    HB3  GLU  38           1HB      GLU  38   6.138   2.063  -7.234
  233    HG2  GLU  38           2HG      GLU  38   4.143   0.581  -7.077
  234    HG3  GLU  38           1HG      GLU  38   4.407   0.497  -5.336
  235    H    THR  39           H        THR  39   7.964   0.548  -8.993
  236    HA   THR  39           HA       THR  39  10.560   1.087  -7.756
  237    HB   THR  39           HB       THR  39  11.576  -0.324  -9.674
  238    HG1  THR  39           1HG      THR  39   8.951  -1.440  -9.505
  239   HG21  THR  39          3HG2      THR  39  10.169  -1.690  -7.375
  240   HG22  THR  39          1HG2      THR  39  11.759  -0.927  -7.307
  241   HG23  THR  39          2HG2      THR  39  11.509  -2.359  -8.308
  242    H    GLY  40           H        GLY  40  12.168   1.763  -9.540
  243    HA2  GLY  40           2HA      GLY  40  12.336   2.680 -11.807
  244    HA3  GLY  40           1HA      GLY  40  10.750   3.391 -11.548
  245    H    GLU  41           H        GLU  41  10.701   5.436 -10.981
  246    HA   GLU  41           HA       GLU  41  13.052   6.597  -9.667
  247    HB2  GLU  41           2HB      GLU  41  12.780   8.603 -11.138
  248    HB3  GLU  41           1HB      GLU  41  13.300   7.152 -11.985
  249    HG2  GLU  41           2HG      GLU  41  10.889   6.786 -12.597
  250    HG3  GLU  41           1HG      GLU  41  10.574   8.404 -11.973
  251    H    GLY  42           H        GLY  42  12.465   8.960  -8.995
  252    HA2  GLY  42           2HA      GLY  42  10.819  10.393  -8.021
  253    HA3  GLY  42           1HA      GLY  42   9.728   9.013  -7.926
  254    H    ALA  43           H        ALA  43   9.321   9.011  -5.753
  255    HA   ALA  43           HA       ALA  43  11.650   8.396  -4.062
  256    HB1  ALA  43           1HB      ALA  43  10.908  10.667  -3.600
  257    HB2  ALA  43           2HB      ALA  43  10.606   9.612  -2.218
  258    HB3  ALA  43           3HB      ALA  43   9.276  10.080  -3.278
  259    H    ALA  44           H        ALA  44   8.630   7.431  -5.198
  260    HA   ALA  44           HA       ALA  44   7.758   5.980  -2.881
  261    HB1  ALA  44           1HB      ALA  44   6.140   6.867  -4.474
  262    HB2  ALA  44           2HB      ALA  44   6.001   5.113  -4.344
  263    HB3  ALA  44           3HB      ALA  44   6.805   5.834  -5.739
  264    H    ALA  45           H        ALA  45   8.155   3.935  -2.346
  265    HA   ALA  45           HA       ALA  45   9.477   2.182  -4.308
  266    HB1  ALA  45           1HB      ALA  45  10.921   1.309  -2.545
  267    HB2  ALA  45           2HB      ALA  45  10.206   2.435  -1.390
  268    HB3  ALA  45           3HB      ALA  45  11.151   3.045  -2.748
  269    H    TYR  46           H        TYR  46   7.296   2.555  -1.613
  270    HA   TYR  46           HA       TYR  46   6.280  -0.145  -2.161
  271    HB2  TYR  46           2HB      TYR  46   6.750   1.096   0.551
  272    HB3  TYR  46           1HB      TYR  46   5.669  -0.272   0.306
  273    HD1  TYR  46           1HD      TYR  46   6.598  -2.446  -0.482
  274    HD2  TYR  46           2HD      TYR  46   9.108   0.809   0.601
  275    HE1  TYR  46           1HE      TYR  46   8.504  -3.989  -0.297
  276    HE2  TYR  46           2HE      TYR  46  11.018  -0.718   0.795
  277    HH   TYR  46           HH       TYR  46  11.514  -3.041   1.100
  278    H    GLY  47           H        GLY  47   4.014  -0.423  -1.679
  279    HA2  GLY  47           2HA      GLY  47   2.549   2.132  -1.560
  280    HA3  GLY  47           1HA      GLY  47   2.159   0.918  -2.772
  281    H    VAL  48           H        VAL  48   0.634   2.129  -0.497
  282    HA   VAL  48           HA       VAL  48  -0.332  -0.433   0.592
  283    HB   VAL  48           HB       VAL  48  -0.164   2.227   2.029
  284   HG11  VAL  48          1HG1      VAL  48  -2.286   1.117   2.528
  285   HG12  VAL  48          2HG1      VAL  48  -1.217   1.115   3.930
  286   HG13  VAL  48          3HG1      VAL  48  -1.417  -0.351   2.971
  287   HG21  VAL  48          3HG2      VAL  48   1.233   1.012   3.628
  288   HG22  VAL  48          1HG2      VAL  48   1.933   0.988   2.010
  289   HG23  VAL  48          2HG2      VAL  48   1.107  -0.439   2.635
  290    H    LEU  49           H        LEU  49  -2.191  -0.771  -0.550
  291    HA   LEU  49           HA       LEU  49  -3.827   1.588  -1.142
  292    HB2  LEU  49           2HB      LEU  49  -4.832   0.381  -2.946
  293    HB3  LEU  49           1HB      LEU  49  -3.093   0.245  -3.079
  294    HG   LEU  49           HG       LEU  49  -3.630  -2.056  -1.766
  295   HD11  LEU  49          1HD1      LEU  49  -5.622  -3.075  -2.752
  296   HD12  LEU  49          2HD1      LEU  49  -6.029  -1.544  -3.527
  297   HD13  LEU  49          3HD1      LEU  49  -6.042  -1.673  -1.768
  298   HD21  LEU  49          3HD2      LEU  49  -3.774  -1.611  -4.748
  299   HD22  LEU  49          1HD2      LEU  49  -3.459  -3.153  -3.952
  300   HD23  LEU  49          2HD2      LEU  49  -2.305  -1.829  -3.798
  301    H    VAL  50           H        VAL  50  -5.610   1.936  -0.103
  302    HA   VAL  50           HA       VAL  50  -6.944  -0.319   1.227
  303    HB   VAL  50           HB       VAL  50  -7.664   1.376   2.991
  304   HG11  VAL  50          1HG1      VAL  50  -6.036  -0.354   3.460
  305   HG12  VAL  50          2HG1      VAL  50  -5.560   1.149   4.250
  306   HG13  VAL  50          3HG1      VAL  50  -4.749   0.636   2.768
  307   HG21  VAL  50          3HG2      VAL  50  -6.215   3.307   3.330
  308   HG22  VAL  50          1HG2      VAL  50  -7.028   3.407   1.769
  309   HG23  VAL  50          2HG2      VAL  50  -5.336   2.920   1.852
  310    H    THR  51           H        THR  51  -8.907  -0.631   0.512
  311    HA   THR  51           HA       THR  51 -10.242   1.479  -0.996
  312    HB   THR  51           HB       THR  51 -11.181  -1.366  -0.594
  313    HG1  THR  51           1HG      THR  51  -9.193  -1.532  -1.575
  314   HG21  THR  51          3HG2      THR  51 -12.871   0.175  -1.443
  315   HG22  THR  51          1HG2      THR  51 -12.374  -0.951  -2.707
  316   HG23  THR  51          2HG2      THR  51 -11.769   0.707  -2.713
  317    H    ARG  52           H        ARG  52 -11.251   2.869   0.295
  318    HA   ARG  52           HA       ARG  52 -12.405   2.214   2.798
  319    HB2  ARG  52           2HB      ARG  52 -11.991   4.575   1.229
  320    HB3  ARG  52           1HB      ARG  52 -13.677   4.525   1.722
  321    HG2  ARG  52           2HG      ARG  52 -12.442   5.764   3.348
  322    HG3  ARG  52           1HG      ARG  52 -12.930   4.232   4.069
  323    HD2  ARG  52           2HD      ARG  52 -10.691   3.327   3.621
  324    HD3  ARG  52           1HD      ARG  52 -10.214   4.878   2.931
  325    HE   ARG  52           HE       ARG  52 -11.145   5.447   5.465
  326   HH11  ARG  52          1HH1      ARG  52  -8.554   3.533   4.081
  327   HH12  ARG  52          2HH1      ARG  52  -7.546   3.646   5.491
  328   HH21  ARG  52          1HH2      ARG  52  -9.815   5.605   7.315
  329   HH22  ARG  52          2HH2      ARG  52  -8.257   4.824   7.325
  330    HA   PRO  53           HA       PRO  53 -16.160   0.225   1.571
  331    HB2  PRO  53           2HB      PRO  53 -17.376   1.640   3.882
  332    HB3  PRO  53           1HB      PRO  53 -17.325  -0.089   3.518
  333    HG2  PRO  53           2HG      PRO  53 -15.773   0.936   5.423
  334    HG3  PRO  53           1HG      PRO  53 -15.167  -0.333   4.342
  335    HD2  PRO  53           2HD      PRO  53 -14.638   2.611   4.294
  336    HD3  PRO  53           1HD      PRO  53 -13.526   1.261   3.992
  337    H    ASP  54           H        ASP  54 -15.806   3.592   1.745
  338    HA   ASP  54           HA       ASP  54 -18.437   4.356   0.934
  339    HB2  ASP  54           2HB      ASP  54 -15.884   5.927   0.547
  340    HB3  ASP  54           1HB      ASP  54 -17.525   6.555   0.664
  341    H    GLY  55           H        GLY  55 -15.806   2.919  -0.637
  342    HA2  GLY  55           2HA      GLY  55 -16.022   2.032  -2.828
  343    HA3  GLY  55           1HA      GLY  55 -17.150   3.323  -3.212
  344    H    THR  56           H        THR  56 -14.049   3.815  -1.642
  345    HA   THR  56           HA       THR  56 -13.012   4.955  -4.139
  346    HB   THR  56           HB       THR  56 -13.865   6.790  -2.692
  347    HG1  THR  56           1HG      THR  56 -12.214   8.016  -3.269
  348   HG21  THR  56          3HG2      THR  56 -12.669   7.361  -0.626
  349   HG22  THR  56          1HG2      THR  56 -11.728   5.874  -0.765
  350   HG23  THR  56          2HG2      THR  56 -13.471   5.794  -0.500
  351    H    ARG  57           H        ARG  57 -10.788   4.755  -4.439
  352    HA   ARG  57           HA       ARG  57  -9.508   2.858  -2.590
  353    HB2  ARG  57           2HB      ARG  57  -9.896   2.179  -5.013
  354    HB3  ARG  57           1HB      ARG  57  -8.699   3.389  -5.450
  355    HG2  ARG  57           2HG      ARG  57  -7.062   2.209  -3.996
  356    HG3  ARG  57           1HG      ARG  57  -8.269   0.946  -3.746
  357    HD2  ARG  57           2HD      ARG  57  -7.129   0.025  -5.490
  358    HD3  ARG  57           1HD      ARG  57  -8.311   0.970  -6.391
  359    HE   ARG  57           HE       ARG  57  -6.112   2.612  -6.004
  360   HH11  ARG  57          1HH1      ARG  57  -6.935  -0.328  -7.703
  361   HH12  ARG  57          2HH1      ARG  57  -5.599  -0.223  -8.815
  362   HH21  ARG  57          1HH2      ARG  57  -4.346   2.789  -7.480
  363   HH22  ARG  57          2HH2      ARG  57  -4.143   1.560  -8.702
  364    H    VAL  58           H        VAL  58  -7.972   3.667  -1.352
  365    HA   VAL  58           HA       VAL  58  -6.514   6.048  -2.293
  366    HB   VAL  58           HB       VAL  58  -6.897   5.101   0.555
  367   HG11  VAL  58          1HG1      VAL  58  -5.648   7.625  -0.523
  368   HG12  VAL  58          2HG1      VAL  58  -4.789   6.282   0.227
  369   HG13  VAL  58          3HG1      VAL  58  -5.911   7.253   1.180
  370   HG21  VAL  58          3HG2      VAL  58  -8.352   7.043   0.825
  371   HG22  VAL  58          1HG2      VAL  58  -8.980   5.943  -0.403
  372   HG23  VAL  58          2HG2      VAL  58  -8.160   7.430  -0.885
  373    H    GLU  59           H        GLU  59  -4.552   5.558  -3.041
  374    HA   GLU  59           HA       GLU  59  -3.134   3.302  -1.807
  375    HB2  GLU  59           2HB      GLU  59  -1.641   3.437  -3.834
  376    HB3  GLU  59           1HB      GLU  59  -3.296   2.937  -4.144
  377    HG2  GLU  59           2HG      GLU  59  -3.841   5.149  -4.961
  378    HG3  GLU  59           1HG      GLU  59  -2.215   5.715  -4.579
  379    H    VAL  60           H        VAL  60  -1.826   3.843  -0.274
  380    HA   VAL  60           HA       VAL  60  -0.624   6.489  -0.170
  381    HB   VAL  60           HB       VAL  60  -0.346   4.216   1.804
  382   HG11  VAL  60          1HG1      VAL  60   0.270   5.990   3.381
  383   HG12  VAL  60          2HG1      VAL  60   0.163   7.175   2.079
  384   HG13  VAL  60          3HG1      VAL  60   1.385   5.905   2.017
  385   HG21  VAL  60          3HG2      VAL  60  -2.698   4.841   1.511
  386   HG22  VAL  60          1HG2      VAL  60  -2.291   6.520   1.854
  387   HG23  VAL  60          2HG2      VAL  60  -2.096   5.293   3.104
  388    H    HIS  61           H        HIS  61   1.358   6.911  -0.822
  389    HA   HIS  61           HA       HIS  61   3.012   4.690  -1.761
  390    HB2  HIS  61           2HB      HIS  61   3.142   7.656  -2.289
  391    HB3  HIS  61           1HB      HIS  61   4.264   6.487  -2.964
  392    HD1  HIS  61           1HD      HIS  61   1.670   8.388  -4.181
  393    HD2  HIS  61           2HD      HIS  61   2.270   4.264  -4.148
  394    HE1  HIS  61           1HE      HIS  61   0.210   7.468  -6.004
  395    HE2  HIS  61           2HE      HIS  61   0.409   4.972  -5.806
  396    H    LEU  62           H        LEU  62   4.715   4.045  -0.684
  397    HA   LEU  62           HA       LEU  62   5.760   5.734   1.500
  398    HB2  LEU  62           2HB      LEU  62   5.455   2.774   1.151
  399    HB3  LEU  62           1HB      LEU  62   6.715   3.389   2.195
  400    HG   LEU  62           HG       LEU  62   5.251   4.041   3.830
  401   HD11  LEU  62          1HD1      LEU  62   2.904   4.632   3.487
  402   HD12  LEU  62          2HD1      LEU  62   3.071   4.292   1.764
  403   HD13  LEU  62          3HD1      LEU  62   3.970   5.623   2.490
  404   HD21  LEU  62          3HD2      LEU  62   3.492   2.367   4.056
  405   HD22  LEU  62          1HD2      LEU  62   5.012   1.651   3.515
  406   HD23  LEU  62          2HD2      LEU  62   3.704   1.926   2.362
  407    H    ASP  63           H        ASP  63   8.036   5.745   1.861
  408    HA   ASP  63           HA       ASP  63   9.586   5.300  -0.569
  409    HB2  ASP  63           2HB      ASP  63  11.376   6.541   0.539
  410    HB3  ASP  63           1HB      ASP  63   9.870   7.446   0.609
  411    H    ARG  64           H        ARG  64  12.084   4.898   0.619
  412    HA   ARG  64           HA       ARG  64  12.167   2.084   0.622
  413    HB2  ARG  64           2HB      ARG  64  14.367   3.673   1.866
  414    HB3  ARG  64           1HB      ARG  64  14.463   2.310   0.762
  415    HG2  ARG  64           2HG      ARG  64  14.303   3.616  -1.088
  416    HG3  ARG  64           1HG      ARG  64  13.313   4.836  -0.279
  417    HD2  ARG  64           2HD      ARG  64  16.282   4.402  -0.042
  418    HD3  ARG  64           1HD      ARG  64  15.441   5.819  -0.673
  419    HE   ARG  64           HE       ARG  64  14.917   5.125   2.104
  420   HH11  ARG  64          1HH1      ARG  64  16.742   7.122  -0.126
  421   HH12  ARG  64          2HH1      ARG  64  17.112   8.323   1.065
  422   HH21  ARG  64          1HH2      ARG  64  15.387   6.680   3.658
  423   HH22  ARG  64          2HH2      ARG  64  16.321   8.091   3.225
  424    H    ASP  65           H        ASP  65  11.844   4.424   3.182
  425    HA   ASP  65           HA       ASP  65  12.534   2.406   5.199
  426    HB2  ASP  65           2HB      ASP  65  12.218   5.405   5.414
  427    HB3  ASP  65           1HB      ASP  65  12.589   4.342   6.769
  428    H    PHE  66           H        PHE  66   9.926   2.889   3.606
  429    HA   PHE  66           HA       PHE  66   7.782   2.217   3.962
  430    HB2  PHE  66           2HB      PHE  66   9.183   0.900   5.906
  431    HB3  PHE  66           1HB      PHE  66   8.024   1.798   6.873
  432    HD1  PHE  66           2HD      PHE  66   5.569   1.459   6.452
  433    HD2  PHE  66           1HD      PHE  66   8.564  -1.010   4.704
  434    HE1  PHE  66           2HE      PHE  66   3.876  -0.265   5.995
  435    HE2  PHE  66           1HE      PHE  66   6.874  -2.741   4.244
  436    HZ   PHE  66           HZ       PHE  66   4.529  -2.365   4.887
  437    H    ARG  67           H        ARG  67   8.844   5.004   4.611
  438    HA   ARG  67           HA       ARG  67   6.860   5.952   6.522
  439    HB2  ARG  67           2HB      ARG  67   9.049   6.905   6.752
  440    HB3  ARG  67           1HB      ARG  67   9.107   7.324   5.046
  441    HG2  ARG  67           2HG      ARG  67   7.276   8.930   5.403
  442    HG3  ARG  67           1HG      ARG  67   7.298   8.539   7.124
  443    HD2  ARG  67           2HD      ARG  67   9.671   9.591   5.599
  444    HD3  ARG  67           1HD      ARG  67   8.551  10.611   6.502
  445    HE   ARG  67           HE       ARG  67   9.231   9.269   8.499
  446   HH11  ARG  67          1HH1      ARG  67  11.350   9.558   5.717
  447   HH12  ARG  67          2HH1      ARG  67  12.810   9.340   6.644
  448   HH21  ARG  67          1HH2      ARG  67  11.144   8.986   9.719
  449   HH22  ARG  67          2HH2      ARG  67  12.690   9.009   8.925
  450    H    VAL  68           H        VAL  68   5.200   7.372   6.018
  451    HA   VAL  68           HA       VAL  68   4.021   7.088   3.465
  452    HB   VAL  68           HB       VAL  68   2.601   7.377   5.388
  453   HG11  VAL  68          1HG1      VAL  68   3.875  10.088   5.717
  454   HG12  VAL  68          2HG1      VAL  68   4.030   8.711   6.808
  455   HG13  VAL  68          3HG1      VAL  68   2.470   9.510   6.611
  456   HG21  VAL  68          3HG2      VAL  68   2.414   9.799   3.599
  457   HG22  VAL  68          1HG2      VAL  68   1.118   9.159   4.611
  458   HG23  VAL  68          2HG2      VAL  68   1.736   8.207   3.260
  459    H    LEU  69           H        LEU  69   4.345   8.191   1.669
  460    HA   LEU  69           HA       LEU  69   5.647  10.817   1.840
  461    HB2  LEU  69           2HB      LEU  69   5.581   8.862  -0.446
  462    HB3  LEU  69           1HB      LEU  69   6.320  10.450  -0.506
  463    HG   LEU  69           HG       LEU  69   7.215   8.091   1.143
  464   HD11  LEU  69          1HD1      LEU  69   9.235   8.299  -0.218
  465   HD12  LEU  69          2HD1      LEU  69   8.491   9.622  -1.115
  466   HD13  LEU  69          3HD1      LEU  69   7.808   7.998  -1.209
  467   HD21  LEU  69          3HD2      LEU  69   7.457  10.185   2.416
  468   HD22  LEU  69          1HD2      LEU  69   8.356  10.884   1.069
  469   HD23  LEU  69          2HD2      LEU  69   9.016   9.507   1.950
  470    H    ASP  70           H        ASP  70   3.388   9.008  -0.217
  471    HA   ASP  70           HA       ASP  70   2.022  11.547  -0.806
  472    HB2  ASP  70           2HB      ASP  70   3.546  11.201  -2.627
  473    HB3  ASP  70           1HB      ASP  70   3.067   9.515  -2.779
  474    H    THR  71           H        THR  71  -0.161  11.417  -1.103
  475    HA   THR  71           HA       THR  71  -1.374   8.753  -0.731
  476    HB   THR  71           HB       THR  71  -2.590  11.378   0.137
  477    HG1  THR  71           1HG      THR  71  -0.975  11.275   1.549
  478   HG21  THR  71          3HG2      THR  71  -3.176   8.512   0.888
  479   HG22  THR  71          1HG2      THR  71  -4.166   9.538  -0.152
  480   HG23  THR  71          2HG2      THR  71  -3.978   9.933   1.557
  481    H    GLU  72           H        GLU  72  -2.250   8.124  -2.619
  482    HA   GLU  72           HA       GLU  72  -3.551  10.179  -4.281
  483    HB2  GLU  72           2HB      GLU  72  -1.937   7.767  -4.996
  484    HB3  GLU  72           1HB      GLU  72  -3.183   8.323  -6.104
  485    HG2  GLU  72           2HG      GLU  72  -0.922  10.018  -5.076
  486    HG3  GLU  72           1HG      GLU  72  -0.936   9.188  -6.631
  487    HA   PRO  73           HA       PRO  73  -7.197   7.570  -3.826
  488    HB2  PRO  73           2HB      PRO  73  -8.750   9.803  -4.713
  489    HB3  PRO  73           1HB      PRO  73  -8.643   9.154  -3.077
  490    HG2  PRO  73           2HG      PRO  73  -7.704  11.637  -3.872
  491    HG3  PRO  73           1HG      PRO  73  -7.184  10.769  -2.417
  492    HD2  PRO  73           2HD      PRO  73  -5.836  10.999  -5.076
  493    HD3  PRO  73           1HD      PRO  73  -5.124  10.948  -3.448
  494    H    ALA  74           H        ALA  74  -6.741   6.282  -5.626
  495    HA   ALA  74           HA       ALA  74  -7.338   7.469  -8.254
  496    HB1  ALA  74           1HB      ALA  74  -5.137   5.495  -7.663
  497    HB2  ALA  74           2HB      ALA  74  -4.916   7.220  -7.964
  498    HB3  ALA  74           3HB      ALA  74  -5.537   6.174  -9.243
  499    H    ASP  75           H        ASP  75  -8.319   6.154  -9.778
  500    HA   ASP  75           HA       ASP  75  -9.412   3.637  -8.716
  501    HB2  ASP  75           2HB      ASP  75 -11.129   5.312  -9.234
  502    HB3  ASP  75           1HB      ASP  75 -10.515   5.446 -10.878
  503    H    GLY  76           H        GLY  76  -9.689   1.866 -10.295
  504    HA2  GLY  76           2HA      GLY  76  -7.213   1.736 -11.846
  505    HA3  GLY  76           1HA      GLY  76  -8.163   0.369 -11.295
  506    H    ASP  77           H        ASP  77 -10.316   2.538 -12.628
  507    HA   ASP  77           HA       ASP  77 -10.488   0.937 -15.040
  508    HB2  ASP  77           2HB      ASP  77 -12.556   1.573 -13.894
  509    HB3  ASP  77           1HB      ASP  77 -12.179   3.276 -14.136
  510    H    GLY  78           H        GLY  78 -10.276   4.441 -14.400
  511    HA2  GLY  78           2HA      GLY  78  -8.929   6.000 -15.490
  512    HA3  GLY  78           1HA      GLY  78  -8.396   4.735 -16.589
  513    H    GLY  79           H        GLY  79  -9.370   4.511 -18.542
  514    HA2  GLY  79           2HA      GLY  79 -11.916   5.349 -19.271
  515    HA3  GLY  79           1HA      GLY  79 -10.840   6.714 -19.542
  516    H    LEU  80           H        LEU  80 -11.790   6.185 -21.770
  517    HA   LEU  80           HA       LEU  80 -10.040   4.242 -23.129
  518    HB2  LEU  80           2HB      LEU  80 -12.517   3.954 -23.367
  519    HB3  LEU  80           1HB      LEU  80 -12.588   5.525 -24.136
  520    HG   LEU  80           HG       LEU  80 -10.771   3.518 -25.364
  521   HD11  LEU  80          1HD1      LEU  80 -13.777   3.380 -25.602
  522   HD12  LEU  80          2HD1      LEU  80 -12.744   2.170 -24.839
  523   HD13  LEU  80          3HD1      LEU  80 -12.620   2.469 -26.573
  524   HD21  LEU  80          3HD2      LEU  80 -12.750   5.505 -26.478
  525   HD22  LEU  80          1HD2      LEU  80 -11.605   4.547 -27.414
  526   HD23  LEU  80          2HD2      LEU  80 -11.016   5.773 -26.290
  527    H    GLU  81           H        GLU  81  -8.550   4.973 -24.540
  528    HA   GLU  81           HA       GLU  81  -7.149   6.384 -25.624
  529    HB2  GLU  81           2HB      GLU  81  -9.533   8.243 -25.690
  530    HB3  GLU  81           1HB      GLU  81  -8.007   8.564 -26.497
  531    HG2  GLU  81           2HG      GLU  81  -8.326   6.539 -27.855
  532    HG3  GLU  81           1HG      GLU  81  -9.887   6.286 -27.071
  Start of MODEL    3
    1    H1   GLY   1           1HT      GLY   1  11.286   7.191  15.225
    2    H2   GLY   1           2HT      GLY   1  11.905   6.090  14.088
    3    H3   GLY   1           3HT      GLY   1  12.170   5.842  15.740
    4    HA2  GLY   1           1HA      GLY   1   9.872   5.413  16.134
    5    HA3  GLY   1           2HA      GLY   1   9.495   5.840  14.470
    6    H    ALA   2           H        ALA   2   8.635   3.886  13.891
    7    HA   ALA   2           HA       ALA   2  10.606   1.777  13.433
    8    HB1  ALA   2           1HB      ALA   2   9.497   1.104  15.495
    9    HB2  ALA   2           2HB      ALA   2   9.049   0.028  14.170
   10    HB3  ALA   2           3HB      ALA   2   7.922   1.271  14.719
   11    H    MET   3           H        MET   3  10.614   1.701  11.303
   12    HA   MET   3           HA       MET   3   8.369   2.427   9.693
   13    HB2  MET   3           2HB      MET   3  11.037   1.189   8.999
   14    HB3  MET   3           1HB      MET   3   9.833   1.631   7.799
   15    HG2  MET   3           2HG      MET   3  11.465   3.360   7.898
   16    HG3  MET   3           1HG      MET   3   9.976   3.975   8.607
   17    HE1  MET   3           3HE      MET   3  12.573   1.525  10.328
   18    HE2  MET   3           1HE      MET   3  13.665   2.688  11.074
   19    HE3  MET   3           2HE      MET   3  13.562   2.575   9.315
   20    H    ALA   4           H        ALA   4   7.269   1.024   8.195
   21    HA   ALA   4           HA       ALA   4   6.544  -1.421   9.518
   22    HB1  ALA   4           1HB      ALA   4   4.831   0.048   8.571
   23    HB2  ALA   4           2HB      ALA   4   4.762  -1.569   7.870
   24    HB3  ALA   4           3HB      ALA   4   5.478  -0.241   6.955
   25    H    PHE   5           H        PHE   5   8.882  -2.143   9.071
   26    HA   PHE   5           HA       PHE   5   8.827  -3.754   6.608
   27    HB2  PHE   5           2HB      PHE   5  11.153  -2.775   8.269
   28    HB3  PHE   5           1HB      PHE   5  11.318  -4.067   7.084
   29    HD1  PHE   5           2HD      PHE   5  11.060  -3.610   4.700
   30    HD2  PHE   5           1HD      PHE   5  10.900  -0.490   7.591
   31    HE1  PHE   5           2HE      PHE   5  11.381  -1.948   2.915
   32    HE2  PHE   5           1HE      PHE   5  11.215   1.177   5.810
   33    HZ   PHE   5           HZ       PHE   5  11.456   0.450   3.472
   34    H    ASP   6           H        ASP   6   7.207  -4.722   8.297
   35    HA   ASP   6           HA       ASP   6   8.458  -7.157   9.211
   36    HB2  ASP   6           2HB      ASP   6   8.605  -5.645  11.193
   37    HB3  ASP   6           1HB      ASP   6   6.853  -5.464  11.145
   38    H    GLY   7           H        GLY   7   7.230  -8.688   8.402
   39    HA2  GLY   7           2HA      GLY   7   4.329  -8.507   8.627
   40    HA3  GLY   7           1HA      GLY   7   4.975  -8.562   6.991
   41    H    GLU   8           H        GLU   8   3.254 -10.494   8.174
   42    HA   GLU   8           HA       GLU   8   4.905 -12.728   8.967
   43    HB2  GLU   8           2HB      GLU   8   1.984 -12.220   8.788
   44    HB3  GLU   8           1HB      GLU   8   2.526 -13.890   8.695
   45    HG2  GLU   8           2HG      GLU   8   1.997 -13.429  10.958
   46    HG3  GLU   8           1HG      GLU   8   3.752 -13.536  10.836
   47    H    ASP   9           H        ASP   9   4.462 -14.876   7.954
   48    HA   ASP   9           HA       ASP   9   5.254 -14.610   5.171
   49    HB2  ASP   9           2HB      ASP   9   6.697 -15.862   6.659
   50    HB3  ASP   9           1HB      ASP   9   5.364 -16.891   7.154
   51    H    GLU  10           H        GLU  10   2.380 -14.854   6.587
   52    HA   GLU  10           HA       GLU  10   1.287 -17.188   5.302
   53    HB2  GLU  10           2HB      GLU  10  -0.126 -14.992   6.822
   54    HB3  GLU  10           1HB      GLU  10  -0.803 -16.557   6.388
   55    HG2  GLU  10           2HG      GLU  10   1.439 -16.005   8.315
   56    HG3  GLU  10           1HG      GLU  10  -0.170 -16.627   8.683
   57    H    VAL  11           H        VAL  11   2.311 -14.846   3.692
   58    HA   VAL  11           HA       VAL  11  -0.057 -14.620   1.968
   59    HB   VAL  11           HB       VAL  11   0.699 -12.344   1.280
   60   HG11  VAL  11          1HG1      VAL  11  -0.012 -12.667   4.192
   61   HG12  VAL  11          2HG1      VAL  11  -1.139 -12.570   2.840
   62   HG13  VAL  11          3HG1      VAL  11  -0.153 -11.172   3.269
   63   HG21  VAL  11          3HG2      VAL  11   2.219 -11.110   2.766
   64   HG22  VAL  11          1HG2      VAL  11   3.018 -12.466   1.971
   65   HG23  VAL  11          2HG2      VAL  11   2.530 -12.597   3.661
   66    H    THR  12           H        THR  12   0.675 -13.842  -0.294
   67    HA   THR  12           HA       THR  12   2.951 -15.480  -1.095
   68    HB   THR  12           HB       THR  12   1.129 -13.944  -2.947
   69    HG1  THR  12           1HG      THR  12  -0.383 -15.139  -1.982
   70   HG21  THR  12          3HG2      THR  12   2.655 -16.534  -3.270
   71   HG22  THR  12          1HG2      THR  12   3.166 -14.963  -3.887
   72   HG23  THR  12          2HG2      THR  12   1.703 -15.723  -4.514
   73    H    GLY  13           H        GLY  13   4.851 -14.427  -0.870
   74    HA2  GLY  13           2HA      GLY  13   6.438 -12.753  -1.183
   75    HA3  GLY  13           1HA      GLY  13   5.218 -11.792  -2.019
   76    HA   PRO  14           HA       PRO  14   4.800 -11.534   2.901
   77    HB2  PRO  14           2HB      PRO  14   7.675 -11.084   3.425
   78    HB3  PRO  14           1HB      PRO  14   6.494 -12.032   4.334
   79    HG2  PRO  14           2HG      PRO  14   8.348 -13.213   2.850
   80    HG3  PRO  14           1HG      PRO  14   6.708 -13.874   2.950
   81    HD2  PRO  14           2HD      PRO  14   7.996 -12.293   0.760
   82    HD3  PRO  14           1HD      PRO  14   6.883 -13.673   0.650
   83    H    ASP  15           H        ASP  15   6.649  -9.654   0.665
   84    HA   ASP  15           HA       ASP  15   6.741  -7.287   2.273
   85    HB2  ASP  15           2HB      ASP  15   7.084  -7.719  -0.697
   86    HB3  ASP  15           1HB      ASP  15   7.220  -6.140   0.075
   87    H    ALA  16           H        ALA  16   4.382  -8.905   0.463
   88    HA   ALA  16           HA       ALA  16   2.585  -6.765   0.024
   89    HB1  ALA  16           1HB      ALA  16   1.991  -9.691   0.482
   90    HB2  ALA  16           2HB      ALA  16   2.336  -8.942  -1.077
   91    HB3  ALA  16           3HB      ALA  16   0.878  -8.498  -0.189
   92    H    ASP  17           H        ASP  17   3.440  -8.714   2.795
   93    HA   ASP  17           HA       ASP  17   1.021  -8.029   4.235
   94    HB2  ASP  17           2HB      ASP  17   2.245 -10.255   4.401
   95    HB3  ASP  17           1HB      ASP  17   3.445  -9.411   5.376
   96    H    ARG  18           H        ARG  18   4.329  -6.890   4.079
   97    HA   ARG  18           HA       ARG  18   4.586  -5.576   6.523
   98    HB2  ARG  18           2HB      ARG  18   5.515  -4.015   4.188
   99    HB3  ARG  18           1HB      ARG  18   6.375  -4.472   5.643
  100    HG2  ARG  18           2HG      ARG  18   5.785  -6.492   3.531
  101    HG3  ARG  18           1HG      ARG  18   7.138  -5.378   3.362
  102    HD2  ARG  18           2HD      ARG  18   7.873  -6.186   5.666
  103    HD3  ARG  18           1HD      ARG  18   6.696  -7.488   5.456
  104    HE   ARG  18           HE       ARG  18   8.636  -7.081   3.309
  105   HH11  ARG  18          1HH1      ARG  18   7.694  -8.951   6.119
  106   HH12  ARG  18          2HH1      ARG  18   8.664 -10.322   5.687
  107   HH21  ARG  18          1HH2      ARG  18   9.899  -8.845   2.740
  108   HH22  ARG  18          2HH2      ARG  18   9.923 -10.271   3.740
  109    H    ALA  19           H        ALA  19   3.362  -4.280   3.456
  110    HA   ALA  19           HA       ALA  19   2.481  -1.833   4.692
  111    HB1  ALA  19           1HB      ALA  19   3.415  -1.831   2.434
  112    HB2  ALA  19           2HB      ALA  19   1.762  -1.214   2.444
  113    HB3  ALA  19           3HB      ALA  19   2.088  -2.853   1.880
  114    H    ARG  20           H        ARG  20   1.119  -4.902   3.956
  115    HA   ARG  20           HA       ARG  20  -1.609  -4.177   3.796
  116    HB2  ARG  20           2HB      ARG  20  -0.698  -6.338   3.032
  117    HB3  ARG  20           1HB      ARG  20  -0.357  -6.775   4.698
  118    HG2  ARG  20           2HG      ARG  20  -2.772  -6.680   5.181
  119    HG3  ARG  20           1HG      ARG  20  -3.066  -6.340   3.467
  120    HD2  ARG  20           2HD      ARG  20  -2.186  -8.441   2.811
  121    HD3  ARG  20           1HD      ARG  20  -1.523  -8.742   4.414
  122    HE   ARG  20           HE       ARG  20  -4.424  -8.676   3.867
  123   HH11  ARG  20          1HH1      ARG  20  -1.598 -10.082   5.409
  124   HH12  ARG  20          2HH1      ARG  20  -2.497 -11.352   6.178
  125   HH21  ARG  20          1HH2      ARG  20  -5.607 -10.335   4.887
  126   HH22  ARG  20          2HH2      ARG  20  -4.784 -11.486   5.908
  127    H    ALA  21           H        ALA  21   0.527  -4.996   6.480
  128    HA   ALA  21           HA       ALA  21  -1.411  -4.981   8.531
  129    HB1  ALA  21           1HB      ALA  21   0.471  -4.692  10.056
  130    HB2  ALA  21           2HB      ALA  21   1.519  -4.275   8.702
  131    HB3  ALA  21           3HB      ALA  21   0.845  -5.901   8.827
  132    H    ALA  22           H        ALA  22   0.301  -2.440   6.860
  133    HA   ALA  22           HA       ALA  22  -0.563  -0.355   8.646
  134    HB1  ALA  22           1HB      ALA  22   1.511  -0.141   7.352
  135    HB2  ALA  22           2HB      ALA  22   0.385   1.171   7.001
  136    HB3  ALA  22           3HB      ALA  22   0.575  -0.159   5.858
  137    H    ALA  23           H        ALA  23  -1.581  -1.707   5.567
  138    HA   ALA  23           HA       ALA  23  -3.506   0.131   4.800
  139    HB1  ALA  23           1HB      ALA  23  -2.720  -1.694   3.381
  140    HB2  ALA  23           2HB      ALA  23  -4.480  -1.664   3.477
  141    HB3  ALA  23           3HB      ALA  23  -3.566  -2.856   4.402
  142    H    VAL  24           H        VAL  24  -3.914  -2.756   6.837
  143    HA   VAL  24           HA       VAL  24  -6.699  -2.434   7.184
  144    HB   VAL  24           HB       VAL  24  -5.557  -4.584   7.521
  145   HG11  VAL  24          1HG1      VAL  24  -4.295  -5.052   9.541
  146   HG12  VAL  24          2HG1      VAL  24  -4.465  -3.374  10.054
  147   HG13  VAL  24          3HG1      VAL  24  -3.530  -3.763   8.611
  148   HG21  VAL  24          3HG2      VAL  24  -7.042  -3.592   9.949
  149   HG22  VAL  24          1HG2      VAL  24  -6.748  -5.287   9.557
  150   HG23  VAL  24          2HG2      VAL  24  -7.748  -4.296   8.495
  151    H    GLN  25           H        GLN  25  -4.025  -0.840   8.631
  152    HA   GLN  25           HA       GLN  25  -5.615   0.116  10.882
  153    HB2  GLN  25           2HB      GLN  25  -2.803  -0.156  10.334
  154    HB3  GLN  25           1HB      GLN  25  -3.162   1.511  10.760
  155    HG2  GLN  25           2HG      GLN  25  -2.581   0.377  12.755
  156    HG3  GLN  25           1HG      GLN  25  -4.319   0.656  12.802
  157   HE21  GLN  25          1HE2      GLN  25  -2.725  -1.833  10.911
  158   HE22  GLN  25          2HE2      GLN  25  -3.367  -3.169  11.799
  159    H    ALA  26           H        ALA  26  -4.776   1.011   7.704
  160    HA   ALA  26           HA       ALA  26  -5.083   3.863   8.114
  161    HB1  ALA  26           1HB      ALA  26  -4.752   2.312   5.549
  162    HB2  ALA  26           2HB      ALA  26  -3.442   3.000   6.508
  163    HB3  ALA  26           3HB      ALA  26  -4.623   4.061   5.742
  164    H    VAL  27           H        VAL  27  -6.983   1.172   6.920
  165    HA   VAL  27           HA       VAL  27  -9.219   3.040   6.500
  166    HB   VAL  27           HB       VAL  27  -8.603   1.992   4.393
  167   HG11  VAL  27          1HG1      VAL  27  -9.089  -0.644   5.775
  168   HG12  VAL  27          2HG1      VAL  27  -7.541  -0.033   5.192
  169   HG13  VAL  27          3HG1      VAL  27  -8.820  -0.432   4.045
  170   HG21  VAL  27          3HG2      VAL  27 -11.175   0.886   5.502
  171   HG22  VAL  27          1HG2      VAL  27 -10.764   1.011   3.791
  172   HG23  VAL  27          2HG2      VAL  27 -10.946   2.472   4.762
  173    HA   PRO  28           HA       PRO  28 -10.829   0.979  10.095
  174    HB2  PRO  28           2HB      PRO  28 -13.231   2.266  10.137
  175    HB3  PRO  28           1HB      PRO  28 -11.726   2.994  10.708
  176    HG2  PRO  28           2HG      PRO  28 -13.138   3.352   8.099
  177    HG3  PRO  28           1HG      PRO  28 -12.333   4.562   9.115
  178    HD2  PRO  28           2HD      PRO  28 -11.185   3.507   6.895
  179    HD3  PRO  28           1HD      PRO  28 -10.244   4.034   8.306
  180    H    GLY  29           H        GLY  29 -11.206  -1.120   9.556
  181    HA2  GLY  29           2HA      GLY  29 -12.485  -2.976   9.131
  182    HA3  GLY  29           1HA      GLY  29 -13.890  -1.919   9.150
  183    H    GLY  30           H        GLY  30 -11.253  -1.383   6.947
  184    HA2  GLY  30           2HA      GLY  30 -13.116  -1.862   4.735
  185    HA3  GLY  30           1HA      GLY  30 -11.631  -0.925   4.650
  186    H    THR  31           H        THR  31 -11.572  -2.349   2.649
  187    HA   THR  31           HA       THR  31 -10.687  -5.071   3.176
  188    HB   THR  31           HB       THR  31 -11.034  -3.621   0.543
  189    HG1  THR  31           1HG      THR  31 -12.889  -4.359   2.157
  190   HG21  THR  31          3HG2      THR  31 -10.960  -5.860  -0.452
  191   HG22  THR  31          1HG2      THR  31 -10.650  -6.560   1.138
  192   HG23  THR  31          2HG2      THR  31  -9.457  -5.492   0.396
  193    H    ALA  32           H        ALA  32  -8.657  -5.322   3.755
  194    HA   ALA  32           HA       ALA  32  -6.577  -3.591   2.625
  195    HB1  ALA  32           1HB      ALA  32  -6.429  -5.595   4.880
  196    HB2  ALA  32           2HB      ALA  32  -6.580  -3.846   5.056
  197    HB3  ALA  32           3HB      ALA  32  -5.122  -4.539   4.348
  198    H    GLY  33           H        GLY  33  -6.041  -4.352   0.659
  199    HA2  GLY  33           2HA      GLY  33  -6.001  -7.224   0.162
  200    HA3  GLY  33           1HA      GLY  33  -5.838  -5.953  -1.040
  201    H    GLU  34           H        GLU  34  -4.215  -8.221  -0.953
  202    HA   GLU  34           HA       GLU  34  -1.725  -7.633   0.289
  203    HB2  GLU  34           2HB      GLU  34  -0.885  -9.431  -1.344
  204    HB3  GLU  34           1HB      GLU  34  -2.060  -9.910  -0.129
  205    HG2  GLU  34           2HG      GLU  34  -3.824  -9.534  -1.927
  206    HG3  GLU  34           1HG      GLU  34  -2.482  -9.477  -3.068
  207    H    VAL  35           H        VAL  35  -0.079  -6.437  -0.394
  208    HA   VAL  35           HA       VAL  35  -0.505  -4.942  -2.880
  209    HB   VAL  35           HB       VAL  35   0.840  -3.173  -1.923
  210   HG11  VAL  35          1HG1      VAL  35  -1.241  -4.172   0.017
  211   HG12  VAL  35          2HG1      VAL  35  -1.528  -3.163  -1.401
  212   HG13  VAL  35          3HG1      VAL  35  -0.600  -2.532  -0.040
  213   HG21  VAL  35          3HG2      VAL  35   1.153  -4.953   0.491
  214   HG22  VAL  35          1HG2      VAL  35   1.719  -3.288   0.351
  215   HG23  VAL  35          2HG2      VAL  35   2.421  -4.549  -0.664
  216    H    GLU  36           H        GLU  36   1.294  -4.418  -4.222
  217    HA   GLU  36           HA       GLU  36   3.463  -6.398  -4.041
  218    HB2  GLU  36           2HB      GLU  36   3.779  -6.007  -6.457
  219    HB3  GLU  36           1HB      GLU  36   2.148  -6.550  -6.089
  220    HG2  GLU  36           2HG      GLU  36   1.329  -4.270  -6.275
  221    HG3  GLU  36           1HG      GLU  36   2.964  -3.699  -6.607
  222    H    THR  37           H        THR  37   5.621  -5.724  -4.519
  223    HA   THR  37           HA       THR  37   6.260  -3.091  -3.559
  224    HB   THR  37           HB       THR  37   8.121  -5.077  -4.881
  225    HG1  THR  37           1HG      THR  37   6.763  -5.265  -2.548
  226   HG21  THR  37          3HG2      THR  37   9.075  -2.852  -4.590
  227   HG22  THR  37          1HG2      THR  37   9.826  -3.995  -3.476
  228   HG23  THR  37          2HG2      THR  37   8.611  -2.859  -2.888
  229    H    GLU  38           H        GLU  38   5.992  -1.351  -4.830
  230    HA   GLU  38           HA       GLU  38   5.924  -1.587  -7.699
  231    HB2  GLU  38           2HB      GLU  38   5.700   0.824  -5.890
  232    HB3  GLU  38           1HB      GLU  38   5.548   0.888  -7.640
  233    HG2  GLU  38           2HG      GLU  38   3.664  -0.791  -7.389
  234    HG3  GLU  38           1HG      GLU  38   3.727  -0.443  -5.662
  235    H    THR  39           H        THR  39   7.737  -1.758  -8.796
  236    HA   THR  39           HA       THR  39  10.015  -0.086  -7.986
  237    HB   THR  39           HB       THR  39  11.342  -1.862  -9.341
  238    HG1  THR  39           1HG      THR  39   9.613  -3.810  -8.521
  239   HG21  THR  39          3HG2      THR  39  11.635  -3.232  -7.340
  240   HG22  THR  39          1HG2      THR  39  10.144  -2.580  -6.663
  241   HG23  THR  39          2HG2      THR  39  11.533  -1.525  -6.911
  242    H    GLY  40           H        GLY  40  10.594   1.441  -9.386
  243    HA2  GLY  40           2HA      GLY  40  10.861   1.196 -12.121
  244    HA3  GLY  40           1HA      GLY  40   9.217   1.756 -11.857
  245    H    GLU  41           H        GLU  41   8.888   3.873 -11.642
  246    HA   GLU  41           HA       GLU  41  11.277   5.580 -11.449
  247    HB2  GLU  41           2HB      GLU  41   8.690   6.009 -12.949
  248    HB3  GLU  41           1HB      GLU  41   9.951   7.224 -12.785
  249    HG2  GLU  41           2HG      GLU  41  11.492   5.908 -14.030
  250    HG3  GLU  41           1HG      GLU  41  10.403   4.522 -14.018
  251    H    GLY  42           H        GLY  42  10.819   7.817 -10.647
  252    HA2  GLY  42           2HA      GLY  42   9.797   9.313  -9.184
  253    HA3  GLY  42           1HA      GLY  42   8.501   8.151  -8.941
  254    H    ALA  43           H        ALA  43   8.537   8.459  -6.702
  255    HA   ALA  43           HA       ALA  43  10.864   7.250  -5.354
  256    HB1  ALA  43           1HB      ALA  43  10.626   9.636  -4.830
  257    HB2  ALA  43           2HB      ALA  43  10.375   8.624  -3.407
  258    HB3  ALA  43           3HB      ALA  43   8.992   9.337  -4.238
  259    H    ALA  44           H        ALA  44   7.923   6.518  -6.358
  260    HA   ALA  44           HA       ALA  44   6.795   5.434  -3.924
  261    HB1  ALA  44           1HB      ALA  44   4.979   4.645  -5.361
  262    HB2  ALA  44           2HB      ALA  44   5.877   5.161  -6.789
  263    HB3  ALA  44           3HB      ALA  44   5.306   6.358  -5.626
  264    H    ALA  45           H        ALA  45   7.904   3.757  -3.125
  265    HA   ALA  45           HA       ALA  45   8.800   1.654  -4.970
  266    HB1  ALA  45           1HB      ALA  45  10.287   0.927  -3.189
  267    HB2  ALA  45           2HB      ALA  45   9.603   2.138  -2.104
  268    HB3  ALA  45           3HB      ALA  45  10.519   2.643  -3.524
  269    H    TYR  46           H        TYR  46   6.393   2.376  -2.719
  270    HA   TYR  46           HA       TYR  46   5.507  -0.407  -2.739
  271    HB2  TYR  46           2HB      TYR  46   5.780   1.270  -0.232
  272    HB3  TYR  46           1HB      TYR  46   4.858  -0.226  -0.315
  273    HD1  TYR  46           1HD      TYR  46   6.061  -2.376  -0.771
  274    HD2  TYR  46           2HD      TYR  46   8.140   1.249   0.037
  275    HE1  TYR  46           1HE      TYR  46   8.086  -3.664  -0.245
  276    HE2  TYR  46           2HE      TYR  46  10.176  -0.031   0.563
  277    HH   TYR  46           HH       TYR  46  10.759  -2.329   1.323
  278    H    GLY  47           H        GLY  47   3.375  -0.590  -3.101
  279    HA2  GLY  47           2HA      GLY  47   1.759   1.876  -2.894
  280    HA3  GLY  47           1HA      GLY  47   1.510   0.645  -4.125
  281    H    VAL  48           H        VAL  48   0.446   1.808  -1.218
  282    HA   VAL  48           HA       VAL  48  -0.532  -0.772  -0.232
  283    HB   VAL  48           HB       VAL  48  -0.897   1.970   0.991
  284   HG11  VAL  48          1HG1      VAL  48  -1.376   0.722   3.050
  285   HG12  VAL  48          2HG1      VAL  48  -1.220  -0.793   2.161
  286   HG13  VAL  48          3HG1      VAL  48  -2.524   0.330   1.768
  287   HG21  VAL  48          3HG2      VAL  48   1.472   1.451   0.834
  288   HG22  VAL  48          1HG2      VAL  48   1.193  -0.115   1.593
  289   HG23  VAL  48          2HG2      VAL  48   0.929   1.367   2.511
  290    H    LEU  49           H        LEU  49  -2.480  -1.470  -0.930
  291    HA   LEU  49           HA       LEU  49  -4.304   0.544  -2.021
  292    HB2  LEU  49           2HB      LEU  49  -5.467  -1.337  -3.104
  293    HB3  LEU  49           1HB      LEU  49  -3.789  -1.199  -3.580
  294    HG   LEU  49           HG       LEU  49  -3.768  -3.020  -1.464
  295   HD11  LEU  49          1HD1      LEU  49  -6.058  -3.586  -3.346
  296   HD12  LEU  49          2HD1      LEU  49  -6.194  -3.227  -1.625
  297   HD13  LEU  49          3HD1      LEU  49  -5.400  -4.710  -2.156
  298   HD21  LEU  49          3HD2      LEU  49  -3.208  -4.634  -3.242
  299   HD22  LEU  49          1HD2      LEU  49  -2.343  -3.107  -3.423
  300   HD23  LEU  49          2HD2      LEU  49  -3.734  -3.459  -4.449
  301    H    VAL  50           H        VAL  50  -5.638   1.337  -0.602
  302    HA   VAL  50           HA       VAL  50  -6.816  -0.472   1.404
  303    HB   VAL  50           HB       VAL  50  -7.375   1.692   2.651
  304   HG11  VAL  50          1HG1      VAL  50  -5.635   0.151   3.381
  305   HG12  VAL  50          2HG1      VAL  50  -5.124   1.821   3.639
  306   HG13  VAL  50          3HG1      VAL  50  -4.487   0.904   2.274
  307   HG21  VAL  50          3HG2      VAL  50  -5.265   2.785   0.789
  308   HG22  VAL  50          1HG2      VAL  50  -5.958   3.621   2.177
  309   HG23  VAL  50          2HG2      VAL  50  -6.969   3.239   0.782
  310    H    THR  51           H        THR  51  -8.717  -1.160   0.730
  311    HA   THR  51           HA       THR  51 -10.404   0.616  -0.861
  312    HB   THR  51           HB       THR  51 -10.854  -2.302  -0.214
  313    HG1  THR  51           1HG      THR  51  -8.928  -2.080  -1.384
  314   HG21  THR  51          3HG2      THR  51 -12.306  -2.239  -2.203
  315   HG22  THR  51          1HG2      THR  51 -12.006  -0.509  -2.362
  316   HG23  THR  51          2HG2      THR  51 -12.868  -1.128  -0.953
  317    H    ARG  52           H        ARG  52 -11.762   1.865   0.211
  318    HA   ARG  52           HA       ARG  52 -12.692   1.301   2.860
  319    HB2  ARG  52           2HB      ARG  52 -13.478   3.352   0.792
  320    HB3  ARG  52           1HB      ARG  52 -14.361   3.185   2.297
  321    HG2  ARG  52           2HG      ARG  52 -12.839   4.973   2.552
  322    HG3  ARG  52           1HG      ARG  52 -12.227   3.629   3.510
  323    HD2  ARG  52           2HD      ARG  52 -10.489   3.204   2.013
  324    HD3  ARG  52           1HD      ARG  52 -11.273   4.095   0.708
  325    HE   ARG  52           HE       ARG  52 -10.749   6.146   1.895
  326   HH11  ARG  52          1HH1      ARG  52  -9.060   3.270   2.960
  327   HH12  ARG  52          2HH1      ARG  52  -7.749   4.152   3.673
  328   HH21  ARG  52          1HH2      ARG  52  -8.996   7.305   2.800
  329   HH22  ARG  52          2HH2      ARG  52  -7.711   6.429   3.593
  330    HA   PRO  53           HA       PRO  53 -16.110  -1.350   1.868
  331    HB2  PRO  53           2HB      PRO  53 -17.832  -0.680   3.886
  332    HB3  PRO  53           1HB      PRO  53 -16.425  -1.726   4.105
  333    HG2  PRO  53           2HG      PRO  53 -16.727   1.192   4.700
  334    HG3  PRO  53           1HG      PRO  53 -15.944  -0.073   5.666
  335    HD2  PRO  53           2HD      PRO  53 -14.523   1.648   4.162
  336    HD3  PRO  53           1HD      PRO  53 -14.020  -0.041   4.381
  337    H    ASP  54           H        ASP  54 -16.193   1.974   1.651
  338    HA   ASP  54           HA       ASP  54 -18.948   2.249   0.847
  339    HB2  ASP  54           2HB      ASP  54 -16.609   4.163   0.685
  340    HB3  ASP  54           1HB      ASP  54 -18.261   4.573   0.236
  341    H    GLY  55           H        GLY  55 -16.366   0.822  -0.567
  342    HA2  GLY  55           2HA      GLY  55 -16.358  -0.099  -2.717
  343    HA3  GLY  55           1HA      GLY  55 -17.623   1.029  -3.181
  344    H    THR  56           H        THR  56 -14.586   1.950  -1.658
  345    HA   THR  56           HA       THR  56 -13.681   3.046  -4.214
  346    HB   THR  56           HB       THR  56 -14.848   4.882  -3.123
  347    HG1  THR  56           1HG      THR  56 -13.302   5.992  -4.011
  348   HG21  THR  56          3HG2      THR  56 -14.699   4.193  -0.803
  349   HG22  THR  56          1HG2      THR  56 -14.049   5.823  -0.993
  350   HG23  THR  56          2HG2      THR  56 -12.956   4.451  -0.814
  351    H    ARG  57           H        ARG  57 -11.634   2.614  -4.599
  352    HA   ARG  57           HA       ARG  57  -9.955   1.647  -2.384
  353    HB2  ARG  57           2HB      ARG  57 -10.176  -0.010  -4.086
  354    HB3  ARG  57           1HB      ARG  57  -9.865   1.159  -5.361
  355    HG2  ARG  57           2HG      ARG  57  -7.557   1.396  -4.562
  356    HG3  ARG  57           1HG      ARG  57  -7.881   0.193  -3.313
  357    HD2  ARG  57           2HD      ARG  57  -8.091  -1.538  -4.873
  358    HD3  ARG  57           1HD      ARG  57  -8.305  -0.419  -6.221
  359    HE   ARG  57           HE       ARG  57  -5.807   0.139  -5.218
  360   HH11  ARG  57          1HH1      ARG  57  -7.361  -2.772  -6.430
  361   HH12  ARG  57          2HH1      ARG  57  -5.901  -3.395  -7.143
  362   HH21  ARG  57          1HH2      ARG  57  -3.912  -0.661  -6.136
  363   HH22  ARG  57          2HH2      ARG  57  -3.923  -2.203  -6.964
  364    H    VAL  58           H        VAL  58  -8.285   2.818  -1.719
  365    HA   VAL  58           HA       VAL  58  -7.366   5.035  -3.430
  366    HB   VAL  58           HB       VAL  58  -7.207   4.832  -0.414
  367   HG11  VAL  58          1HG1      VAL  58  -6.545   7.194  -0.505
  368   HG12  VAL  58          2HG1      VAL  58  -6.549   7.121  -2.268
  369   HG13  VAL  58          3HG1      VAL  58  -5.395   6.157  -1.348
  370   HG21  VAL  58          3HG2      VAL  58  -8.920   6.573  -0.375
  371   HG22  VAL  58          1HG2      VAL  58  -9.508   5.108  -1.160
  372   HG23  VAL  58          2HG2      VAL  58  -9.038   6.502  -2.134
  373    H    GLU  59           H        GLU  59  -5.267   5.095  -4.007
  374    HA   GLU  59           HA       GLU  59  -3.540   2.913  -3.134
  375    HB2  GLU  59           2HB      GLU  59  -3.069   5.008  -5.263
  376    HB3  GLU  59           1HB      GLU  59  -2.101   3.570  -4.988
  377    HG2  GLU  59           2HG      GLU  59  -4.985   3.578  -5.850
  378    HG3  GLU  59           1HG      GLU  59  -3.600   3.368  -6.919
  379    H    VAL  60           H        VAL  60  -2.492   3.333  -1.296
  380    HA   VAL  60           HA       VAL  60  -1.461   6.008  -0.752
  381    HB   VAL  60           HB       VAL  60  -1.055   3.517   0.906
  382   HG11  VAL  60          1HG1      VAL  60  -0.871   6.448   1.580
  383   HG12  VAL  60          2HG1      VAL  60   0.477   5.323   1.422
  384   HG13  VAL  60          3HG1      VAL  60  -0.688   5.124   2.731
  385   HG21  VAL  60          3HG2      VAL  60  -3.255   5.572   1.129
  386   HG22  VAL  60          1HG2      VAL  60  -2.950   4.269   2.277
  387   HG23  VAL  60          2HG2      VAL  60  -3.452   3.893   0.628
  388    H    HIS  61           H        HIS  61   0.353   6.529  -1.790
  389    HA   HIS  61           HA       HIS  61   2.220   4.425  -2.529
  390    HB2  HIS  61           2HB      HIS  61   1.990   7.322  -3.276
  391    HB3  HIS  61           1HB      HIS  61   3.376   6.343  -3.740
  392    HD1  HIS  61           1HD      HIS  61  -0.024   7.205  -4.775
  393    HD2  HIS  61           2HD      HIS  61   2.647   4.079  -5.420
  394    HE1  HIS  61           1HE      HIS  61  -0.899   5.964  -6.773
  395    HE2  HIS  61           2HE      HIS  61   0.598   3.946  -6.995
  396    H    LEU  62           H        LEU  62   4.041   4.017  -1.539
  397    HA   LEU  62           HA       LEU  62   4.935   5.884   0.554
  398    HB2  LEU  62           2HB      LEU  62   4.548   2.965   0.487
  399    HB3  LEU  62           1HB      LEU  62   6.021   3.504   1.267
  400    HG   LEU  62           HG       LEU  62   4.903   4.455   3.041
  401   HD11  LEU  62          1HD1      LEU  62   2.579   5.200   3.013
  402   HD12  LEU  62          2HD1      LEU  62   2.425   4.673   1.336
  403   HD13  LEU  62          3HD1      LEU  62   3.518   5.994   1.750
  404   HD21  LEU  62          3HD2      LEU  62   4.469   2.069   3.028
  405   HD22  LEU  62          1HD2      LEU  62   3.008   2.331   2.074
  406   HD23  LEU  62          2HD2      LEU  62   3.107   2.950   3.724
  407    H    ASP  63           H        ASP  63   7.189   5.864   1.040
  408    HA   ASP  63           HA       ASP  63   8.810   5.787  -1.373
  409    HB2  ASP  63           2HB      ASP  63   8.942   7.818  -0.106
  410    HB3  ASP  63           1HB      ASP  63   9.193   6.945   1.397
  411    H    ARG  64           H        ARG  64  11.189   5.132  -0.919
  412    HA   ARG  64           HA       ARG  64  11.340   2.370  -0.540
  413    HB2  ARG  64           2HB      ARG  64  13.537   4.439  -0.344
  414    HB3  ARG  64           1HB      ARG  64  13.782   2.713  -0.577
  415    HG2  ARG  64           2HG      ARG  64  13.289   2.808  -2.767
  416    HG3  ARG  64           1HG      ARG  64  12.008   4.000  -2.536
  417    HD2  ARG  64           2HD      ARG  64  14.969   4.569  -2.481
  418    HD3  ARG  64           1HD      ARG  64  13.886   4.907  -3.831
  419    HE   ARG  64           HE       ARG  64  12.706   6.226  -1.789
  420   HH11  ARG  64          1HH1      ARG  64  15.969   6.261  -3.088
  421   HH12  ARG  64          2HH1      ARG  64  16.294   7.871  -2.518
  422   HH21  ARG  64          1HH2      ARG  64  13.127   8.313  -1.070
  423   HH22  ARG  64          2HH2      ARG  64  14.676   9.044  -1.382
  424    H    ASP  65           H        ASP  65  11.677   5.002   1.733
  425    HA   ASP  65           HA       ASP  65  12.667   3.258   3.850
  426    HB2  ASP  65           2HB      ASP  65  13.479   5.607   3.584
  427    HB3  ASP  65           1HB      ASP  65  11.861   6.176   3.967
  428    H    PHE  66           H        PHE  66   9.828   3.513   2.462
  429    HA   PHE  66           HA       PHE  66   7.693   3.003   2.985
  430    HB2  PHE  66           2HB      PHE  66   9.144   1.899   5.182
  431    HB3  PHE  66           1HB      PHE  66   7.677   2.644   5.807
  432    HD1  PHE  66           1HD      PHE  66   9.022   0.064   3.573
  433    HD2  PHE  66           2HD      PHE  66   5.521   1.750   5.306
  434    HE1  PHE  66           1HE      PHE  66   7.725  -1.896   2.849
  435    HE2  PHE  66           2HE      PHE  66   4.216  -0.207   4.585
  436    HZ   PHE  66           HZ       PHE  66   5.319  -2.033   3.356
  437    H    ARG  67           H        ARG  67   9.004   5.683   3.370
  438    HA   ARG  67           HA       ARG  67   7.341   7.026   5.290
  439    HB2  ARG  67           2HB      ARG  67   9.638   7.666   3.718
  440    HB3  ARG  67           1HB      ARG  67   8.392   8.858   3.375
  441    HG2  ARG  67           2HG      ARG  67   9.757   9.661   5.162
  442    HG3  ARG  67           1HG      ARG  67   8.165   9.256   5.808
  443    HD2  ARG  67           2HD      ARG  67   9.128   7.034   6.488
  444    HD3  ARG  67           1HD      ARG  67  10.713   7.668   6.048
  445    HE   ARG  67           HE       ARG  67   9.405   9.440   7.824
  446   HH11  ARG  67          1HH1      ARG  67  11.177   6.407   7.754
  447   HH12  ARG  67          2HH1      ARG  67  11.576   6.477   9.443
  448   HH21  ARG  67          1HH2      ARG  67   9.943   9.550   9.987
  449   HH22  ARG  67          2HH2      ARG  67  10.876   8.284  10.729
  450    H    VAL  68           H        VAL  68   5.400   7.985   4.942
  451    HA   VAL  68           HA       VAL  68   3.899   7.245   2.671
  452    HB   VAL  68           HB       VAL  68   2.815   7.590   4.817
  453   HG11  VAL  68          1HG1      VAL  68   4.190   9.391   5.692
  454   HG12  VAL  68          2HG1      VAL  68   2.483   9.824   5.756
  455   HG13  VAL  68          3HG1      VAL  68   3.517  10.505   4.501
  456   HG21  VAL  68          3HG2      VAL  68   0.914   8.977   4.095
  457   HG22  VAL  68          1HG2      VAL  68   1.432   7.840   2.852
  458   HG23  VAL  68          2HG2      VAL  68   1.869   9.545   2.725
  459    H    LEU  69           H        LEU  69   3.560   8.226   0.774
  460    HA   LEU  69           HA       LEU  69   4.822  10.838   0.359
  461    HB2  LEU  69           2HB      LEU  69   3.857   8.803  -1.652
  462    HB3  LEU  69           1HB      LEU  69   4.645  10.319  -2.045
  463    HG   LEU  69           HG       LEU  69   5.909   8.036  -0.523
  464   HD11  LEU  69          1HD1      LEU  69   7.255   7.730  -2.538
  465   HD12  LEU  69          2HD1      LEU  69   6.331   8.992  -3.352
  466   HD13  LEU  69          3HD1      LEU  69   5.540   7.492  -2.866
  467   HD21  LEU  69          3HD2      LEU  69   7.976   9.295  -0.747
  468   HD22  LEU  69          1HD2      LEU  69   6.773  10.233   0.137
  469   HD23  LEU  69          2HD2      LEU  69   7.113  10.604  -1.553
  470    H    ASP  70           H        ASP  70   1.897   9.137  -0.835
  471    HA   ASP  70           HA       ASP  70   0.174  11.307  -0.161
  472    HB2  ASP  70           2HB      ASP  70   1.567  12.024  -2.286
  473    HB3  ASP  70           1HB      ASP  70   0.444  10.965  -3.130
  474    H    THR  71           H        THR  71  -2.015  10.950  -1.497
  475    HA   THR  71           HA       THR  71  -2.464   8.078  -1.859
  476    HB   THR  71           HB       THR  71  -4.544   8.198  -0.489
  477    HG1  THR  71           1HG      THR  71  -3.630  10.818  -0.131
  478   HG21  THR  71          3HG2      THR  71  -1.998   8.800   1.016
  479   HG22  THR  71          1HG2      THR  71  -2.517   7.211   0.448
  480   HG23  THR  71          2HG2      THR  71  -3.443   8.049   1.692
  481    H    GLU  72           H        GLU  72  -3.281   7.944  -3.854
  482    HA   GLU  72           HA       GLU  72  -5.553   9.705  -4.486
  483    HB2  GLU  72           2HB      GLU  72  -4.941   9.468  -6.902
  484    HB3  GLU  72           1HB      GLU  72  -3.792  10.396  -5.953
  485    HG2  GLU  72           2HG      GLU  72  -3.287   7.493  -6.328
  486    HG3  GLU  72           1HG      GLU  72  -3.018   8.576  -7.691
  487    HA   PRO  73           HA       PRO  73  -7.811   5.919  -4.819
  488    HB2  PRO  73           2HB      PRO  73  -9.912   6.798  -6.311
  489    HB3  PRO  73           1HB      PRO  73  -9.729   7.144  -4.589
  490    HG2  PRO  73           2HG      PRO  73  -9.124   8.875  -6.945
  491    HG3  PRO  73           1HG      PRO  73  -9.860   9.310  -5.393
  492    HD2  PRO  73           2HD      PRO  73  -7.255   9.801  -5.992
  493    HD3  PRO  73           1HD      PRO  73  -7.827   9.496  -4.340
  494    H    ALA  74           H        ALA  74  -8.305   4.269  -6.297
  495    HA   ALA  74           HA       ALA  74  -6.855   4.552  -8.824
  496    HB1  ALA  74           1HB      ALA  74  -6.198   2.736  -7.298
  497    HB2  ALA  74           2HB      ALA  74  -6.736   2.142  -8.869
  498    HB3  ALA  74           3HB      ALA  74  -7.807   2.034  -7.471
  499    H    ASP  75           H        ASP  75  -8.070   5.138 -10.498
  500    HA   ASP  75           HA       ASP  75 -10.438   3.522 -11.091
  501    HB2  ASP  75           2HB      ASP  75 -11.244   5.669 -10.126
  502    HB3  ASP  75           1HB      ASP  75 -10.364   6.540 -11.378
  503    H    GLY  76           H        GLY  76  -9.973   2.535 -12.948
  504    HA2  GLY  76           2HA      GLY  76  -8.052   3.868 -14.753
  505    HA3  GLY  76           1HA      GLY  76  -8.214   2.131 -14.569
  506    H    ASP  77           H        ASP  77 -10.506   4.790 -15.283
  507    HA   ASP  77           HA       ASP  77 -11.424   3.250 -17.607
  508    HB2  ASP  77           2HB      ASP  77 -13.218   4.154 -16.235
  509    HB3  ASP  77           1HB      ASP  77 -12.522   5.771 -16.336
  510    H    GLY  78           H        GLY  78 -10.274   6.462 -16.711
  511    HA2  GLY  78           2HA      GLY  78  -9.026   6.684 -19.375
  512    HA3  GLY  78           1HA      GLY  78  -9.905   8.039 -18.672
  513    H    GLY  79           H        GLY  79  -7.485   5.684 -17.550
  514    HA2  GLY  79           2HA      GLY  79  -6.293   7.677 -15.821
  515    HA3  GLY  79           1HA      GLY  79  -5.796   5.998 -15.990
  516    H    LEU  80           H        LEU  80  -5.794   9.084 -17.706
  517    HA   LEU  80           HA       LEU  80  -3.164   8.371 -18.830
  518    HB2  LEU  80           2HB      LEU  80  -5.288  10.180 -20.000
  519    HB3  LEU  80           1HB      LEU  80  -3.693   9.929 -20.682
  520    HG   LEU  80           HG       LEU  80  -5.810   7.798 -20.382
  521   HD11  LEU  80          1HD1      LEU  80  -4.843   9.289 -22.815
  522   HD12  LEU  80          2HD1      LEU  80  -6.420   9.464 -22.044
  523   HD13  LEU  80          3HD1      LEU  80  -5.980   7.940 -22.817
  524   HD21  LEU  80          3HD2      LEU  80  -3.111   7.744 -21.727
  525   HD22  LEU  80          1HD2      LEU  80  -4.314   6.457 -21.787
  526   HD23  LEU  80          2HD2      LEU  80  -3.559   6.886 -20.252
  527    H    GLU  81           H        GLU  81  -1.549   9.905 -18.695
  528    HA   GLU  81           HA       GLU  81  -2.205  12.418 -17.324
  529    HB2  GLU  81           2HB      GLU  81  -1.159  10.402 -15.914
  530    HB3  GLU  81           1HB      GLU  81   0.333  11.006 -16.616
  531    HG2  GLU  81           2HG      GLU  81  -1.585  12.752 -15.101
  532    HG3  GLU  81           1HG      GLU  81  -0.275  11.868 -14.326
  Start of MODEL    4
    1    H1   GLY   1           1HT      GLY   1   5.322   5.125  15.399
    2    H2   GLY   1           2HT      GLY   1   5.916   6.668  15.022
    3    H3   GLY   1           3HT      GLY   1   6.920   5.537  15.794
    4    HA2  GLY   1           1HA      GLY   1   5.842   5.332  13.039
    5    HA3  GLY   1           2HA      GLY   1   7.507   5.691  13.474
    6    H    ALA   2           H        ALA   2   5.211   3.269  12.861
    7    HA   ALA   2           HA       ALA   2   7.021   1.193  13.913
    8    HB1  ALA   2           1HB      ALA   2   4.079   0.982  13.269
    9    HB2  ALA   2           2HB      ALA   2   4.776   1.115  14.883
   10    HB3  ALA   2           3HB      ALA   2   5.094  -0.314  13.899
   11    H    MET   3           H        MET   3   8.286   0.374  12.402
   12    HA   MET   3           HA       MET   3   7.520   0.470   9.611
   13    HB2  MET   3           2HB      MET   3  10.027  -0.393  11.040
   14    HB3  MET   3           1HB      MET   3   9.801  -0.663   9.319
   15    HG2  MET   3           2HG      MET   3  11.062   1.311   9.537
   16    HG3  MET   3           1HG      MET   3   9.435   1.800   9.077
   17    HE1  MET   3           3HE      MET   3  12.120   1.679  11.928
   18    HE2  MET   3           1HE      MET   3  10.837   0.660  12.577
   19    HE3  MET   3           2HE      MET   3  11.190   2.216  13.328
   20    H    ALA   4           H        ALA   4   6.169  -1.011   8.899
   21    HA   ALA   4           HA       ALA   4   5.980  -3.594  10.165
   22    HB1  ALA   4           1HB      ALA   4   3.956  -2.371   9.486
   23    HB2  ALA   4           2HB      ALA   4   4.062  -3.954   8.715
   24    HB3  ALA   4           3HB      ALA   4   4.459  -2.500   7.800
   25    H    PHE   5           H        PHE   5   7.948  -4.562   9.667
   26    HA   PHE   5           HA       PHE   5   8.156  -5.443   6.862
   27    HB2  PHE   5           2HB      PHE   5  10.331  -5.000   8.911
   28    HB3  PHE   5           1HB      PHE   5  10.590  -5.924   7.434
   29    HD1  PHE   5           2HD      PHE   5  10.319  -4.792   5.225
   30    HD2  PHE   5           1HD      PHE   5  10.356  -2.648   8.902
   31    HE1  PHE   5           2HE      PHE   5  10.794  -2.712   4.002
   32    HE2  PHE   5           1HE      PHE   5  10.829  -0.563   7.685
   33    HZ   PHE   5           HZ       PHE   5  11.050  -0.594   5.232
   34    H    ASP   6           H        ASP   6   6.386  -6.811   8.056
   35    HA   ASP   6           HA       ASP   6   7.620  -9.397   8.573
   36    HB2  ASP   6           2HB      ASP   6   7.288  -8.458  10.823
   37    HB3  ASP   6           1HB      ASP   6   5.598  -8.137  10.451
   38    H    GLY   7           H        GLY   7   6.301 -11.120   7.938
   39    HA2  GLY   7           2HA      GLY   7   3.538 -10.877   7.403
   40    HA3  GLY   7           1HA      GLY   7   4.442 -10.646   5.912
   41    H    GLU   8           H        GLU   8   2.685 -12.767   6.169
   42    HA   GLU   8           HA       GLU   8   4.230 -15.106   6.891
   43    HB2  GLU   8           2HB      GLU   8   2.235 -16.378   6.187
   44    HB3  GLU   8           1HB      GLU   8   1.880 -15.158   7.397
   45    HG2  GLU   8           2HG      GLU   8   0.973 -13.700   5.675
   46    HG3  GLU   8           1HG      GLU   8   1.352 -14.909   4.446
   47    H    ASP   9           H        ASP   9   4.368 -16.949   5.320
   48    HA   ASP   9           HA       ASP   9   5.628 -15.821   2.931
   49    HB2  ASP   9           2HB      ASP   9   7.010 -17.212   4.391
   50    HB3  ASP   9           1HB      ASP   9   5.881 -18.551   4.221
   51    H    GLU  10           H        GLU  10   2.746 -17.339   3.742
   52    HA   GLU  10           HA       GLU  10   2.580 -18.963   1.351
   53    HB2  GLU  10           2HB      GLU  10   0.527 -18.438   3.498
   54    HB3  GLU  10           1HB      GLU  10   0.345 -19.588   2.179
   55    HG2  GLU  10           2HG      GLU  10   2.511 -20.635   3.060
   56    HG3  GLU  10           1HG      GLU  10   2.206 -19.694   4.519
   57    H    VAL  11           H        VAL  11   2.313 -15.767   1.761
   58    HA   VAL  11           HA       VAL  11   0.089 -15.405  -0.080
   59    HB   VAL  11           HB       VAL  11   0.615 -12.994   0.059
   60   HG11  VAL  11          1HG1      VAL  11   0.367 -14.350   2.741
   61   HG12  VAL  11          2HG1      VAL  11  -0.956 -13.993   1.630
   62   HG13  VAL  11          3HG1      VAL  11  -0.058 -12.676   2.384
   63   HG21  VAL  11          3HG2      VAL  11   3.033 -13.169   0.408
   64   HG22  VAL  11          1HG2      VAL  11   2.753 -13.831   2.019
   65   HG23  VAL  11          2HG2      VAL  11   2.270 -12.176   1.650
   66    H    THR  12           H        THR  12   0.451 -14.201  -2.125
   67    HA   THR  12           HA       THR  12   2.805 -15.339  -3.425
   68    HB   THR  12           HB       THR  12   0.418 -13.977  -4.699
   69    HG1  THR  12           1HG      THR  12   0.900 -16.637  -3.868
   70   HG21  THR  12          3HG2      THR  12   2.425 -14.079  -6.126
   71   HG22  THR  12          1HG2      THR  12   1.138 -15.121  -6.732
   72   HG23  THR  12          2HG2      THR  12   2.508 -15.822  -5.871
   73    H    GLY  13           H        GLY  13   1.268 -12.239  -2.768
   74    HA2  GLY  13           2HA      GLY  13   3.338 -10.753  -4.146
   75    HA3  GLY  13           1HA      GLY  13   2.037 -10.078  -3.170
   76    HA   PRO  14           HA       PRO  14   6.012 -11.377  -0.584
   77    HB2  PRO  14           2HB      PRO  14   8.137  -9.957  -1.594
   78    HB3  PRO  14           1HB      PRO  14   7.803 -11.647  -1.980
   79    HG2  PRO  14           2HG      PRO  14   7.188  -9.184  -3.553
   80    HG3  PRO  14           1HG      PRO  14   7.758 -10.764  -4.120
   81    HD2  PRO  14           2HD      PRO  14   5.180  -9.996  -4.337
   82    HD3  PRO  14           1HD      PRO  14   5.645 -11.687  -4.065
   83    H    ASP  15           H        ASP  15   6.547  -8.204  -2.105
   84    HA   ASP  15           HA       ASP  15   6.730  -6.864   0.403
   85    HB2  ASP  15           2HB      ASP  15   6.737  -4.795  -1.028
   86    HB3  ASP  15           1HB      ASP  15   7.969  -5.981  -1.449
   87    H    ALA  16           H        ALA  16   4.168  -7.751  -1.642
   88    HA   ALA  16           HA       ALA  16   2.290  -5.752  -1.282
   89    HB1  ALA  16           1HB      ALA  16   0.621  -7.423  -1.859
   90    HB2  ALA  16           2HB      ALA  16   1.787  -8.712  -1.552
   91    HB3  ALA  16           3HB      ALA  16   2.048  -7.582  -2.882
   92    H    ASP  17           H        ASP  17   2.910  -8.595   0.768
   93    HA   ASP  17           HA       ASP  17   0.609  -8.265   2.356
   94    HB2  ASP  17           2HB      ASP  17   1.771 -10.399   2.244
   95    HB3  ASP  17           1HB      ASP  17   3.173  -9.695   3.050
   96    H    ARG  18           H        ARG  18   4.005  -7.442   3.147
   97    HA   ARG  18           HA       ARG  18   3.347  -6.336   5.656
   98    HB2  ARG  18           2HB      ARG  18   5.607  -5.172   5.483
   99    HB3  ARG  18           1HB      ARG  18   5.608  -6.922   5.448
  100    HG2  ARG  18           2HG      ARG  18   5.607  -5.418   2.879
  101    HG3  ARG  18           1HG      ARG  18   7.098  -5.546   3.814
  102    HD2  ARG  18           2HD      ARG  18   5.407  -7.886   2.931
  103    HD3  ARG  18           1HD      ARG  18   6.846  -7.314   2.087
  104    HE   ARG  18           HE       ARG  18   7.843  -7.776   4.517
  105   HH11  ARG  18          1HH1      ARG  18   5.735  -9.711   2.506
  106   HH12  ARG  18          2HH1      ARG  18   6.283 -11.228   3.150
  107   HH21  ARG  18          1HH2      ARG  18   8.625  -9.778   5.334
  108   HH22  ARG  18          2HH2      ARG  18   7.936 -11.267   4.753
  109    H    ALA  19           H        ALA  19   3.473  -4.931   2.439
  110    HA   ALA  19           HA       ALA  19   3.151  -2.233   3.275
  111    HB1  ALA  19           1HB      ALA  19   2.357  -3.532   0.668
  112    HB2  ALA  19           2HB      ALA  19   3.931  -2.822   1.030
  113    HB3  ALA  19           3HB      ALA  19   2.496  -1.798   0.961
  114    H    ARG  20           H        ARG  20   0.910  -4.761   2.271
  115    HA   ARG  20           HA       ARG  20  -1.493  -3.354   2.502
  116    HB2  ARG  20           2HB      ARG  20  -1.357  -5.490   1.389
  117    HB3  ARG  20           1HB      ARG  20  -0.848  -6.284   2.872
  118    HG2  ARG  20           2HG      ARG  20  -3.047  -5.807   3.856
  119    HG3  ARG  20           1HG      ARG  20  -3.547  -5.067   2.332
  120    HD2  ARG  20           2HD      ARG  20  -4.354  -7.350   2.455
  121    HD3  ARG  20           1HD      ARG  20  -3.144  -7.198   1.182
  122    HE   ARG  20           HE       ARG  20  -1.694  -8.024   3.324
  123   HH11  ARG  20          1HH1      ARG  20  -4.529  -9.228   1.682
  124   HH12  ARG  20          2HH1      ARG  20  -4.267 -10.886   2.148
  125   HH21  ARG  20          1HH2      ARG  20  -1.292 -10.218   3.908
  126   HH22  ARG  20          2HH2      ARG  20  -2.439 -11.443   3.425
  127    H    ALA  21           H        ALA  21   0.274  -5.299   4.878
  128    HA   ALA  21           HA       ALA  21  -1.632  -5.165   6.939
  129    HB1  ALA  21           1HB      ALA  21   0.236  -6.780   6.852
  130    HB2  ALA  21           2HB      ALA  21   0.110  -5.949   8.403
  131    HB3  ALA  21           3HB      ALA  21   1.349  -5.468   7.242
  132    H    ALA  22           H        ALA  22   1.071  -3.039   6.119
  133    HA   ALA  22           HA       ALA  22   1.011  -1.468   8.456
  134    HB1  ALA  22           1HB      ALA  22   2.289   0.169   7.186
  135    HB2  ALA  22           2HB      ALA  22   1.875  -0.655   5.684
  136    HB3  ALA  22           3HB      ALA  22   2.888  -1.461   6.881
  137    H    ALA  23           H        ALA  23  -0.790  -1.272   5.444
  138    HA   ALA  23           HA       ALA  23  -1.851   1.337   5.991
  139    HB1  ALA  23           1HB      ALA  23  -3.101   1.052   3.945
  140    HB2  ALA  23           2HB      ALA  23  -2.688  -0.661   3.903
  141    HB3  ALA  23           3HB      ALA  23  -1.426   0.555   3.708
  142    H    VAL  24           H        VAL  24  -2.745  -1.836   6.906
  143    HA   VAL  24           HA       VAL  24  -5.530  -1.678   6.994
  144    HB   VAL  24           HB       VAL  24  -3.704  -3.129   8.920
  145   HG11  VAL  24          1HG1      VAL  24  -5.640  -4.544   9.405
  146   HG12  VAL  24          2HG1      VAL  24  -6.641  -3.541   8.355
  147   HG13  VAL  24          3HG1      VAL  24  -5.957  -2.860   9.831
  148   HG21  VAL  24          3HG2      VAL  24  -4.125  -5.084   7.520
  149   HG22  VAL  24          1HG2      VAL  24  -3.370  -3.793   6.588
  150   HG23  VAL  24          2HG2      VAL  24  -5.100  -4.103   6.425
  151    H    GLN  25           H        GLN  25  -3.125  -0.520   9.297
  152    HA   GLN  25           HA       GLN  25  -4.984   0.205  11.323
  153    HB2  GLN  25           2HB      GLN  25  -2.113   0.965  10.819
  154    HB3  GLN  25           1HB      GLN  25  -3.030   1.638  12.159
  155    HG2  GLN  25           2HG      GLN  25  -1.787  -0.171  13.023
  156    HG3  GLN  25           1HG      GLN  25  -3.460  -0.712  12.920
  157   HE21  GLN  25          1HE2      GLN  25  -1.253  -0.444  10.204
  158   HE22  GLN  25          2HE2      GLN  25  -1.161  -2.143   9.874
  159    H    ALA  26           H        ALA  26  -4.301   1.564   8.328
  160    HA   ALA  26           HA       ALA  26  -5.007   4.279   9.183
  161    HB1  ALA  26           1HB      ALA  26  -3.018   4.090   7.795
  162    HB2  ALA  26           2HB      ALA  26  -4.286   4.968   6.939
  163    HB3  ALA  26           3HB      ALA  26  -3.953   3.283   6.538
  164    H    VAL  27           H        VAL  27  -6.732   1.702   8.589
  165    HA   VAL  27           HA       VAL  27  -8.919   3.269   7.503
  166    HB   VAL  27           HB       VAL  27  -8.027   2.292   5.474
  167   HG11  VAL  27          1HG1      VAL  27  -8.333  -0.385   6.821
  168   HG12  VAL  27          2HG1      VAL  27  -6.815   0.409   6.396
  169   HG13  VAL  27          3HG1      VAL  27  -7.917  -0.129   5.127
  170   HG21  VAL  27          3HG2      VAL  27 -10.002   1.063   4.694
  171   HG22  VAL  27          1HG2      VAL  27 -10.436   2.497   5.626
  172   HG23  VAL  27          2HG2      VAL  27 -10.547   0.898   6.363
  173    HA   PRO  28           HA       PRO  28 -10.569   0.975  10.957
  174    HB2  PRO  28           2HB      PRO  28 -12.956   2.274  11.058
  175    HB3  PRO  28           1HB      PRO  28 -11.457   2.943  11.709
  176    HG2  PRO  28           2HG      PRO  28 -12.848   3.548   9.143
  177    HG3  PRO  28           1HG      PRO  28 -11.989   4.641  10.242
  178    HD2  PRO  28           2HD      PRO  28 -10.933   3.671   7.909
  179    HD3  PRO  28           1HD      PRO  28  -9.957   4.176   9.302
  180    H    GLY  29           H        GLY  29 -10.763  -1.027   9.916
  181    HA2  GLY  29           2HA      GLY  29 -11.961  -2.873   9.269
  182    HA3  GLY  29           1HA      GLY  29 -13.418  -1.956   9.622
  183    H    GLY  30           H        GLY  30 -10.857  -1.363   7.235
  184    HA2  GLY  30           2HA      GLY  30 -12.976  -1.325   5.187
  185    HA3  GLY  30           1HA      GLY  30 -11.514  -0.354   5.123
  186    H    THR  31           H        THR  31 -11.643  -1.404   2.914
  187    HA   THR  31           HA       THR  31 -10.704  -4.160   2.842
  188    HB   THR  31           HB       THR  31 -11.332  -2.281   0.557
  189    HG1  THR  31           1HG      THR  31 -13.005  -4.422   1.269
  190   HG21  THR  31          3HG2      THR  31 -10.951  -5.277   0.640
  191   HG22  THR  31          1HG2      THR  31  -9.868  -4.107  -0.114
  192   HG23  THR  31          2HG2      THR  31 -11.488  -4.358  -0.767
  193    H    ALA  32           H        ALA  32  -8.606  -4.505   3.044
  194    HA   ALA  32           HA       ALA  32  -6.715  -2.636   1.774
  195    HB1  ALA  32           1HB      ALA  32  -6.218  -4.575   4.034
  196    HB2  ALA  32           2HB      ALA  32  -6.416  -2.832   4.196
  197    HB3  ALA  32           3HB      ALA  32  -5.027  -3.484   3.326
  198    H    GLY  33           H        GLY  33  -5.752  -3.353  -0.017
  199    HA2  GLY  33           2HA      GLY  33  -5.906  -6.249  -0.556
  200    HA3  GLY  33           1HA      GLY  33  -6.017  -5.007  -1.793
  201    H    GLU  34           H        GLU  34  -4.255  -7.172  -1.917
  202    HA   GLU  34           HA       GLU  34  -1.637  -6.495  -1.090
  203    HB2  GLU  34           2HB      GLU  34  -2.569  -8.315  -3.319
  204    HB3  GLU  34           1HB      GLU  34  -0.907  -8.194  -2.764
  205    HG2  GLU  34           2HG      GLU  34  -1.704 -10.090  -1.698
  206    HG3  GLU  34           1HG      GLU  34  -1.831  -8.839  -0.463
  207    H    VAL  35           H        VAL  35  -0.013  -5.415  -2.124
  208    HA   VAL  35           HA       VAL  35  -0.687  -4.065  -4.642
  209    HB   VAL  35           HB       VAL  35   0.253  -1.952  -3.734
  210   HG11  VAL  35          1HG1      VAL  35  -2.111  -3.027  -2.197
  211   HG12  VAL  35          2HG1      VAL  35  -2.167  -2.324  -3.813
  212   HG13  VAL  35          3HG1      VAL  35  -1.711  -1.327  -2.433
  213   HG21  VAL  35          3HG2      VAL  35   0.453  -1.696  -1.292
  214   HG22  VAL  35          1HG2      VAL  35   1.612  -2.860  -1.935
  215   HG23  VAL  35          2HG2      VAL  35   0.167  -3.427  -1.099
  216    H    GLU  36           H        GLU  36   1.130  -3.265  -5.816
  217    HA   GLU  36           HA       GLU  36   3.622  -4.669  -5.162
  218    HB2  GLU  36           2HB      GLU  36   4.178  -4.574  -7.521
  219    HB3  GLU  36           1HB      GLU  36   2.604  -5.324  -7.303
  220    HG2  GLU  36           2HG      GLU  36   1.490  -3.325  -8.023
  221    HG3  GLU  36           1HG      GLU  36   3.019  -2.446  -8.081
  222    H    THR  37           H        THR  37   5.632  -3.546  -5.805
  223    HA   THR  37           HA       THR  37   5.677  -0.992  -4.561
  224    HB   THR  37           HB       THR  37   8.129  -1.045  -5.289
  225    HG1  THR  37           1HG      THR  37   8.838  -2.742  -6.388
  226   HG21  THR  37          3HG2      THR  37   7.027  -3.317  -3.644
  227   HG22  THR  37          1HG2      THR  37   7.413  -1.698  -3.064
  228   HG23  THR  37          2HG2      THR  37   8.701  -2.761  -3.631
  229    H    GLU  38           H        GLU  38   6.280   0.997  -5.412
  230    HA   GLU  38           HA       GLU  38   5.336   1.495  -8.088
  231    HB2  GLU  38           2HB      GLU  38   6.513   3.362  -6.017
  232    HB3  GLU  38           1HB      GLU  38   5.785   3.871  -7.534
  233    HG2  GLU  38           2HG      GLU  38   3.646   2.914  -6.814
  234    HG3  GLU  38           1HG      GLU  38   4.383   2.449  -5.282
  235    H    THR  39           H        THR  39   6.748   0.675  -9.552
  236    HA   THR  39           HA       THR  39   9.587   1.243  -9.329
  237    HB   THR  39           HB       THR  39   8.108  -0.227 -11.518
  238    HG1  THR  39           1HG      THR  39   7.855  -1.671  -9.978
  239   HG21  THR  39          3HG2      THR  39  11.020  -0.218 -10.720
  240   HG22  THR  39          1HG2      THR  39  10.340   0.515 -12.172
  241   HG23  THR  39          2HG2      THR  39  10.302  -1.237 -11.968
  242    H    GLY  40           H        GLY  40  10.386   3.089 -10.098
  243    HA2  GLY  40           2HA      GLY  40  10.415   4.053 -12.592
  244    HA3  GLY  40           1HA      GLY  40   8.866   4.651 -12.016
  245    H    GLU  41           H        GLU  41   9.234   6.787 -11.843
  246    HA   GLU  41           HA       GLU  41  11.681   7.713 -10.535
  247    HB2  GLU  41           2HB      GLU  41   9.556   9.165 -12.117
  248    HB3  GLU  41           1HB      GLU  41  10.845   9.995 -11.260
  249    HG2  GLU  41           2HG      GLU  41  11.453   9.825 -13.554
  250    HG3  GLU  41           1HG      GLU  41  12.490   8.742 -12.630
  251    H    GLY  42           H        GLY  42  11.231   9.856  -9.234
  252    HA2  GLY  42           2HA      GLY  42   9.794  11.001  -7.710
  253    HA3  GLY  42           1HA      GLY  42   8.833   9.534  -7.564
  254    H    ALA  43           H        ALA  43   9.133  10.175  -5.231
  255    HA   ALA  43           HA       ALA  43  11.630   8.982  -4.207
  256    HB1  ALA  43           1HB      ALA  43   9.843  10.979  -2.820
  257    HB2  ALA  43           2HB      ALA  43  11.358  11.364  -3.638
  258    HB3  ALA  43           3HB      ALA  43  11.365  10.330  -2.208
  259    H    ALA  44           H        ALA  44   8.684   8.075  -4.895
  260    HA   ALA  44           HA       ALA  44   7.925   6.884  -2.350
  261    HB1  ALA  44           1HB      ALA  44   6.197   7.887  -3.780
  262    HB2  ALA  44           2HB      ALA  44   5.910   6.170  -3.502
  263    HB3  ALA  44           3HB      ALA  44   6.575   6.714  -5.042
  264    H    ALA  45           H        ALA  45   7.175   4.513  -2.510
  265    HA   ALA  45           HA       ALA  45   8.815   2.904  -4.291
  266    HB1  ALA  45           1HB      ALA  45  10.307   3.346  -2.405
  267    HB2  ALA  45           2HB      ALA  45   9.862   1.641  -2.495
  268    HB3  ALA  45           3HB      ALA  45   9.100   2.689  -1.300
  269    H    TYR  46           H        TYR  46   6.393   3.053  -1.720
  270    HA   TYR  46           HA       TYR  46   5.245   0.562  -2.807
  271    HB2  TYR  46           2HB      TYR  46   5.281   1.469   0.087
  272    HB3  TYR  46           1HB      TYR  46   4.379   0.086  -0.511
  273    HD1  TYR  46           2HD      TYR  46   7.802   1.423  -0.009
  274    HD2  TYR  46           1HD      TYR  46   5.417  -2.018  -0.777
  275    HE1  TYR  46           2HE      TYR  46   9.760  -0.012   0.378
  276    HE2  TYR  46           1HE      TYR  46   7.370  -3.464  -0.390
  277    HH   TYR  46           HH       TYR  46   9.769  -3.363  -0.409
  278    H    GLY  47           H        GLY  47   3.156   0.740  -3.461
  279    HA2  GLY  47           2HA      GLY  47   1.644   3.077  -2.464
  280    HA3  GLY  47           1HA      GLY  47   1.506   2.484  -4.116
  281    H    VAL  48           H        VAL  48   0.095   2.430  -1.115
  282    HA   VAL  48           HA       VAL  48  -1.002  -0.278  -1.506
  283    HB   VAL  48           HB       VAL  48  -1.098   1.295   1.068
  284   HG11  VAL  48          1HG1      VAL  48  -1.448  -1.638   0.454
  285   HG12  VAL  48          2HG1      VAL  48  -2.719  -0.498   0.899
  286   HG13  VAL  48          3HG1      VAL  48  -1.467  -0.923   2.066
  287   HG21  VAL  48          3HG2      VAL  48   1.242   0.983   0.460
  288   HG22  VAL  48          1HG2      VAL  48   0.964  -0.743   0.225
  289   HG23  VAL  48          2HG2      VAL  48   0.812  -0.037   1.835
  290    H    LEU  49           H        LEU  49  -3.067  -0.476  -2.040
  291    HA   LEU  49           HA       LEU  49  -4.769   1.872  -2.067
  292    HB2  LEU  49           2HB      LEU  49  -6.325   0.486  -3.335
  293    HB3  LEU  49           1HB      LEU  49  -4.722   0.433  -4.036
  294    HG   LEU  49           HG       LEU  49  -4.629  -1.775  -2.465
  295   HD11  LEU  49          1HD1      LEU  49  -7.486  -1.535  -3.393
  296   HD12  LEU  49          2HD1      LEU  49  -6.926  -1.571  -1.721
  297   HD13  LEU  49          3HD1      LEU  49  -6.739  -2.995  -2.746
  298   HD21  LEU  49          3HD2      LEU  49  -4.017  -1.640  -4.824
  299   HD22  LEU  49          1HD2      LEU  49  -5.723  -1.628  -5.271
  300   HD23  LEU  49          2HD2      LEU  49  -5.021  -3.054  -4.505
  301    H    VAL  50           H        VAL  50  -6.321   2.296  -0.639
  302    HA   VAL  50           HA       VAL  50  -7.251   0.125   1.106
  303    HB   VAL  50           HB       VAL  50  -7.461   1.936   2.936
  304   HG11  VAL  50          1HG1      VAL  50  -4.743   0.890   2.148
  305   HG12  VAL  50          2HG1      VAL  50  -5.965   0.007   3.063
  306   HG13  VAL  50          3HG1      VAL  50  -5.213   1.445   3.755
  307   HG21  VAL  50          3HG2      VAL  50  -5.727   3.672   2.864
  308   HG22  VAL  50          1HG2      VAL  50  -6.898   3.869   1.558
  309   HG23  VAL  50          2HG2      VAL  50  -5.309   3.180   1.223
  310    H    THR  51           H        THR  51  -9.304  -0.158   0.807
  311    HA   THR  51           HA       THR  51 -10.908   2.032  -0.300
  312    HB   THR  51           HB       THR  51 -11.689  -0.875  -0.044
  313    HG1  THR  51           1HG      THR  51  -9.703  -0.102  -1.423
  314   HG21  THR  51          3HG2      THR  51 -13.529   0.695  -0.456
  315   HG22  THR  51          1HG2      THR  51 -13.239  -0.333  -1.859
  316   HG23  THR  51          2HG2      THR  51 -12.669   1.335  -1.856
  317    H    ARG  52           H        ARG  52 -12.194   3.146   1.024
  318    HA   ARG  52           HA       ARG  52 -12.949   2.181   3.620
  319    HB2  ARG  52           2HB      ARG  52 -13.520   4.616   1.993
  320    HB3  ARG  52           1HB      ARG  52 -14.657   4.208   3.267
  321    HG2  ARG  52           2HG      ARG  52 -13.079   5.790   4.102
  322    HG3  ARG  52           1HG      ARG  52 -12.792   4.237   4.884
  323    HD2  ARG  52           2HD      ARG  52 -10.891   3.821   3.470
  324    HD3  ARG  52           1HD      ARG  52 -11.228   5.274   2.525
  325    HE   ARG  52           HE       ARG  52 -10.904   6.421   4.833
  326   HH11  ARG  52          1HH1      ARG  52  -9.057   3.712   3.583
  327   HH12  ARG  52          2HH1      ARG  52  -7.656   4.074   4.537
  328   HH21  ARG  52          1HH2      ARG  52  -9.071   6.885   6.073
  329   HH22  ARG  52          2HH2      ARG  52  -7.668   5.869   5.974
  330    HA   PRO  53           HA       PRO  53 -16.358  -0.285   2.309
  331    HB2  PRO  53           2HB      PRO  53 -17.601   0.225   4.921
  332    HB3  PRO  53           1HB      PRO  53 -16.984  -1.286   4.248
  333    HG2  PRO  53           2HG      PRO  53 -15.735  -0.015   6.259
  334    HG3  PRO  53           1HG      PRO  53 -14.840  -0.907   5.012
  335    HD2  PRO  53           2HD      PRO  53 -15.305   2.043   5.269
  336    HD3  PRO  53           1HD      PRO  53 -13.820   1.173   4.828
  337    H    ASP  54           H        ASP  54 -16.517   2.858   2.262
  338    HA   ASP  54           HA       ASP  54 -19.447   2.995   2.104
  339    HB2  ASP  54           2HB      ASP  54 -18.085   4.616   3.602
  340    HB3  ASP  54           1HB      ASP  54 -17.648   5.401   2.086
  341    H    GLY  55           H        GLY  55 -16.592   2.883   0.286
  342    HA2  GLY  55           2HA      GLY  55 -17.016   2.474  -2.131
  343    HA3  GLY  55           1HA      GLY  55 -18.025   3.911  -2.087
  344    H    THR  56           H        THR  56 -15.930   5.091  -0.194
  345    HA   THR  56           HA       THR  56 -14.377   6.357  -2.241
  346    HB   THR  56           HB       THR  56 -13.297   7.371  -0.019
  347    HG1  THR  56           1HG      THR  56 -15.302   7.464   1.447
  348   HG21  THR  56          3HG2      THR  56 -14.512   8.656  -1.687
  349   HG22  THR  56          1HG2      THR  56 -15.068   9.093  -0.072
  350   HG23  THR  56          2HG2      THR  56 -16.045   8.029  -1.084
  351    H    ARG  57           H        ARG  57 -12.597   5.570  -3.045
  352    HA   ARG  57           HA       ARG  57 -10.946   3.770  -1.391
  353    HB2  ARG  57           2HB      ARG  57 -12.000   2.564  -3.198
  354    HB3  ARG  57           1HB      ARG  57 -11.484   3.770  -4.362
  355    HG2  ARG  57           2HG      ARG  57  -9.179   3.110  -4.083
  356    HG3  ARG  57           1HG      ARG  57  -9.638   1.961  -2.822
  357    HD2  ARG  57           2HD      ARG  57  -9.277   0.942  -5.083
  358    HD3  ARG  57           1HD      ARG  57 -10.861   0.625  -4.373
  359    HE   ARG  57           HE       ARG  57 -10.506   2.806  -6.320
  360   HH11  ARG  57          1HH1      ARG  57 -11.961  -0.251  -5.400
  361   HH12  ARG  57          2HH1      ARG  57 -13.160  -0.195  -6.659
  362   HH21  ARG  57          1HH2      ARG  57 -12.113   2.872  -7.976
  363   HH22  ARG  57          2HH2      ARG  57 -13.246   1.561  -8.108
  364    H    VAL  58           H        VAL  58  -9.015   4.557  -0.887
  365    HA   VAL  58           HA       VAL  58  -7.769   6.492  -2.727
  366    HB   VAL  58           HB       VAL  58  -6.713   7.569  -0.755
  367   HG11  VAL  58          1HG1      VAL  58  -9.728   7.543  -0.722
  368   HG12  VAL  58          2HG1      VAL  58  -8.704   8.554  -1.740
  369   HG13  VAL  58          3HG1      VAL  58  -8.704   8.779   0.009
  370   HG21  VAL  58          3HG2      VAL  58  -7.651   7.152   1.481
  371   HG22  VAL  58          1HG2      VAL  58  -6.828   5.736   0.828
  372   HG23  VAL  58          2HG2      VAL  58  -8.590   5.812   0.823
  373    H    GLU  59           H        GLU  59  -5.381   6.586  -2.501
  374    HA   GLU  59           HA       GLU  59  -4.286   3.994  -1.640
  375    HB2  GLU  59           2HB      GLU  59  -2.662   4.130  -3.482
  376    HB3  GLU  59           1HB      GLU  59  -4.316   4.070  -4.070
  377    HG2  GLU  59           2HG      GLU  59  -4.262   6.503  -4.407
  378    HG3  GLU  59           1HG      GLU  59  -2.578   6.517  -3.882
  379    H    VAL  60           H        VAL  60  -2.554   4.049  -0.364
  380    HA   VAL  60           HA       VAL  60  -1.533   6.702   0.374
  381    HB   VAL  60           HB       VAL  60  -1.141   4.100   1.862
  382   HG11  VAL  60          1HG1      VAL  60  -0.749   6.970   2.696
  383   HG12  VAL  60          2HG1      VAL  60   0.519   5.783   2.386
  384   HG13  VAL  60          3HG1      VAL  60  -0.579   5.567   3.750
  385   HG21  VAL  60          3HG2      VAL  60  -3.511   4.586   1.778
  386   HG22  VAL  60          1HG2      VAL  60  -3.215   6.241   2.314
  387   HG23  VAL  60          2HG2      VAL  60  -2.889   4.891   3.401
  388    H    HIS  61           H        HIS  61   0.386   7.276  -0.376
  389    HA   HIS  61           HA       HIS  61   2.079   5.240  -1.603
  390    HB2  HIS  61           2HB      HIS  61   2.114   8.253  -1.750
  391    HB3  HIS  61           1HB      HIS  61   3.347   7.235  -2.488
  392    HD1  HIS  61           1HD      HIS  61   0.367   8.941  -3.384
  393    HD2  HIS  61           2HD      HIS  61   1.910   5.174  -4.240
  394    HE1  HIS  61           1HE      HIS  61  -0.802   8.182  -5.469
  395    HE2  HIS  61           2HE      HIS  61  -0.095   5.789  -5.756
  396    H    LEU  62           H        LEU  62   3.785   4.481  -0.695
  397    HA   LEU  62           HA       LEU  62   4.723   5.689   1.823
  398    HB2  LEU  62           2HB      LEU  62   4.018   2.949   0.992
  399    HB3  LEU  62           1HB      LEU  62   5.492   3.074   1.927
  400    HG   LEU  62           HG       LEU  62   4.388   3.607   3.862
  401   HD11  LEU  62          1HD1      LEU  62   2.124   4.727   2.211
  402   HD12  LEU  62          2HD1      LEU  62   3.363   5.665   3.045
  403   HD13  LEU  62          3HD1      LEU  62   2.203   4.714   3.972
  404   HD21  LEU  62          3HD2      LEU  62   3.578   1.434   3.085
  405   HD22  LEU  62          1HD2      LEU  62   2.222   2.232   2.289
  406   HD23  LEU  62          2HD2      LEU  62   2.365   2.280   4.046
  407    H    ASP  63           H        ASP  63   6.925   5.429   2.337
  408    HA   ASP  63           HA       ASP  63   8.706   5.466   0.037
  409    HB2  ASP  63           2HB      ASP  63   9.004   7.260   1.606
  410    HB3  ASP  63           1HB      ASP  63   9.047   6.149   2.967
  411    H    ARG  64           H        ARG  64  10.917   4.408   0.508
  412    HA   ARG  64           HA       ARG  64  10.688   1.675   0.319
  413    HB2  ARG  64           2HB      ARG  64  13.021   3.385   1.173
  414    HB3  ARG  64           1HB      ARG  64  13.155   1.667   0.815
  415    HG2  ARG  64           2HG      ARG  64  12.794   1.961  -1.429
  416    HG3  ARG  64           1HG      ARG  64  11.926   3.481  -1.202
  417    HD2  ARG  64           2HD      ARG  64  14.855   3.182  -0.601
  418    HD3  ARG  64           1HD      ARG  64  14.260   3.620  -2.200
  419    HE   ARG  64           HE       ARG  64  13.080   5.380  -0.413
  420   HH11  ARG  64          1HH1      ARG  64  16.328   4.512  -1.359
  421   HH12  ARG  64          2HH1      ARG  64  16.962   6.122  -1.187
  422   HH21  ARG  64          1HH2      ARG  64  13.889   7.512  -0.176
  423   HH22  ARG  64          2HH2      ARG  64  15.571   7.831  -0.490
  424    H    ASP  65           H        ASP  65  11.481   3.545   3.254
  425    HA   ASP  65           HA       ASP  65  11.368   1.059   4.800
  426    HB2  ASP  65           2HB      ASP  65  12.250   3.846   5.558
  427    HB3  ASP  65           1HB      ASP  65  12.135   2.521   6.709
  428    H    PHE  66           H        PHE  66   9.047   2.431   3.580
  429    HA   PHE  66           HA       PHE  66   6.854   2.574   4.035
  430    HB2  PHE  66           2HB      PHE  66   7.842   1.188   6.480
  431    HB3  PHE  66           1HB      PHE  66   6.175   1.762   6.440
  432    HD1  PHE  66           2HD      PHE  66   4.863   1.172   4.270
  433    HD2  PHE  66           1HD      PHE  66   8.292  -0.941   5.645
  434    HE1  PHE  66           2HE      PHE  66   4.189  -0.780   2.942
  435    HE2  PHE  66           1HE      PHE  66   7.624  -2.893   4.308
  436    HZ   PHE  66           HZ       PHE  66   5.569  -2.810   2.960
  437    H    ARG  67           H        ARG  67   8.599   4.870   4.590
  438    HA   ARG  67           HA       ARG  67   7.173   6.331   6.621
  439    HB2  ARG  67           2HB      ARG  67   9.174   7.070   4.516
  440    HB3  ARG  67           1HB      ARG  67   8.210   8.336   5.258
  441    HG2  ARG  67           2HG      ARG  67  10.192   8.279   6.482
  442    HG3  ARG  67           1HG      ARG  67   9.015   7.437   7.488
  443    HD2  ARG  67           2HD      ARG  67  10.967   6.137   7.582
  444    HD3  ARG  67           1HD      ARG  67   9.895   5.292   6.465
  445    HE   ARG  67           HE       ARG  67  11.236   6.339   4.637
  446   HH11  ARG  67          1HH1      ARG  67  12.582   6.031   7.842
  447   HH12  ARG  67          2HH1      ARG  67  14.225   5.923   7.300
  448   HH21  ARG  67          1HH2      ARG  67  13.384   6.194   3.889
  449   HH22  ARG  67          2HH2      ARG  67  14.685   6.015   5.027
  450    H    VAL  68           H        VAL  68   5.222   7.263   6.392
  451    HA   VAL  68           HA       VAL  68   3.783   6.989   3.959
  452    HB   VAL  68           HB       VAL  68   2.553   6.914   6.028
  453   HG11  VAL  68          1HG1      VAL  68   2.279   8.867   7.478
  454   HG12  VAL  68          2HG1      VAL  68   3.426   9.763   6.481
  455   HG13  VAL  68          3HG1      VAL  68   3.965   8.352   7.391
  456   HG21  VAL  68          3HG2      VAL  68   1.342   7.744   4.099
  457   HG22  VAL  68          1HG2      VAL  68   1.860   9.392   4.459
  458   HG23  VAL  68          2HG2      VAL  68   0.777   8.548   5.564
  459    H    LEU  69           H        LEU  69   3.853   8.238   2.220
  460    HA   LEU  69           HA       LEU  69   5.146  10.851   2.445
  461    HB2  LEU  69           2HB      LEU  69   4.430   9.225   0.001
  462    HB3  LEU  69           1HB      LEU  69   5.287  10.754  -0.018
  463    HG   LEU  69           HG       LEU  69   6.292   8.167   1.170
  464   HD11  LEU  69          1HD1      LEU  69   6.324   8.197  -1.258
  465   HD12  LEU  69          2HD1      LEU  69   7.962   8.301  -0.611
  466   HD13  LEU  69          3HD1      LEU  69   7.167   9.745  -1.240
  467   HD21  LEU  69          3HD2      LEU  69   7.049  10.078   2.482
  468   HD22  LEU  69          1HD2      LEU  69   7.613  10.873   1.011
  469   HD23  LEU  69          2HD2      LEU  69   8.380   9.381   1.556
  470    H    ASP  70           H        ASP  70   2.343   9.484   0.693
  471    HA   ASP  70           HA       ASP  70   0.815  11.887   1.271
  472    HB2  ASP  70           2HB      ASP  70   2.295  12.212  -0.852
  473    HB3  ASP  70           1HB      ASP  70   1.134  11.138  -1.622
  474    H    THR  71           H        THR  71  -1.396  11.698   0.177
  475    HA   THR  71           HA       THR  71  -2.251   8.954  -0.281
  476    HB   THR  71           HB       THR  71  -3.508  10.627   1.909
  477    HG1  THR  71           1HG      THR  71  -1.380   8.906   1.913
  478   HG21  THR  71          3HG2      THR  71  -4.000   7.772   1.034
  479   HG22  THR  71          1HG2      THR  71  -5.095   9.134   0.798
  480   HG23  THR  71          2HG2      THR  71  -4.743   8.557   2.428
  481    H    GLU  72           H        GLU  72  -3.403   9.072  -2.072
  482    HA   GLU  72           HA       GLU  72  -5.316  11.273  -2.394
  483    HB2  GLU  72           2HB      GLU  72  -4.739  11.203  -4.881
  484    HB3  GLU  72           1HB      GLU  72  -3.573  11.975  -3.818
  485    HG2  GLU  72           2HG      GLU  72  -3.144   9.106  -4.328
  486    HG3  GLU  72           1HG      GLU  72  -2.933  10.179  -5.711
  487    HA   PRO  73           HA       PRO  73  -8.327   8.232  -3.478
  488    HB2  PRO  73           2HB      PRO  73  -9.449   9.296  -5.765
  489    HB3  PRO  73           1HB      PRO  73  -9.865   9.781  -4.119
  490    HG2  PRO  73           2HG      PRO  73  -8.015  11.088  -6.068
  491    HG3  PRO  73           1HG      PRO  73  -9.169  11.831  -4.944
  492    HD2  PRO  73           2HD      PRO  73  -6.536  11.770  -4.425
  493    HD3  PRO  73           1HD      PRO  73  -7.740  11.595  -3.131
  494    H    ALA  74           H        ALA  74  -8.526   6.397  -4.654
  495    HA   ALA  74           HA       ALA  74  -6.793   6.124  -7.022
  496    HB1  ALA  74           1HB      ALA  74  -5.769   5.029  -5.090
  497    HB2  ALA  74           2HB      ALA  74  -6.261   3.853  -6.309
  498    HB3  ALA  74           3HB      ALA  74  -7.233   4.074  -4.855
  499    H    ASP  75           H        ASP  75  -7.889   5.543  -8.779
  500    HA   ASP  75           HA       ASP  75 -10.130   3.696  -8.528
  501    HB2  ASP  75           2HB      ASP  75 -11.038   6.064  -8.450
  502    HB3  ASP  75           1HB      ASP  75 -10.441   6.260 -10.095
  503    H    GLY  76           H        GLY  76  -9.494   2.098  -9.791
  504    HA2  GLY  76           2HA      GLY  76  -7.766   2.398 -12.021
  505    HA3  GLY  76           1HA      GLY  76  -8.679   0.952 -11.607
  506    H    ASP  77           H        ASP  77  -8.680   3.943 -13.379
  507    HA   ASP  77           HA       ASP  77 -11.329   3.904 -14.304
  508    HB2  ASP  77           2HB      ASP  77  -9.806   5.875 -14.407
  509    HB3  ASP  77           1HB      ASP  77  -8.928   5.084 -15.715
  510    H    GLY  78           H        GLY  78  -8.387   2.432 -15.582
  511    HA2  GLY  78           2HA      GLY  78  -9.552   0.228 -16.659
  512    HA3  GLY  78           1HA      GLY  78  -9.722   1.431 -17.929
  513    H    GLY  79           H        GLY  79  -7.263   2.793 -17.493
  514    HA2  GLY  79           2HA      GLY  79  -5.643   1.110 -19.136
  515    HA3  GLY  79           1HA      GLY  79  -5.219   2.707 -18.544
  516    H    LEU  80           H        LEU  80  -4.285  -0.389 -18.542
  517    HA   LEU  80           HA       LEU  80  -2.799  -0.057 -16.019
  518    HB2  LEU  80           2HB      LEU  80  -3.696  -2.628 -17.336
  519    HB3  LEU  80           1HB      LEU  80  -2.657  -2.535 -15.928
  520    HG   LEU  80           HG       LEU  80  -5.518  -1.572 -16.035
  521   HD11  LEU  80          1HD1      LEU  80  -5.994  -3.493 -14.605
  522   HD12  LEU  80          2HD1      LEU  80  -4.318  -4.022 -14.753
  523   HD13  LEU  80          3HD1      LEU  80  -5.365  -3.999 -16.172
  524   HD21  LEU  80          3HD2      LEU  80  -3.620  -1.836 -13.707
  525   HD22  LEU  80          1HD2      LEU  80  -5.303  -1.312 -13.631
  526   HD23  LEU  80          2HD2      LEU  80  -4.105  -0.319 -14.464
  527    H    GLU  81           H        GLU  81  -0.708   0.319 -16.397
  528    HA   GLU  81           HA       GLU  81   0.447  -0.700 -18.904
  529    HB2  GLU  81           2HB      GLU  81   1.856   1.328 -18.952
  530    HB3  GLU  81           1HB      GLU  81   0.141   1.703 -19.047
  531    HG2  GLU  81           2HG      GLU  81   0.143   2.255 -16.654
  532    HG3  GLU  81           1HG      GLU  81   1.872   1.921 -16.592
  Start of MODEL    5
    1    H1   GLY   1           1HT      GLY   1   7.818   6.733  16.519
    2    H2   GLY   1           2HT      GLY   1   9.341   6.395  15.858
    3    H3   GLY   1           3HT      GLY   1   8.629   5.306  16.945
    4    HA2  GLY   1           1HA      GLY   1   6.832   4.902  15.356
    5    HA3  GLY   1           2HA      GLY   1   7.657   5.963  14.222
    6    H    ALA   2           H        ALA   2   7.017   3.219  13.784
    7    HA   ALA   2           HA       ALA   2   9.703   2.000  13.790
    8    HB1  ALA   2           1HB      ALA   2   7.013   0.640  13.817
    9    HB2  ALA   2           2HB      ALA   2   8.150   0.743  15.163
   10    HB3  ALA   2           3HB      ALA   2   8.571  -0.179  13.720
   11    H    MET   3           H        MET   3  10.559   1.346  11.901
   12    HA   MET   3           HA       MET   3   9.075   1.892   9.451
   13    HB2  MET   3           2HB      MET   3  11.953   1.205  10.027
   14    HB3  MET   3           1HB      MET   3  11.313   1.205   8.392
   15    HG2  MET   3           2HG      MET   3  12.424   3.280   8.799
   16    HG3  MET   3           1HG      MET   3  10.692   3.573   8.670
   17    HE1  MET   3           3HE      MET   3  12.073   6.241  11.264
   18    HE2  MET   3           1HE      MET   3  11.234   6.029   9.726
   19    HE3  MET   3           2HE      MET   3  12.931   5.572   9.876
   20    H    ALA   4           H        ALA   4   7.929   0.327   8.528
   21    HA   ALA   4           HA       ALA   4   8.010  -2.310   9.642
   22    HB1  ALA   4           1HB      ALA   4   6.326  -1.214   7.397
   23    HB2  ALA   4           2HB      ALA   4   5.883  -1.255   9.103
   24    HB3  ALA   4           3HB      ALA   4   6.083  -2.760   8.208
   25    H    PHE   5           H        PHE   5  10.167  -2.905   8.980
   26    HA   PHE   5           HA       PHE   5  10.128  -4.014   6.249
   27    HB2  PHE   5           2HB      PHE   5  12.523  -3.113   7.861
   28    HB3  PHE   5           1HB      PHE   5  12.612  -3.947   6.314
   29    HD1  PHE   5           2HD      PHE   5  11.498  -2.833   4.312
   30    HD2  PHE   5           1HD      PHE   5  12.347  -0.809   7.953
   31    HE1  PHE   5           2HE      PHE   5  11.340  -0.674   3.143
   32    HE2  PHE   5           1HE      PHE   5  12.185   1.352   6.795
   33    HZ   PHE   5           HZ       PHE   5  11.679   1.423   4.388
   34    H    ASP   6           H        ASP   6   8.844  -5.448   7.818
   35    HA   ASP   6           HA       ASP   6  10.494  -7.736   8.519
   36    HB2  ASP   6           2HB      ASP   6  10.133  -6.151  10.553
   37    HB3  ASP   6           1HB      ASP   6   8.462  -6.696  10.498
   38    H    GLY   7           H        GLY   7   7.975  -8.789   9.945
   39    HA2  GLY   7           2HA      GLY   7   5.654  -8.490   8.542
   40    HA3  GLY   7           1HA      GLY   7   6.572  -9.626   7.565
   41    H    GLU   8           H        GLU   8   4.286 -10.556   8.401
   42    HA   GLU   8           HA       GLU   8   4.618 -11.973  10.915
   43    HB2  GLU   8           2HB      GLU   8   2.458 -12.056   8.803
   44    HB3  GLU   8           1HB      GLU   8   2.420 -13.007  10.282
   45    HG2  GLU   8           2HG      GLU   8   2.564 -10.006  10.206
   46    HG3  GLU   8           1HG      GLU   8   1.071 -10.927  10.367
   47    H    ASP   9           H        ASP   9   3.856 -14.484  10.602
   48    HA   ASP   9           HA       ASP   9   5.937 -15.562   8.860
   49    HB2  ASP   9           2HB      ASP   9   5.658 -16.291  11.295
   50    HB3  ASP   9           1HB      ASP   9   4.216 -17.154  10.761
   51    H    GLU  10           H        GLU  10   2.670 -14.925   8.819
   52    HA   GLU  10           HA       GLU  10   1.921 -17.038   6.989
   53    HB2  GLU  10           2HB      GLU  10   0.432 -14.501   7.707
   54    HB3  GLU  10           1HB      GLU  10  -0.225 -15.871   6.826
   55    HG2  GLU  10           2HG      GLU  10  -1.060 -16.125   8.972
   56    HG3  GLU  10           1HG      GLU  10   0.304 -17.238   8.917
   57    H    VAL  11           H        VAL  11   4.044 -16.086   5.887
   58    HA   VAL  11           HA       VAL  11   3.937 -13.672   4.496
   59    HB   VAL  11           HB       VAL  11   5.774 -14.697   3.058
   60   HG11  VAL  11          1HG1      VAL  11   6.227 -13.295   4.990
   61   HG12  VAL  11          2HG1      VAL  11   7.401 -14.608   4.893
   62   HG13  VAL  11          3HG1      VAL  11   6.080 -14.690   6.059
   63   HG21  VAL  11          3HG2      VAL  11   6.783 -16.764   3.911
   64   HG22  VAL  11          1HG2      VAL  11   5.150 -17.040   3.302
   65   HG23  VAL  11          2HG2      VAL  11   5.440 -16.950   5.039
   66    H    THR  12           H        THR  12   2.103 -13.375   3.375
   67    HA   THR  12           HA       THR  12   1.474 -15.152   1.150
   68    HB   THR  12           HB       THR  12  -0.439 -14.374   2.380
   69    HG1  THR  12           1HG      THR  12  -0.487 -12.677   0.101
   70   HG21  THR  12          3HG2      THR  12  -0.977 -11.996   2.639
   71   HG22  THR  12          1HG2      THR  12   0.556 -11.572   1.874
   72   HG23  THR  12          2HG2      THR  12   0.546 -12.411   3.424
   73    H    GLY  13           H        GLY  13   3.089 -12.235   1.897
   74    HA2  GLY  13           2HA      GLY  13   4.025 -12.026  -0.845
   75    HA3  GLY  13           1HA      GLY  13   3.188 -10.616  -0.203
   76    HA   PRO  14           HA       PRO  14   7.805 -11.197   1.268
   77    HB2  PRO  14           2HB      PRO  14   8.538  -9.481  -1.022
   78    HB3  PRO  14           1HB      PRO  14   9.337 -10.929  -0.402
   79    HG2  PRO  14           2HG      PRO  14   7.952 -10.954  -2.693
   80    HG3  PRO  14           1HG      PRO  14   7.982 -12.354  -1.608
   81    HD2  PRO  14           2HD      PRO  14   5.842 -10.313  -2.026
   82    HD3  PRO  14           1HD      PRO  14   5.697 -12.058  -1.730
   83    H    ASP  15           H        ASP  15   7.187  -8.254  -0.650
   84    HA   ASP  15           HA       ASP  15   7.594  -6.638   1.747
   85    HB2  ASP  15           2HB      ASP  15   7.304  -5.957  -1.179
   86    HB3  ASP  15           1HB      ASP  15   7.301  -4.719   0.073
   87    H    ALA  16           H        ALA  16   5.121  -7.876  -0.240
   88    HA   ALA  16           HA       ALA  16   3.051  -6.052   0.148
   89    HB1  ALA  16           1HB      ALA  16   2.919  -7.862  -1.468
   90    HB2  ALA  16           2HB      ALA  16   1.544  -7.917  -0.365
   91    HB3  ALA  16           3HB      ALA  16   2.882  -9.048  -0.163
   92    H    ASP  17           H        ASP  17   4.240  -8.636   2.214
   93    HA   ASP  17           HA       ASP  17   2.068  -8.944   3.926
   94    HB2  ASP  17           2HB      ASP  17   4.165 -10.366   3.833
   95    HB3  ASP  17           1HB      ASP  17   4.961  -9.117   4.783
   96    H    ARG  18           H        ARG  18   4.955  -6.889   4.504
   97    HA   ARG  18           HA       ARG  18   3.852  -5.776   6.869
   98    HB2  ARG  18           2HB      ARG  18   5.714  -4.078   6.675
   99    HB3  ARG  18           1HB      ARG  18   6.207  -5.753   6.793
  100    HG2  ARG  18           2HG      ARG  18   5.934  -4.560   4.088
  101    HG3  ARG  18           1HG      ARG  18   7.318  -4.100   5.083
  102    HD2  ARG  18           2HD      ARG  18   7.638  -6.624   5.439
  103    HD3  ARG  18           1HD      ARG  18   6.548  -6.816   4.068
  104    HE   ARG  18           HE       ARG  18   8.266  -5.279   2.912
  105   HH11  ARG  18          1HH1      ARG  18   8.994  -7.736   5.298
  106   HH12  ARG  18          2HH1      ARG  18  10.597  -8.026   4.690
  107   HH21  ARG  18          1HH2      ARG  18  10.354  -5.666   2.096
  108   HH22  ARG  18          2HH2      ARG  18  11.371  -6.853   2.869
  109    H    ALA  19           H        ALA  19   3.843  -4.726   3.519
  110    HA   ALA  19           HA       ALA  19   2.979  -2.068   4.039
  111    HB1  ALA  19           1HB      ALA  19   2.688  -3.718   1.527
  112    HB2  ALA  19           2HB      ALA  19   4.058  -2.686   1.939
  113    HB3  ALA  19           3HB      ALA  19   2.472  -1.973   1.649
  114    H    ARG  20           H        ARG  20   1.295  -5.074   3.260
  115    HA   ARG  20           HA       ARG  20  -1.300  -3.907   3.180
  116    HB2  ARG  20           2HB      ARG  20  -0.790  -6.009   2.037
  117    HB3  ARG  20           1HB      ARG  20  -0.440  -6.776   3.578
  118    HG2  ARG  20           2HG      ARG  20  -2.785  -6.412   4.254
  119    HG3  ARG  20           1HG      ARG  20  -3.109  -5.750   2.649
  120    HD2  ARG  20           2HD      ARG  20  -2.588  -7.842   1.608
  121    HD3  ARG  20           1HD      ARG  20  -2.001  -8.510   3.131
  122    HE   ARG  20           HE       ARG  20  -4.801  -7.675   2.995
  123   HH11  ARG  20          1HH1      ARG  20  -2.485 -10.287   2.857
  124   HH12  ARG  20          2HH1      ARG  20  -3.621 -11.491   3.384
  125   HH21  ARG  20          1HH2      ARG  20  -6.310  -9.264   3.673
  126   HH22  ARG  20          2HH2      ARG  20  -5.787 -10.918   3.853
  127    H    ALA  21           H        ALA  21   0.649  -5.451   5.686
  128    HA   ALA  21           HA       ALA  21  -1.380  -5.668   7.638
  129    HB1  ALA  21           1HB      ALA  21   1.598  -5.427   8.033
  130    HB2  ALA  21           2HB      ALA  21   0.714  -6.926   7.747
  131    HB3  ALA  21           3HB      ALA  21   0.435  -6.005   9.226
  132    H    ALA  22           H        ALA  22   0.532  -2.995   6.562
  133    HA   ALA  22           HA       ALA  22   0.091  -1.396   8.920
  134    HB1  ALA  22           1HB      ALA  22   2.114  -1.112   7.575
  135    HB2  ALA  22           2HB      ALA  22   1.188   0.386   7.673
  136    HB3  ALA  22           3HB      ALA  22   1.134  -0.591   6.206
  137    H    ALA  23           H        ALA  23  -1.470  -1.918   5.866
  138    HA   ALA  23           HA       ALA  23  -2.850   0.510   5.601
  139    HB1  ALA  23           1HB      ALA  23  -3.649  -2.213   4.594
  140    HB2  ALA  23           2HB      ALA  23  -2.568  -1.088   3.774
  141    HB3  ALA  23           3HB      ALA  23  -4.264  -0.667   4.010
  142    H    VAL  24           H        VAL  24  -3.556  -2.342   7.498
  143    HA   VAL  24           HA       VAL  24  -6.342  -1.867   7.770
  144    HB   VAL  24           HB       VAL  24  -5.206  -4.078   8.098
  145   HG11  VAL  24          1HG1      VAL  24  -4.305  -4.625  10.299
  146   HG12  VAL  24          2HG1      VAL  24  -4.494  -2.944  10.798
  147   HG13  VAL  24          3HG1      VAL  24  -3.362  -3.360   9.511
  148   HG21  VAL  24          3HG2      VAL  24  -7.523  -3.771   8.720
  149   HG22  VAL  24          1HG2      VAL  24  -7.043  -3.143  10.298
  150   HG23  VAL  24          2HG2      VAL  24  -6.718  -4.826   9.881
  151    H    GLN  25           H        GLN  25  -3.647  -0.371   9.233
  152    HA   GLN  25           HA       GLN  25  -5.130   0.555  11.550
  153    HB2  GLN  25           2HB      GLN  25  -2.355   1.057  10.516
  154    HB3  GLN  25           1HB      GLN  25  -3.051   2.130  11.719
  155    HG2  GLN  25           2HG      GLN  25  -1.802   0.585  12.938
  156    HG3  GLN  25           1HG      GLN  25  -3.472   0.058  13.118
  157   HE21  GLN  25          1HE2      GLN  25  -1.547  -0.433  10.239
  158   HE22  GLN  25          2HE2      GLN  25  -1.440  -2.157  10.377
  159    H    ALA  26           H        ALA  26  -4.326   1.627   8.342
  160    HA   ALA  26           HA       ALA  26  -5.002   4.383   8.831
  161    HB1  ALA  26           1HB      ALA  26  -3.283   3.737   7.189
  162    HB2  ALA  26           2HB      ALA  26  -4.560   4.724   6.479
  163    HB3  ALA  26           3HB      ALA  26  -4.534   2.981   6.203
  164    H    VAL  27           H        VAL  27  -6.606   1.541   7.563
  165    HA   VAL  27           HA       VAL  27  -8.973   3.195   6.987
  166    HB   VAL  27           HB       VAL  27  -8.078   1.973   5.030
  167   HG11  VAL  27          1HG1      VAL  27  -8.766  -0.511   6.588
  168   HG12  VAL  27          2HG1      VAL  27  -7.150   0.027   6.128
  169   HG13  VAL  27          3HG1      VAL  27  -8.306  -0.461   4.887
  170   HG21  VAL  27          3HG2      VAL  27 -10.204   0.955   4.313
  171   HG22  VAL  27          1HG2      VAL  27 -10.427   2.525   5.084
  172   HG23  VAL  27          2HG2      VAL  27 -10.785   1.048   5.976
  173    HA   PRO  28           HA       PRO  28 -10.835   1.019  10.388
  174    HB2  PRO  28           2HB      PRO  28 -13.336   2.227  10.003
  175    HB3  PRO  28           1HB      PRO  28 -12.033   2.824  11.028
  176    HG2  PRO  28           2HG      PRO  28 -13.022   3.980   8.627
  177    HG3  PRO  28           1HG      PRO  28 -11.648   4.522   9.601
  178    HD2  PRO  28           2HD      PRO  28 -11.682   2.998   7.083
  179    HD3  PRO  28           1HD      PRO  28 -10.380   3.963   7.805
  180    H    GLY  29           H        GLY  29 -10.995  -1.096   9.727
  181    HA2  GLY  29           2HA      GLY  29 -12.028  -3.023   9.018
  182    HA3  GLY  29           1HA      GLY  29 -13.532  -2.112   9.051
  183    H    GLY  30           H        GLY  30 -10.668  -1.514   7.084
  184    HA2  GLY  30           2HA      GLY  30 -12.406  -1.698   4.720
  185    HA3  GLY  30           1HA      GLY  30 -10.931  -0.744   4.825
  186    H    THR  31           H        THR  31 -11.241  -2.319   2.687
  187    HA   THR  31           HA       THR  31 -10.124  -4.938   3.138
  188    HB   THR  31           HB       THR  31 -10.672  -3.509   0.531
  189    HG1  THR  31           1HG      THR  31 -12.271  -5.056   2.285
  190   HG21  THR  31          3HG2      THR  31 -10.664  -5.757  -0.438
  191   HG22  THR  31          1HG2      THR  31 -10.279  -6.444   1.140
  192   HG23  THR  31          2HG2      THR  31  -9.114  -5.402   0.325
  193    H    ALA  32           H        ALA  32  -8.059  -4.892   3.770
  194    HA   ALA  32           HA       ALA  32  -6.079  -3.392   2.266
  195    HB1  ALA  32           1HB      ALA  32  -5.752  -3.616   4.665
  196    HB2  ALA  32           2HB      ALA  32  -4.460  -4.452   3.803
  197    HB3  ALA  32           3HB      ALA  32  -5.778  -5.374   4.527
  198    H    GLY  33           H        GLY  33  -5.449  -4.159   0.355
  199    HA2  GLY  33           2HA      GLY  33  -5.774  -7.030  -0.192
  200    HA3  GLY  33           1HA      GLY  33  -5.713  -5.757  -1.402
  201    H    GLU  34           H        GLU  34  -4.208  -8.087  -1.598
  202    HA   GLU  34           HA       GLU  34  -1.547  -7.845  -0.711
  203    HB2  GLU  34           2HB      GLU  34  -2.669  -9.167  -3.187
  204    HB3  GLU  34           1HB      GLU  34  -1.018  -9.364  -2.619
  205    HG2  GLU  34           2HG      GLU  34  -3.465 -10.118  -1.044
  206    HG3  GLU  34           1HG      GLU  34  -2.515 -11.234  -2.027
  207    H    VAL  35           H        VAL  35  -0.370  -6.093  -1.066
  208    HA   VAL  35           HA       VAL  35  -0.730  -4.544  -3.497
  209    HB   VAL  35           HB       VAL  35   0.680  -2.852  -2.418
  210   HG11  VAL  35          1HG1      VAL  35  -1.693  -2.774  -1.996
  211   HG12  VAL  35          2HG1      VAL  35  -0.821  -2.315  -0.532
  212   HG13  VAL  35          3HG1      VAL  35  -1.527  -3.925  -0.671
  213   HG21  VAL  35          3HG2      VAL  35   1.438  -3.138  -0.107
  214   HG22  VAL  35          1HG2      VAL  35   2.171  -4.335  -1.174
  215   HG23  VAL  35          2HG2      VAL  35   0.839  -4.798  -0.115
  216    H    GLU  36           H        GLU  36   0.985  -3.988  -4.881
  217    HA   GLU  36           HA       GLU  36   3.244  -5.857  -4.769
  218    HB2  GLU  36           2HB      GLU  36   3.463  -5.451  -7.214
  219    HB3  GLU  36           1HB      GLU  36   1.933  -6.190  -6.765
  220    HG2  GLU  36           2HG      GLU  36   0.839  -4.006  -6.933
  221    HG3  GLU  36           1HG      GLU  36   2.373  -3.282  -7.415
  222    H    THR  37           H        THR  37   5.333  -5.082  -5.193
  223    HA   THR  37           HA       THR  37   5.801  -2.422  -4.272
  224    HB   THR  37           HB       THR  37   8.243  -3.131  -5.025
  225    HG1  THR  37           1HG      THR  37   8.495  -5.310  -5.202
  226   HG21  THR  37          3HG2      THR  37   6.788  -4.379  -2.694
  227   HG22  THR  37          1HG2      THR  37   7.504  -2.767  -2.719
  228   HG23  THR  37          2HG2      THR  37   8.535  -4.192  -2.842
  229    H    GLU  38           H        GLU  38   6.175  -0.638  -5.396
  230    HA   GLU  38           HA       GLU  38   6.018  -0.787  -8.305
  231    HB2  GLU  38           2HB      GLU  38   5.937   1.613  -6.469
  232    HB3  GLU  38           1HB      GLU  38   5.649   1.632  -8.201
  233    HG2  GLU  38           2HG      GLU  38   3.633   0.369  -7.944
  234    HG3  GLU  38           1HG      GLU  38   3.954   0.127  -6.225
  235    H    THR  39           H        THR  39   7.744  -0.444  -9.571
  236    HA   THR  39           HA       THR  39  10.181   0.642  -8.412
  237    HB   THR  39           HB       THR  39  10.916   0.342 -10.932
  238    HG1  THR  39           1HG      THR  39   8.786  -0.171 -11.681
  239   HG21  THR  39          3HG2      THR  39  11.564  -1.976 -10.444
  240   HG22  THR  39          1HG2      THR  39  10.427  -2.009  -9.096
  241   HG23  THR  39          2HG2      THR  39  11.823  -0.932  -9.046
  242    H    GLY  40           H        GLY  40  10.517   2.768  -8.399
  243    HA2  GLY  40           2HA      GLY  40   9.451   4.402 -10.573
  244    HA3  GLY  40           1HA      GLY  40   8.811   4.714  -8.967
  245    H    GLU  41           H        GLU  41  11.556   4.938 -11.061
  246    HA   GLU  41           HA       GLU  41  13.515   5.948  -9.411
  247    HB2  GLU  41           2HB      GLU  41  13.751   5.472 -11.845
  248    HB3  GLU  41           1HB      GLU  41  12.813   6.914 -12.194
  249    HG2  GLU  41           2HG      GLU  41  15.333   7.101 -10.597
  250    HG3  GLU  41           1HG      GLU  41  15.388   6.986 -12.354
  251    H    GLY  42           H        GLY  42  13.383   7.500  -7.963
  252    HA2  GLY  42           2HA      GLY  42  13.102  10.080  -8.063
  253    HA3  GLY  42           1HA      GLY  42  11.422   9.640  -8.337
  254    H    ALA  43           H        ALA  43  10.913   7.646  -6.623
  255    HA   ALA  43           HA       ALA  43  11.877   7.986  -3.998
  256    HB1  ALA  43           1HB      ALA  43   9.325   9.491  -4.566
  257    HB2  ALA  43           2HB      ALA  43  10.883  10.208  -4.157
  258    HB3  ALA  43           3HB      ALA  43  10.028   9.219  -2.973
  259    H    ALA  44           H        ALA  44   9.124   7.177  -6.039
  260    HA   ALA  44           HA       ALA  44   7.609   5.755  -4.166
  261    HB1  ALA  44           1HB      ALA  44   6.742   6.541  -6.328
  262    HB2  ALA  44           2HB      ALA  44   6.415   4.829  -6.058
  263    HB3  ALA  44           3HB      ALA  44   7.713   5.319  -7.148
  264    H    ALA  45           H        ALA  45   7.766   3.809  -3.304
  265    HA   ALA  45           HA       ALA  45   9.363   1.747  -4.642
  266    HB1  ALA  45           1HB      ALA  45  10.845   2.805  -3.003
  267    HB2  ALA  45           2HB      ALA  45  10.478   1.137  -2.561
  268    HB3  ALA  45           3HB      ALA  45   9.676   2.467  -1.727
  269    H    TYR  46           H        TYR  46   6.975   2.616  -2.206
  270    HA   TYR  46           HA       TYR  46   5.825  -0.084  -2.473
  271    HB2  TYR  46           2HB      TYR  46   5.962   1.658  -0.003
  272    HB3  TYR  46           1HB      TYR  46   4.957   0.219  -0.131
  273    HD1  TYR  46           2HD      TYR  46   8.425   1.452   0.038
  274    HD2  TYR  46           1HD      TYR  46   5.898  -1.967   0.050
  275    HE1  TYR  46           2HE      TYR  46  10.312   0.069   0.805
  276    HE2  TYR  46           1HE      TYR  46   7.771  -3.358   0.816
  277    HH   TYR  46           HH       TYR  46  10.094  -3.419   0.938
  278    H    GLY  47           H        GLY  47   3.736  -0.155  -3.069
  279    HA2  GLY  47           2HA      GLY  47   2.149   2.318  -2.802
  280    HA3  GLY  47           1HA      GLY  47   2.037   1.271  -4.213
  281    H    VAL  48           H        VAL  48   0.644   2.040  -1.320
  282    HA   VAL  48           HA       VAL  48  -0.370  -0.671  -0.839
  283    HB   VAL  48           HB       VAL  48  -0.654   1.781   0.910
  284   HG11  VAL  48          1HG1      VAL  48  -1.253  -1.134   1.439
  285   HG12  VAL  48          2HG1      VAL  48  -2.436   0.164   1.283
  286   HG13  VAL  48          3HG1      VAL  48  -1.316   0.150   2.646
  287   HG21  VAL  48          3HG2      VAL  48   1.048   0.747   2.330
  288   HG22  VAL  48          1HG2      VAL  48   1.686   1.087   0.721
  289   HG23  VAL  48          2HG2      VAL  48   1.235  -0.560   1.163
  290    H    LEU  49           H        LEU  49  -2.201  -1.143  -1.882
  291    HA   LEU  49           HA       LEU  49  -4.067   0.961  -2.567
  292    HB2  LEU  49           2HB      LEU  49  -5.319  -0.844  -3.730
  293    HB3  LEU  49           1HB      LEU  49  -3.673  -0.641  -4.290
  294    HG   LEU  49           HG       LEU  49  -3.356  -2.618  -2.437
  295   HD11  LEU  49          1HD1      LEU  49  -5.120  -4.251  -2.770
  296   HD12  LEU  49          2HD1      LEU  49  -6.010  -3.112  -3.780
  297   HD13  LEU  49          3HD1      LEU  49  -5.776  -2.774  -2.064
  298   HD21  LEU  49          3HD2      LEU  49  -2.431  -2.579  -4.686
  299   HD22  LEU  49          1HD2      LEU  49  -4.024  -2.923  -5.362
  300   HD23  LEU  49          2HD2      LEU  49  -3.212  -4.126  -4.360
  301    H    VAL  50           H        VAL  50  -5.594   1.588  -1.261
  302    HA   VAL  50           HA       VAL  50  -6.498  -0.248   0.859
  303    HB   VAL  50           HB       VAL  50  -6.538   2.775   0.824
  304   HG11  VAL  50          1HG1      VAL  50  -8.383   1.863   2.116
  305   HG12  VAL  50          2HG1      VAL  50  -7.179   2.580   3.186
  306   HG13  VAL  50          3HG1      VAL  50  -7.268   0.828   3.007
  307   HG21  VAL  50          3HG2      VAL  50  -4.270   1.894   1.033
  308   HG22  VAL  50          1HG2      VAL  50  -4.784   0.868   2.372
  309   HG23  VAL  50          2HG2      VAL  50  -4.802   2.622   2.549
  310    H    THR  51           H        THR  51  -8.424  -1.093   0.439
  311    HA   THR  51           HA       THR  51 -10.316   0.393  -1.220
  312    HB   THR  51           HB       THR  51 -10.567  -2.436  -0.191
  313    HG1  THR  51           1HG      THR  51  -8.720  -1.720  -1.739
  314   HG21  THR  51          3HG2      THR  51 -11.911  -1.001  -2.487
  315   HG22  THR  51          1HG2      THR  51 -12.665  -1.403  -0.943
  316   HG23  THR  51          2HG2      THR  51 -12.156  -2.689  -2.038
  317    H    ARG  52           H        ARG  52 -11.413   1.831  -0.017
  318    HA   ARG  52           HA       ARG  52 -12.231   1.425   2.678
  319    HB2  ARG  52           2HB      ARG  52 -12.535   3.467   0.629
  320    HB3  ARG  52           1HB      ARG  52 -14.019   3.244   1.538
  321    HG2  ARG  52           2HG      ARG  52 -12.780   4.982   2.564
  322    HG3  ARG  52           1HG      ARG  52 -12.713   3.579   3.627
  323    HD2  ARG  52           2HD      ARG  52 -10.476   3.057   2.793
  324    HD3  ARG  52           1HD      ARG  52 -10.550   4.454   1.715
  325    HE   ARG  52           HE       ARG  52 -10.963   5.056   4.517
  326   HH11  ARG  52          1HH1      ARG  52  -8.597   4.769   1.944
  327   HH12  ARG  52          2HH1      ARG  52  -7.448   5.805   2.722
  328   HH21  ARG  52          1HH2      ARG  52  -9.463   6.393   5.538
  329   HH22  ARG  52          2HH2      ARG  52  -7.938   6.741   4.770
  330    HA   PRO  53           HA       PRO  53 -15.577  -1.408   2.070
  331    HB2  PRO  53           2HB      PRO  53 -17.170  -0.623   4.183
  332    HB3  PRO  53           1HB      PRO  53 -15.786  -1.710   4.314
  333    HG2  PRO  53           2HG      PRO  53 -15.956   1.218   4.881
  334    HG3  PRO  53           1HG      PRO  53 -15.097  -0.053   5.773
  335    HD2  PRO  53           2HD      PRO  53 -13.803   1.627   4.132
  336    HD3  PRO  53           1HD      PRO  53 -13.325  -0.077   4.279
  337    H    ASP  54           H        ASP  54 -15.920   1.953   1.840
  338    HA   ASP  54           HA       ASP  54 -18.705   2.068   1.205
  339    HB2  ASP  54           2HB      ASP  54 -16.448   3.981   0.557
  340    HB3  ASP  54           1HB      ASP  54 -18.152   4.315   0.277
  341    H    GLY  55           H        GLY  55 -15.958   0.927  -0.444
  342    HA2  GLY  55           2HA      GLY  55 -16.201  -0.289  -2.483
  343    HA3  GLY  55           1HA      GLY  55 -17.556   0.747  -2.904
  344    H    THR  56           H        THR  56 -14.446   1.908  -1.723
  345    HA   THR  56           HA       THR  56 -13.867   2.908  -4.420
  346    HB   THR  56           HB       THR  56 -14.873   4.779  -3.270
  347    HG1  THR  56           1HG      THR  56 -13.386   6.020  -4.090
  348   HG21  THR  56          3HG2      THR  56 -13.920   5.707  -1.207
  349   HG22  THR  56          1HG2      THR  56 -12.800   4.349  -1.117
  350   HG23  THR  56          2HG2      THR  56 -14.535   4.071  -0.962
  351    H    ARG  57           H        ARG  57 -11.728   3.039  -4.976
  352    HA   ARG  57           HA       ARG  57  -9.844   1.792  -3.091
  353    HB2  ARG  57           2HB      ARG  57 -10.130   0.396  -5.004
  354    HB3  ARG  57           1HB      ARG  57  -9.975   1.758  -6.102
  355    HG2  ARG  57           2HG      ARG  57  -7.617   2.003  -5.424
  356    HG3  ARG  57           1HG      ARG  57  -7.788   0.572  -4.407
  357    HD2  ARG  57           2HD      ARG  57  -8.118  -0.837  -6.261
  358    HD3  ARG  57           1HD      ARG  57  -8.417   0.523  -7.343
  359    HE   ARG  57           HE       ARG  57  -5.843   0.867  -6.434
  360   HH11  ARG  57          1HH1      ARG  57  -7.578  -1.669  -8.113
  361   HH12  ARG  57          2HH1      ARG  57  -6.196  -2.166  -9.056
  362   HH21  ARG  57          1HH2      ARG  57  -4.015   0.230  -7.688
  363   HH22  ARG  57          2HH2      ARG  57  -4.182  -1.102  -8.793
  364    H    VAL  58           H        VAL  58  -8.319   3.040  -2.297
  365    HA   VAL  58           HA       VAL  58  -7.249   5.202  -3.980
  366    HB   VAL  58           HB       VAL  58  -8.637   6.171  -2.191
  367   HG11  VAL  58          1HG1      VAL  58  -8.018   5.965   0.153
  368   HG12  VAL  58          2HG1      VAL  58  -6.730   4.840  -0.276
  369   HG13  VAL  58          3HG1      VAL  58  -8.416   4.389  -0.533
  370   HG21  VAL  58          3HG2      VAL  58  -6.977   7.710  -1.262
  371   HG22  VAL  58          1HG2      VAL  58  -6.718   7.426  -2.983
  372   HG23  VAL  58          2HG2      VAL  58  -5.688   6.628  -1.793
  373    H    GLU  59           H        GLU  59  -4.992   5.383  -3.990
  374    HA   GLU  59           HA       GLU  59  -3.651   3.176  -2.587
  375    HB2  GLU  59           2HB      GLU  59  -1.922   3.280  -4.329
  376    HB3  GLU  59           1HB      GLU  59  -3.512   2.945  -4.995
  377    HG2  GLU  59           2HG      GLU  59  -3.712   5.274  -5.701
  378    HG3  GLU  59           1HG      GLU  59  -2.117   5.613  -5.029
  379    H    VAL  60           H        VAL  60  -1.998   3.538  -1.280
  380    HA   VAL  60           HA       VAL  60  -1.225   6.338  -0.813
  381    HB   VAL  60           HB       VAL  60  -0.804   3.982   1.038
  382   HG11  VAL  60          1HG1      VAL  60  -0.666   6.951   1.528
  383   HG12  VAL  60          2HG1      VAL  60   0.711   5.855   1.404
  384   HG13  VAL  60          3HG1      VAL  60  -0.431   5.690   2.738
  385   HG21  VAL  60          3HG2      VAL  60  -3.192   4.311   0.716
  386   HG22  VAL  60          1HG2      VAL  60  -3.020   6.028   1.079
  387   HG23  VAL  60          2HG2      VAL  60  -2.710   4.828   2.333
  388    H    HIS  61           H        HIS  61   0.686   6.918  -1.565
  389    HA   HIS  61           HA       HIS  61   2.565   4.865  -2.421
  390    HB2  HIS  61           2HB      HIS  61   2.247   7.783  -2.958
  391    HB3  HIS  61           1HB      HIS  61   3.802   7.014  -3.258
  392    HD1  HIS  61           1HD      HIS  61   0.626   7.678  -4.862
  393    HD2  HIS  61           2HD      HIS  61   3.495   4.677  -5.038
  394    HE1  HIS  61           1HE      HIS  61   0.247   6.497  -7.051
  395    HE2  HIS  61           2HE      HIS  61   1.802   4.510  -6.972
  396    H    LEU  62           H        LEU  62   4.276   4.289  -1.354
  397    HA   LEU  62           HA       LEU  62   5.288   6.005   0.831
  398    HB2  LEU  62           2HB      LEU  62   4.859   3.058   0.587
  399    HB3  LEU  62           1HB      LEU  62   6.206   3.619   1.551
  400    HG   LEU  62           HG       LEU  62   4.858   4.395   3.240
  401   HD11  LEU  62          1HD1      LEU  62   2.537   5.101   2.997
  402   HD12  LEU  62          2HD1      LEU  62   2.588   4.699   1.280
  403   HD13  LEU  62          3HD1      LEU  62   3.590   6.007   1.911
  404   HD21  LEU  62          3HD2      LEU  62   3.018   2.831   3.591
  405   HD22  LEU  62          1HD2      LEU  62   4.475   2.018   3.018
  406   HD23  LEU  62          2HD2      LEU  62   3.140   2.325   1.906
  407    H    ASP  63           H        ASP  63   7.549   6.207   1.030
  408    HA   ASP  63           HA       ASP  63   9.018   5.531  -1.398
  409    HB2  ASP  63           2HB      ASP  63  10.650   7.113  -0.763
  410    HB3  ASP  63           1HB      ASP  63   9.117   7.840  -0.317
  411    H    ARG  64           H        ARG  64  11.591   5.364  -0.396
  412    HA   ARG  64           HA       ARG  64  11.863   2.631  -0.008
  413    HB2  ARG  64           2HB      ARG  64  13.845   4.727   0.874
  414    HB3  ARG  64           1HB      ARG  64  14.187   3.056   0.455
  415    HG2  ARG  64           2HG      ARG  64  13.597   3.486  -1.857
  416    HG3  ARG  64           1HG      ARG  64  13.175   5.152  -1.452
  417    HD2  ARG  64           2HD      ARG  64  15.891   3.859  -1.314
  418    HD3  ARG  64           1HD      ARG  64  15.375   5.163  -2.382
  419    HE   ARG  64           HE       ARG  64  14.972   6.231   0.057
  420   HH11  ARG  64          1HH1      ARG  64  17.730   4.575  -1.332
  421   HH12  ARG  64          2HH1      ARG  64  18.892   5.466  -0.398
  422   HH21  ARG  64          1HH2      ARG  64  16.488   7.360   1.314
  423   HH22  ARG  64          2HH2      ARG  64  18.183   7.023   1.139
  424    H    ASP  65           H        ASP  65  11.675   5.228   2.386
  425    HA   ASP  65           HA       ASP  65  12.341   3.382   4.542
  426    HB2  ASP  65           2HB      ASP  65  11.841   6.347   4.450
  427    HB3  ASP  65           1HB      ASP  65  11.989   5.475   5.971
  428    H    PHE  66           H        PHE  66   9.716   3.469   2.913
  429    HA   PHE  66           HA       PHE  66   7.561   2.861   3.293
  430    HB2  PHE  66           2HB      PHE  66   8.995   1.806   5.463
  431    HB3  PHE  66           1HB      PHE  66   7.574   2.566   6.172
  432    HD1  PHE  66           2HD      PHE  66   5.304   1.901   5.308
  433    HD2  PHE  66           1HD      PHE  66   8.846  -0.257   4.380
  434    HE1  PHE  66           2HE      PHE  66   3.946  -0.052   4.676
  435    HE2  PHE  66           1HE      PHE  66   7.504  -2.212   3.752
  436    HZ   PHE  66           HZ       PHE  66   5.044  -2.110   3.896
  437    H    ARG  67           H        ARG  67   8.578   5.663   3.705
  438    HA   ARG  67           HA       ARG  67   6.680   6.765   5.607
  439    HB2  ARG  67           2HB      ARG  67   8.897   7.736   5.554
  440    HB3  ARG  67           1HB      ARG  67   8.763   8.045   3.830
  441    HG2  ARG  67           2HG      ARG  67   8.455  10.103   4.972
  442    HG3  ARG  67           1HG      ARG  67   6.890   9.605   4.330
  443    HD2  ARG  67           2HD      ARG  67   6.256   8.744   6.524
  444    HD3  ARG  67           1HD      ARG  67   7.827   9.219   7.171
  445    HE   ARG  67           HE       ARG  67   5.879  11.168   6.097
  446   HH11  ARG  67          1HH1      ARG  67   8.245  10.188   8.498
  447   HH12  ARG  67          2HH1      ARG  67   8.070  11.646   9.433
  448   HH21  ARG  67          1HH2      ARG  67   5.658  13.068   7.330
  449   HH22  ARG  67          2HH2      ARG  67   6.611  13.271   8.771
  450    H    VAL  68           H        VAL  68   4.800   7.701   5.088
  451    HA   VAL  68           HA       VAL  68   3.630   7.364   2.572
  452    HB   VAL  68           HB       VAL  68   2.229   7.561   4.506
  453   HG11  VAL  68          1HG1      VAL  68   3.560   9.008   5.900
  454   HG12  VAL  68          2HG1      VAL  68   1.944   9.689   5.717
  455   HG13  VAL  68          3HG1      VAL  68   3.293  10.364   4.805
  456   HG21  VAL  68          3HG2      VAL  68   1.232   8.284   2.416
  457   HG22  VAL  68          1HG2      VAL  68   1.822   9.926   2.677
  458   HG23  VAL  68          2HG2      VAL  68   0.603   9.244   3.755
  459    H    LEU  69           H        LEU  69   4.127   8.326   0.755
  460    HA   LEU  69           HA       LEU  69   5.370  10.941   0.701
  461    HB2  LEU  69           2HB      LEU  69   4.484   9.142  -1.563
  462    HB3  LEU  69           1HB      LEU  69   5.450  10.594  -1.733
  463    HG   LEU  69           HG       LEU  69   6.292   8.062  -0.325
  464   HD11  LEU  69          1HD1      LEU  69   7.862   7.834  -2.172
  465   HD12  LEU  69          2HD1      LEU  69   7.203   9.288  -2.923
  466   HD13  LEU  69          3HD1      LEU  69   6.197   7.850  -2.755
  467   HD21  LEU  69          3HD2      LEU  69   8.475   9.131  -0.132
  468   HD22  LEU  69          1HD2      LEU  69   7.241  10.059   0.720
  469   HD23  LEU  69          2HD2      LEU  69   7.827  10.605  -0.852
  470    H    ASP  70           H        ASP  70   2.396   9.423  -0.470
  471    HA   ASP  70           HA       ASP  70   0.784  11.673   0.098
  472    HB2  ASP  70           2HB      ASP  70   2.115  12.252  -2.120
  473    HB3  ASP  70           1HB      ASP  70   0.905  11.207  -2.860
  474    H    THR  71           H        THR  71  -1.416  11.289  -1.311
  475    HA   THR  71           HA       THR  71  -1.950   8.428  -1.514
  476    HB   THR  71           HB       THR  71  -3.594  10.197   0.314
  477    HG1  THR  71           1HG      THR  71  -1.361   8.575   0.778
  478   HG21  THR  71          3HG2      THR  71  -4.850   8.361  -0.675
  479   HG22  THR  71          1HG2      THR  71  -4.580   8.066   1.042
  480   HG23  THR  71          2HG2      THR  71  -3.611   7.216  -0.162
  481    H    GLU  72           H        GLU  72  -2.766   8.359  -3.524
  482    HA   GLU  72           HA       GLU  72  -4.818  10.347  -4.230
  483    HB2  GLU  72           2HB      GLU  72  -4.088  10.004  -6.619
  484    HB3  GLU  72           1HB      GLU  72  -2.948  10.855  -5.592
  485    HG2  GLU  72           2HG      GLU  72  -2.667   7.910  -5.962
  486    HG3  GLU  72           1HG      GLU  72  -2.143   9.003  -7.240
  487    HA   PRO  73           HA       PRO  73  -7.651   7.039  -4.866
  488    HB2  PRO  73           2HB      PRO  73  -8.733   8.558  -7.153
  489    HB3  PRO  73           1HB      PRO  73  -9.528   8.071  -5.654
  490    HG2  PRO  73           2HG      PRO  73  -8.862  10.626  -6.113
  491    HG3  PRO  73           1HG      PRO  73  -8.763   9.916  -4.490
  492    HD2  PRO  73           2HD      PRO  73  -6.576  10.459  -6.461
  493    HD3  PRO  73           1HD      PRO  73  -6.588  10.687  -4.699
  494    H    ALA  74           H        ALA  74  -7.542   5.171  -5.941
  495    HA   ALA  74           HA       ALA  74  -6.112   5.154  -8.513
  496    HB1  ALA  74           1HB      ALA  74  -4.981   3.935  -6.722
  497    HB2  ALA  74           2HB      ALA  74  -5.511   2.845  -8.003
  498    HB3  ALA  74           3HB      ALA  74  -6.415   2.935  -6.491
  499    H    ASP  75           H        ASP  75  -7.687   5.295 -10.012
  500    HA   ASP  75           HA       ASP  75 -10.106   3.716  -9.734
  501    HB2  ASP  75           2HB      ASP  75 -10.271   6.022 -10.586
  502    HB3  ASP  75           1HB      ASP  75  -9.241   5.592 -11.949
  503    H    GLY  76           H        GLY  76 -10.607   1.937 -10.891
  504    HA2  GLY  76           2HA      GLY  76  -8.454   0.412 -11.949
  505    HA3  GLY  76           1HA      GLY  76 -10.150  -0.044 -11.952
  506    H    ASP  77           H        ASP  77 -10.847   2.485 -13.424
  507    HA   ASP  77           HA       ASP  77 -10.376   1.408 -16.070
  508    HB2  ASP  77           2HB      ASP  77 -12.587   2.324 -15.436
  509    HB3  ASP  77           1HB      ASP  77 -11.856   3.912 -15.224
  510    H    GLY  78           H        GLY  78  -9.971   4.650 -14.632
  511    HA2  GLY  78           2HA      GLY  78  -8.168   6.073 -14.647
  512    HA3  GLY  78           1HA      GLY  78  -7.205   4.767 -15.306
  513    H    GLY  79           H        GLY  79  -8.941   4.490 -17.687
  514    HA2  GLY  79           2HA      GLY  79  -7.312   6.020 -19.379
  515    HA3  GLY  79           1HA      GLY  79  -8.736   5.125 -19.871
  516    H    LEU  80           H        LEU  80  -7.457   7.936 -20.270
  517    HA   LEU  80           HA       LEU  80 -10.024   9.375 -20.157
  518    HB2  LEU  80           2HB      LEU  80  -7.225  10.449 -19.793
  519    HB3  LEU  80           1HB      LEU  80  -8.622  11.472 -20.060
  520    HG   LEU  80           HG       LEU  80  -8.255   9.621 -17.701
  521   HD11  LEU  80          1HD1      LEU  80  -7.940  11.670 -16.410
  522   HD12  LEU  80          2HD1      LEU  80  -8.023  12.621 -17.894
  523   HD13  LEU  80          3HD1      LEU  80  -6.693  11.489 -17.644
  524   HD21  LEU  80          3HD2      LEU  80 -10.369  11.695 -18.282
  525   HD22  LEU  80          1HD2      LEU  80 -10.208  10.769 -16.790
  526   HD23  LEU  80          2HD2      LEU  80 -10.600   9.947 -18.300
  527    H    GLU  81           H        GLU  81 -10.787   9.951 -22.084
  528    HA   GLU  81           HA       GLU  81  -8.876  10.344 -24.282
  529    HB2  GLU  81           2HB      GLU  81 -11.517   8.875 -24.418
  530    HB3  GLU  81           1HB      GLU  81 -10.564   9.331 -25.824
  531    HG2  GLU  81           2HG      GLU  81  -8.722   7.943 -25.032
  532    HG3  GLU  81           1HG      GLU  81  -9.666   7.494 -23.614
  Start of MODEL    6
    1    H1   GLY   1           1HT      GLY   1  14.724   0.633  14.041
    2    H2   GLY   1           2HT      GLY   1  14.947   2.315  14.131
    3    H3   GLY   1           3HT      GLY   1  13.867   1.661  12.998
    4    HA2  GLY   1           1HA      GLY   1  13.556   1.541  15.945
    5    HA3  GLY   1           2HA      GLY   1  12.681   2.623  14.869
    6    H    ALA   2           H        ALA   2  10.625   1.925  14.814
    7    HA   ALA   2           HA       ALA   2  10.111  -0.953  14.720
    8    HB1  ALA   2           1HB      ALA   2   8.168   1.330  15.083
    9    HB2  ALA   2           2HB      ALA   2   8.876   0.370  16.381
   10    HB3  ALA   2           3HB      ALA   2   7.795  -0.389  15.213
   11    H    MET   3           H        MET   3  10.718  -1.363  12.587
   12    HA   MET   3           HA       MET   3   9.355   0.082  10.460
   13    HB2  MET   3           2HB      MET   3  10.811  -1.123   8.934
   14    HB3  MET   3           1HB      MET   3  11.764  -0.406  10.223
   15    HG2  MET   3           2HG      MET   3  10.908  -3.291  10.153
   16    HG3  MET   3           1HG      MET   3  12.461  -2.700   9.570
   17    HE1  MET   3           3HE      MET   3  13.686  -4.449  11.120
   18    HE2  MET   3           1HE      MET   3  12.148  -5.036  11.753
   19    HE3  MET   3           2HE      MET   3  13.440  -4.571  12.861
   20    H    ALA   4           H        ALA   4   7.813  -0.772   9.153
   21    HA   ALA   4           HA       ALA   4   6.510  -3.180  10.131
   22    HB1  ALA   4           1HB      ALA   4   5.635  -1.206   8.023
   23    HB2  ALA   4           2HB      ALA   4   5.132  -1.215   9.714
   24    HB3  ALA   4           3HB      ALA   4   4.665  -2.540   8.647
   25    H    PHE   5           H        PHE   5   8.258  -4.581   9.386
   26    HA   PHE   5           HA       PHE   5   7.787  -5.367   6.591
   27    HB2  PHE   5           2HB      PHE   5  10.451  -5.185   8.008
   28    HB3  PHE   5           1HB      PHE   5  10.216  -6.097   6.522
   29    HD1  PHE   5           2HD      PHE   5   9.768  -4.958   4.424
   30    HD2  PHE   5           1HD      PHE   5  10.506  -2.791   8.007
   31    HE1  PHE   5           2HE      PHE   5  10.174  -2.928   3.102
   32    HE2  PHE   5           1HE      PHE   5  10.915  -0.752   6.692
   33    HZ   PHE   5           HZ       PHE   5  10.751  -0.820   4.236
   34    H    ASP   6           H        ASP   6   6.274  -6.540   8.323
   35    HA   ASP   6           HA       ASP   6   6.762  -9.252   8.113
   36    HB2  ASP   6           2HB      ASP   6   8.565  -8.936   9.754
   37    HB3  ASP   6           1HB      ASP   6   7.428  -8.192  10.872
   38    H    GLY   7           H        GLY   7   4.589  -9.215   7.556
   39    HA2  GLY   7           2HA      GLY   7   2.673  -8.501   9.660
   40    HA3  GLY   7           1HA      GLY   7   2.284  -8.905   7.989
   41    H    GLU   8           H        GLU   8   2.408 -11.105   7.321
   42    HA   GLU   8           HA       GLU   8   2.813 -13.124   9.373
   43    HB2  GLU   8           2HB      GLU   8   0.195 -12.770   7.922
   44    HB3  GLU   8           1HB      GLU   8   0.692 -14.332   8.560
   45    HG2  GLU   8           2HG      GLU   8   0.918 -13.261  10.801
   46    HG3  GLU   8           1HG      GLU   8   0.215 -11.801  10.113
   47    H    ASP   9           H        ASP   9   3.679 -14.962   8.589
   48    HA   ASP   9           HA       ASP   9   4.931 -14.671   6.028
   49    HB2  ASP   9           2HB      ASP   9   5.971 -15.562   8.182
   50    HB3  ASP   9           1HB      ASP   9   5.108 -17.061   7.859
   51    H    GLU  10           H        GLU  10   1.935 -15.637   6.619
   52    HA   GLU  10           HA       GLU  10   1.824 -18.208   5.375
   53    HB2  GLU  10           2HB      GLU  10  -0.569 -18.005   5.571
   54    HB3  GLU  10           1HB      GLU  10   0.175 -17.419   7.052
   55    HG2  GLU  10           2HG      GLU  10  -0.114 -15.113   6.277
   56    HG3  GLU  10           1HG      GLU  10  -0.887 -15.714   4.811
   57    H    VAL  11           H        VAL  11   2.018 -15.035   4.156
   58    HA   VAL  11           HA       VAL  11   0.594 -15.672   1.692
   59    HB   VAL  11           HB       VAL  11   0.979 -13.322   1.071
   60   HG11  VAL  11          1HG1      VAL  11  -0.166 -13.700   3.836
   61   HG12  VAL  11          2HG1      VAL  11  -1.027 -13.890   2.308
   62   HG13  VAL  11          3HG1      VAL  11  -0.442 -12.301   2.800
   63   HG21  VAL  11          3HG2      VAL  11   2.348 -13.119   3.754
   64   HG22  VAL  11          1HG2      VAL  11   1.944 -11.761   2.702
   65   HG23  VAL  11          2HG2      VAL  11   3.118 -12.966   2.175
   66    H    THR  12           H        THR  12   1.618 -15.131  -0.400
   67    HA   THR  12           HA       THR  12   4.401 -16.045  -0.419
   68    HB   THR  12           HB       THR  12   3.918 -16.343  -2.923
   69    HG1  THR  12           1HG      THR  12   2.003 -15.104  -3.038
   70   HG21  THR  12          3HG2      THR  12   4.062 -18.230  -1.392
   71   HG22  THR  12          1HG2      THR  12   2.747 -18.482  -2.539
   72   HG23  THR  12          2HG2      THR  12   2.392 -17.974  -0.887
   73    H    GLY  13           H        GLY  13   2.829 -13.186  -0.434
   74    HA2  GLY  13           2HA      GLY  13   4.731 -11.937  -2.308
   75    HA3  GLY  13           1HA      GLY  13   3.182 -11.242  -1.842
   76    HA   PRO  14           HA       PRO  14   6.666 -10.758   1.612
   77    HB2  PRO  14           2HB      PRO  14   8.808  -9.515   0.408
   78    HB3  PRO  14           1HB      PRO  14   8.727 -11.244   0.761
   79    HG2  PRO  14           2HG      PRO  14   8.218  -9.805  -1.805
   80    HG3  PRO  14           1HG      PRO  14   9.047 -11.348  -1.530
   81    HD2  PRO  14           2HD      PRO  14   6.517 -11.228  -2.444
   82    HD3  PRO  14           1HD      PRO  14   7.067 -12.526  -1.364
   83    H    ASP  15           H        ASP  15   6.688  -8.561  -1.186
   84    HA   ASP  15           HA       ASP  15   6.703  -6.199   0.410
   85    HB2  ASP  15           2HB      ASP  15   6.364  -5.017  -1.720
   86    HB3  ASP  15           1HB      ASP  15   7.644  -6.217  -1.852
   87    H    ALA  16           H        ALA  16   4.244  -8.114  -1.185
   88    HA   ALA  16           HA       ALA  16   2.059  -6.385  -0.860
   89    HB1  ALA  16           1HB      ALA  16   0.665  -8.364  -1.163
   90    HB2  ALA  16           2HB      ALA  16   2.064  -9.403  -0.894
   91    HB3  ALA  16           3HB      ALA  16   2.004  -8.356  -2.312
   92    H    ASP  17           H        ASP  17   3.388  -8.891   1.256
   93    HA   ASP  17           HA       ASP  17   1.438  -8.906   3.237
   94    HB2  ASP  17           2HB      ASP  17   3.077 -10.603   3.320
   95    HB3  ASP  17           1HB      ASP  17   4.400  -9.442   3.320
   96    H    ARG  18           H        ARG  18   4.408  -6.965   3.090
   97    HA   ARG  18           HA       ARG  18   4.229  -5.877   5.646
   98    HB2  ARG  18           2HB      ARG  18   5.371  -4.274   3.390
   99    HB3  ARG  18           1HB      ARG  18   5.935  -4.411   5.044
  100    HG2  ARG  18           2HG      ARG  18   6.197  -6.468   2.870
  101    HG3  ARG  18           1HG      ARG  18   7.484  -5.486   3.568
  102    HD2  ARG  18           2HD      ARG  18   7.002  -6.586   5.766
  103    HD3  ARG  18           1HD      ARG  18   5.901  -7.670   4.910
  104    HE   ARG  18           HE       ARG  18   8.736  -7.459   4.127
  105   HH11  ARG  18          1HH1      ARG  18   6.002  -9.396   5.213
  106   HH12  ARG  18          2HH1      ARG  18   6.825 -10.906   4.919
  107   HH21  ARG  18          1HH2      ARG  18   9.783  -9.429   3.765
  108   HH22  ARG  18          2HH2      ARG  18   8.985 -10.928   4.139
  109    H    ALA  19           H        ALA  19   3.130  -4.508   2.558
  110    HA   ALA  19           HA       ALA  19   2.174  -2.116   3.829
  111    HB1  ALA  19           1HB      ALA  19   3.128  -2.044   1.592
  112    HB2  ALA  19           2HB      ALA  19   1.466  -1.453   1.591
  113    HB3  ALA  19           3HB      ALA  19   1.828  -3.074   0.996
  114    H    ARG  20           H        ARG  20   0.733  -5.126   2.695
  115    HA   ARG  20           HA       ARG  20  -1.953  -4.173   2.739
  116    HB2  ARG  20           2HB      ARG  20  -1.164  -6.205   1.490
  117    HB3  ARG  20           1HB      ARG  20  -1.028  -7.037   3.032
  118    HG2  ARG  20           2HG      ARG  20  -3.423  -6.764   3.402
  119    HG3  ARG  20           1HG      ARG  20  -3.561  -5.896   1.871
  120    HD2  ARG  20           2HD      ARG  20  -2.635  -7.940   0.747
  121    HD3  ARG  20           1HD      ARG  20  -2.786  -8.773   2.293
  122    HE   ARG  20           HE       ARG  20  -5.245  -7.560   1.545
  123   HH11  ARG  20          1HH1      ARG  20  -3.185 -10.297   0.831
  124   HH12  ARG  20          2HH1      ARG  20  -4.488 -11.303   0.280
  125   HH21  ARG  20          1HH2      ARG  20  -6.967  -8.884   0.836
  126   HH22  ARG  20          2HH2      ARG  20  -6.639 -10.502   0.302
  127    H    ALA  21           H        ALA  21   0.167  -5.704   5.093
  128    HA   ALA  21           HA       ALA  21  -1.761  -6.074   7.122
  129    HB1  ALA  21           1HB      ALA  21   0.440  -7.156   7.163
  130    HB2  ALA  21           2HB      ALA  21   0.125  -6.257   8.647
  131    HB3  ALA  21           3HB      ALA  21   1.201  -5.585   7.422
  132    H    ALA  22           H        ALA  22   0.278  -3.351   6.225
  133    HA   ALA  22           HA       ALA  22  -0.470  -1.707   8.439
  134    HB1  ALA  22           1HB      ALA  22   1.626  -1.369   7.224
  135    HB2  ALA  22           2HB      ALA  22   0.637   0.092   7.210
  136    HB3  ALA  22           3HB      ALA  22   0.719  -0.933   5.777
  137    H    ALA  23           H        ALA  23  -1.698  -2.261   5.217
  138    HA   ALA  23           HA       ALA  23  -3.333  -0.063   4.836
  139    HB1  ALA  23           1HB      ALA  23  -2.827  -1.761   3.128
  140    HB2  ALA  23           2HB      ALA  23  -4.555  -1.430   3.257
  141    HB3  ALA  23           3HB      ALA  23  -3.882  -2.895   3.971
  142    H    VAL  24           H        VAL  24  -3.852  -2.903   6.807
  143    HA   VAL  24           HA       VAL  24  -6.601  -2.751   7.204
  144    HB   VAL  24           HB       VAL  24  -4.529  -3.612   9.233
  145   HG11  VAL  24          1HG1      VAL  24  -7.456  -4.298   8.992
  146   HG12  VAL  24          2HG1      VAL  24  -6.714  -3.301  10.242
  147   HG13  VAL  24          3HG1      VAL  24  -6.328  -5.019  10.141
  148   HG21  VAL  24          3HG2      VAL  24  -4.895  -5.872   8.349
  149   HG22  VAL  24          1HG2      VAL  24  -4.234  -4.785   7.128
  150   HG23  VAL  24          2HG2      VAL  24  -5.948  -5.205   7.101
  151    H    GLN  25           H        GLN  25  -4.016  -0.872   8.614
  152    HA   GLN  25           HA       GLN  25  -5.862   0.434  10.467
  153    HB2  GLN  25           2HB      GLN  25  -2.868   0.617  10.116
  154    HB3  GLN  25           1HB      GLN  25  -3.766   1.657  11.208
  155    HG2  GLN  25           2HG      GLN  25  -2.895  -0.052  12.540
  156    HG3  GLN  25           1HG      GLN  25  -4.598  -0.448  12.327
  157   HE21  GLN  25          1HE2      GLN  25  -2.133  -0.941   9.884
  158   HE22  GLN  25          2HE2      GLN  25  -2.181  -2.672   9.913
  159    H    ALA  26           H        ALA  26  -4.686   0.824   7.344
  160    HA   ALA  26           HA       ALA  26  -4.633   3.722   7.371
  161    HB1  ALA  26           1HB      ALA  26  -4.310   1.798   5.072
  162    HB2  ALA  26           2HB      ALA  26  -3.003   2.501   6.024
  163    HB3  ALA  26           3HB      ALA  26  -4.016   3.537   5.019
  164    H    VAL  27           H        VAL  27  -6.797   1.148   6.430
  165    HA   VAL  27           HA       VAL  27  -8.693   3.172   5.459
  166    HB   VAL  27           HB       VAL  27  -8.146   1.491   3.764
  167   HG11  VAL  27          1HG1      VAL  27  -7.590  -0.375   5.235
  168   HG12  VAL  27          2HG1      VAL  27  -8.780  -0.840   4.019
  169   HG13  VAL  27          3HG1      VAL  27  -9.292  -0.532   5.678
  170   HG21  VAL  27          3HG2      VAL  27 -10.425   0.814   3.188
  171   HG22  VAL  27          1HG2      VAL  27 -10.362   2.486   3.747
  172   HG23  VAL  27          2HG2      VAL  27 -10.954   1.220   4.821
  173    HA   PRO  28           HA       PRO  28 -10.913   2.345   9.209
  174    HB2  PRO  28           2HB      PRO  28 -13.124   3.883   8.127
  175    HB3  PRO  28           1HB      PRO  28 -12.009   4.309   9.426
  176    HG2  PRO  28           2HG      PRO  28 -12.046   5.534   6.979
  177    HG3  PRO  28           1HG      PRO  28 -10.617   5.450   8.024
  178    HD2  PRO  28           2HD      PRO  28 -11.303   3.845   5.605
  179    HD3  PRO  28           1HD      PRO  28  -9.724   4.438   6.158
  180    H    GLY  29           H        GLY  29 -11.321   0.129   8.870
  181    HA2  GLY  29           2HA      GLY  29 -12.767  -1.655   8.799
  182    HA3  GLY  29           1HA      GLY  29 -14.076  -0.492   8.658
  183    H    GLY  30           H        GLY  30 -11.548  -0.405   6.315
  184    HA2  GLY  30           2HA      GLY  30 -13.496  -1.232   4.291
  185    HA3  GLY  30           1HA      GLY  30 -12.023  -0.321   3.996
  186    H    THR  31           H        THR  31 -11.775  -1.902   2.249
  187    HA   THR  31           HA       THR  31 -10.840  -4.517   3.196
  188    HB   THR  31           HB       THR  31 -12.548  -4.749   1.527
  189    HG1  THR  31           1HG      THR  31 -10.445  -6.009   1.387
  190   HG21  THR  31          3HG2      THR  31 -12.338  -3.830  -0.729
  191   HG22  THR  31          1HG2      THR  31 -10.853  -3.003  -0.260
  192   HG23  THR  31          2HG2      THR  31 -12.388  -2.548   0.480
  193    H    ALA  32           H        ALA  32  -8.797  -5.180   2.889
  194    HA   ALA  32           HA       ALA  32  -6.908  -3.168   1.870
  195    HB1  ALA  32           1HB      ALA  32  -6.442  -5.440   3.805
  196    HB2  ALA  32           2HB      ALA  32  -6.599  -3.734   4.225
  197    HB3  ALA  32           3HB      ALA  32  -5.225  -4.285   3.265
  198    H    GLY  33           H        GLY  33  -6.296  -3.578  -0.140
  199    HA2  GLY  33           2HA      GLY  33  -6.363  -6.303  -1.165
  200    HA3  GLY  33           1HA      GLY  33  -6.093  -4.841  -2.100
  201    H    GLU  34           H        GLU  34  -4.578  -7.182  -2.399
  202    HA   GLU  34           HA       GLU  34  -2.089  -6.876  -1.016
  203    HB2  GLU  34           2HB      GLU  34  -1.292  -8.554  -2.749
  204    HB3  GLU  34           1HB      GLU  34  -2.591  -9.077  -1.687
  205    HG2  GLU  34           2HG      GLU  34  -4.196  -8.469  -3.511
  206    HG3  GLU  34           1HG      GLU  34  -2.799  -8.222  -4.560
  207    H    VAL  35           H        VAL  35  -0.149  -6.076  -1.826
  208    HA   VAL  35           HA       VAL  35  -0.563  -4.032  -3.904
  209    HB   VAL  35           HB       VAL  35   0.856  -2.534  -2.677
  210   HG11  VAL  35          1HG1      VAL  35  -1.169  -3.826  -0.855
  211   HG12  VAL  35          2HG1      VAL  35  -1.464  -2.519  -2.002
  212   HG13  VAL  35          3HG1      VAL  35  -0.437  -2.243  -0.595
  213   HG21  VAL  35          3HG2      VAL  35   2.465  -4.121  -1.799
  214   HG22  VAL  35          1HG2      VAL  35   1.247  -4.786  -0.712
  215   HG23  VAL  35          2HG2      VAL  35   1.813  -3.131  -0.494
  216    H    GLU  36           H        GLU  36   1.239  -3.406  -5.173
  217    HA   GLU  36           HA       GLU  36   3.510  -5.278  -5.123
  218    HB2  GLU  36           2HB      GLU  36   3.846  -4.877  -7.472
  219    HB3  GLU  36           1HB      GLU  36   2.163  -5.320  -7.231
  220    HG2  GLU  36           2HG      GLU  36   1.440  -3.082  -7.529
  221    HG3  GLU  36           1HG      GLU  36   3.092  -2.470  -7.457
  222    H    THR  37           H        THR  37   5.618  -4.349  -5.508
  223    HA   THR  37           HA       THR  37   6.005  -1.777  -4.335
  224    HB   THR  37           HB       THR  37   8.407  -2.134  -5.166
  225    HG1  THR  37           1HG      THR  37   7.592  -3.762  -6.769
  226   HG21  THR  37          3HG2      THR  37   8.874  -3.801  -3.431
  227   HG22  THR  37          1HG2      THR  37   7.154  -4.192  -3.349
  228   HG23  THR  37          2HG2      THR  37   7.720  -2.590  -2.874
  229    H    GLU  38           H        GLU  38   5.915   0.142  -5.302
  230    HA   GLU  38           HA       GLU  38   5.467   0.394  -8.106
  231    HB2  GLU  38           2HB      GLU  38   6.084   2.517  -6.038
  232    HB3  GLU  38           1HB      GLU  38   5.529   2.830  -7.677
  233    HG2  GLU  38           2HG      GLU  38   3.463   1.542  -7.143
  234    HG3  GLU  38           1HG      GLU  38   4.016   1.459  -5.470
  235    H    THR  39           H        THR  39   6.882   0.862  -9.709
  236    HA   THR  39           HA       THR  39   9.679   1.328  -8.919
  237    HB   THR  39           HB       THR  39   8.844  -0.134 -11.426
  238    HG1  THR  39           1HG      THR  39   8.589  -1.031  -8.971
  239   HG21  THR  39          3HG2      THR  39  11.459   0.023  -9.917
  240   HG22  THR  39          1HG2      THR  39  11.091   0.847 -11.432
  241   HG23  THR  39          2HG2      THR  39  11.171  -0.914 -11.383
  242    H    GLY  40           H        GLY  40  10.353   3.261  -9.513
  243    HA2  GLY  40           2HA      GLY  40  10.182   4.290 -12.112
  244    HA3  GLY  40           1HA      GLY  40   8.913   5.031 -11.143
  245    H    GLU  41           H        GLU  41   9.818   7.079 -11.186
  246    HA   GLU  41           HA       GLU  41  12.414   7.328  -9.811
  247    HB2  GLU  41           2HB      GLU  41  11.071   9.270 -11.698
  248    HB3  GLU  41           1HB      GLU  41  12.616   9.528 -10.894
  249    HG2  GLU  41           2HG      GLU  41  13.534   7.575 -12.069
  250    HG3  GLU  41           1HG      GLU  41  11.993   7.369 -12.898
  251    H    GLY  42           H        GLY  42  12.262   7.924  -7.783
  252    HA2  GLY  42           2HA      GLY  42  11.369  10.132  -6.625
  253    HA3  GLY  42           1HA      GLY  42   9.858   9.246  -6.804
  254    H    ALA  43           H        ALA  43  10.062   9.563  -4.354
  255    HA   ALA  43           HA       ALA  43  11.821   7.586  -3.110
  256    HB1  ALA  43           1HB      ALA  43  11.095   8.554  -0.991
  257    HB2  ALA  43           2HB      ALA  43   9.932   9.570  -1.843
  258    HB3  ALA  43           3HB      ALA  43  11.662   9.810  -2.093
  259    H    ALA  44           H        ALA  44   8.831   7.603  -4.498
  260    HA   ALA  44           HA       ALA  44   7.381   6.044  -2.567
  261    HB1  ALA  44           1HB      ALA  44   5.652   5.897  -4.282
  262    HB2  ALA  44           2HB      ALA  44   6.755   6.599  -5.465
  263    HB3  ALA  44           3HB      ALA  44   6.210   7.560  -4.090
  264    H    ALA  45           H        ALA  45   7.910   4.015  -2.170
  265    HA   ALA  45           HA       ALA  45   8.779   2.323  -4.424
  266    HB1  ALA  45           1HB      ALA  45   9.479   2.051  -1.502
  267    HB2  ALA  45           2HB      ALA  45  10.541   2.667  -2.768
  268    HB3  ALA  45           3HB      ALA  45  10.020   0.983  -2.797
  269    H    TYR  46           H        TYR  46   6.385   2.822  -2.057
  270    HA   TYR  46           HA       TYR  46   5.255   0.168  -2.628
  271    HB2  TYR  46           2HB      TYR  46   5.226   1.559   0.064
  272    HB3  TYR  46           1HB      TYR  46   4.395   0.057  -0.315
  273    HD1  TYR  46           1HD      TYR  46   5.677  -2.016  -0.670
  274    HD2  TYR  46           2HD      TYR  46   7.588   1.606   0.487
  275    HE1  TYR  46           1HE      TYR  46   7.673  -3.289  -0.001
  276    HE2  TYR  46           2HE      TYR  46   9.588   0.346   1.154
  277    HH   TYR  46           HH       TYR  46  10.223  -1.894   1.809
  278    H    GLY  47           H        GLY  47   3.198   0.215  -3.302
  279    HA2  GLY  47           2HA      GLY  47   1.665   2.691  -2.821
  280    HA3  GLY  47           1HA      GLY  47   1.499   1.709  -4.273
  281    H    VAL  48           H        VAL  48   0.181   2.381  -1.304
  282    HA   VAL  48           HA       VAL  48  -0.898  -0.313  -0.907
  283    HB   VAL  48           HB       VAL  48  -1.154   2.098   0.893
  284   HG11  VAL  48          1HG1      VAL  48  -2.891   0.459   1.269
  285   HG12  VAL  48          2HG1      VAL  48  -1.741   0.433   2.606
  286   HG13  VAL  48          3HG1      VAL  48  -1.689  -0.827   1.374
  287   HG21  VAL  48          3HG2      VAL  48   0.592   1.064   2.262
  288   HG22  VAL  48          1HG2      VAL  48   1.186   1.472   0.653
  289   HG23  VAL  48          2HG2      VAL  48   0.790  -0.201   1.048
  290    H    LEU  49           H        LEU  49  -2.827  -0.772  -1.724
  291    HA   LEU  49           HA       LEU  49  -4.673   1.395  -2.363
  292    HB2  LEU  49           2HB      LEU  49  -6.001  -0.432  -3.476
  293    HB3  LEU  49           1HB      LEU  49  -4.425  -0.109  -4.172
  294    HG   LEU  49           HG       LEU  49  -4.577  -2.286  -2.156
  295   HD11  LEU  49          1HD1      LEU  49  -5.366  -3.893  -3.789
  296   HD12  LEU  49          2HD1      LEU  49  -5.588  -2.612  -4.979
  297   HD13  LEU  49          3HD1      LEU  49  -6.590  -2.652  -3.527
  298   HD21  LEU  49          3HD2      LEU  49  -2.947  -3.301  -3.651
  299   HD22  LEU  49          1HD2      LEU  49  -2.469  -1.654  -3.239
  300   HD23  LEU  49          2HD2      LEU  49  -3.183  -1.998  -4.815
  301    H    VAL  50           H        VAL  50  -5.898   2.017  -0.731
  302    HA   VAL  50           HA       VAL  50  -7.100  -0.070   0.964
  303    HB   VAL  50           HB       VAL  50  -7.420   1.871   2.641
  304   HG11  VAL  50          1HG1      VAL  50  -5.196   1.477   3.593
  305   HG12  VAL  50          2HG1      VAL  50  -4.675   0.762   2.066
  306   HG13  VAL  50          3HG1      VAL  50  -5.938  -0.015   3.019
  307   HG21  VAL  50          3HG2      VAL  50  -5.177   2.998   0.967
  308   HG22  VAL  50          1HG2      VAL  50  -5.708   3.615   2.531
  309   HG23  VAL  50          2HG2      VAL  50  -6.790   3.692   1.140
  310    H    THR  51           H        THR  51  -9.028  -0.446   0.175
  311    HA   THR  51           HA       THR  51 -10.607   1.706  -0.995
  312    HB   THR  51           HB       THR  51 -11.302  -1.234  -0.891
  313    HG1  THR  51           1HG      THR  51  -9.700  -1.500  -2.251
  314   HG21  THR  51          3HG2      THR  51 -12.143   0.996  -2.750
  315   HG22  THR  51          1HG2      THR  51 -13.139   0.266  -1.490
  316   HG23  THR  51          2HG2      THR  51 -12.635  -0.692  -2.883
  317    H    ARG  52           H        ARG  52 -12.136   2.713   0.115
  318    HA   ARG  52           HA       ARG  52 -12.968   1.773   2.719
  319    HB2  ARG  52           2HB      ARG  52 -13.554   4.204   1.061
  320    HB3  ARG  52           1HB      ARG  52 -14.597   3.809   2.415
  321    HG2  ARG  52           2HG      ARG  52 -13.063   5.357   3.239
  322    HG3  ARG  52           1HG      ARG  52 -12.514   3.796   3.842
  323    HD2  ARG  52           2HD      ARG  52 -10.727   3.721   2.315
  324    HD3  ARG  52           1HD      ARG  52 -11.412   5.016   1.329
  325    HE   ARG  52           HE       ARG  52 -11.027   6.148   3.791
  326   HH11  ARG  52          1HH1      ARG  52  -8.928   4.502   1.510
  327   HH12  ARG  52          2HH1      ARG  52  -7.542   5.455   1.925
  328   HH21  ARG  52          1HH2      ARG  52  -9.228   7.403   4.303
  329   HH22  ARG  52          2HH2      ARG  52  -7.712   7.143   3.495
  330    HA   PRO  53           HA       PRO  53 -16.757  -0.261   1.459
  331    HB2  PRO  53           2HB      PRO  53 -18.019   0.812   3.886
  332    HB3  PRO  53           1HB      PRO  53 -17.693  -0.866   3.446
  333    HG2  PRO  53           2HG      PRO  53 -16.328   0.378   5.398
  334    HG3  PRO  53           1HG      PRO  53 -15.568  -0.829   4.344
  335    HD2  PRO  53           2HD      PRO  53 -15.400   2.160   4.234
  336    HD3  PRO  53           1HD      PRO  53 -14.118   0.950   4.006
  337    H    ASP  54           H        ASP  54 -16.274   2.974   1.652
  338    HA   ASP  54           HA       ASP  54 -18.959   3.866   1.052
  339    HB2  ASP  54           2HB      ASP  54 -17.360   5.277   2.339
  340    HB3  ASP  54           1HB      ASP  54 -16.323   5.356   0.921
  341    H    GLY  55           H        GLY  55 -16.353   2.489  -0.595
  342    HA2  GLY  55           2HA      GLY  55 -16.629   1.774  -2.861
  343    HA3  GLY  55           1HA      GLY  55 -17.581   3.219  -3.166
  344    H    THR  56           H        THR  56 -15.166   4.387  -1.401
  345    HA   THR  56           HA       THR  56 -13.738   5.243  -3.783
  346    HB   THR  56           HB       THR  56 -14.421   7.050  -2.390
  347    HG1  THR  56           1HG      THR  56 -12.498   8.075  -2.240
  348   HG21  THR  56          3HG2      THR  56 -14.716   5.863  -0.283
  349   HG22  THR  56          1HG2      THR  56 -13.716   7.298  -0.055
  350   HG23  THR  56          2HG2      THR  56 -12.969   5.702  -0.113
  351    H    ARG  57           H        ARG  57 -11.818   4.538  -4.342
  352    HA   ARG  57           HA       ARG  57 -10.253   2.957  -2.422
  353    HB2  ARG  57           2HB      ARG  57 -10.889   1.646  -4.344
  354    HB3  ARG  57           1HB      ARG  57 -10.345   2.903  -5.440
  355    HG2  ARG  57           2HG      ARG  57  -8.096   2.443  -5.050
  356    HG3  ARG  57           1HG      ARG  57  -8.442   1.545  -3.572
  357    HD2  ARG  57           2HD      ARG  57  -7.815   0.129  -5.533
  358    HD3  ARG  57           1HD      ARG  57  -9.366  -0.271  -4.805
  359    HE   ARG  57           HE       ARG  57  -9.726   1.551  -6.945
  360   HH11  ARG  57          1HH1      ARG  57  -9.059  -1.824  -6.249
  361   HH12  ARG  57          2HH1      ARG  57  -9.676  -2.386  -7.781
  362   HH21  ARG  57          1HH2      ARG  57 -10.546   0.792  -8.961
  363   HH22  ARG  57          2HH2      ARG  57 -10.522  -0.914  -9.290
  364    H    VAL  58           H        VAL  58  -8.381   3.787  -1.739
  365    HA   VAL  58           HA       VAL  58  -7.289   6.089  -3.219
  366    HB   VAL  58           HB       VAL  58  -7.285   5.751  -0.213
  367   HG11  VAL  58          1HG1      VAL  58  -6.550   8.100  -1.953
  368   HG12  VAL  58          2HG1      VAL  58  -5.429   7.074  -1.059
  369   HG13  VAL  58          3HG1      VAL  58  -6.577   8.091  -0.190
  370   HG21  VAL  58          3HG2      VAL  58  -9.051   7.499  -1.931
  371   HG22  VAL  58          1HG2      VAL  58  -8.963   7.547  -0.170
  372   HG23  VAL  58          2HG2      VAL  58  -9.566   6.102  -0.983
  373    H    GLU  59           H        GLU  59  -5.131   6.109  -3.589
  374    HA   GLU  59           HA       GLU  59  -3.565   3.817  -2.695
  375    HB2  GLU  59           2HB      GLU  59  -3.118   5.960  -4.754
  376    HB3  GLU  59           1HB      GLU  59  -1.806   4.924  -4.217
  377    HG2  GLU  59           2HG      GLU  59  -3.242   2.966  -4.894
  378    HG3  GLU  59           1HG      GLU  59  -4.310   4.137  -5.667
  379    H    VAL  60           H        VAL  60  -2.351   3.954  -0.945
  380    HA   VAL  60           HA       VAL  60  -1.335   6.589  -0.117
  381    HB   VAL  60           HB       VAL  60  -1.183   4.019   1.457
  382   HG11  VAL  60          1HG1      VAL  60   0.375   5.705   2.178
  383   HG12  VAL  60          2HG1      VAL  60  -0.919   5.560   3.368
  384   HG13  VAL  60          3HG1      VAL  60  -0.908   6.914   2.238
  385   HG21  VAL  60          3HG2      VAL  60  -3.533   4.517   1.007
  386   HG22  VAL  60          1HG2      VAL  60  -3.309   6.154   1.621
  387   HG23  VAL  60          2HG2      VAL  60  -3.143   4.774   2.708
  388    H    HIS  61           H        HIS  61   0.593   7.021  -0.983
  389    HA   HIS  61           HA       HIS  61   2.324   4.810  -1.781
  390    HB2  HIS  61           2HB      HIS  61   2.424   7.767  -2.346
  391    HB3  HIS  61           1HB      HIS  61   3.685   6.651  -2.856
  392    HD1  HIS  61           1HD      HIS  61   2.270   8.102  -5.073
  393    HD2  HIS  61           2HD      HIS  61   0.868   4.513  -3.519
  394    HE1  HIS  61           1HE      HIS  61   0.818   7.108  -6.867
  395    HE2  HIS  61           2HE      HIS  61   0.070   4.876  -5.951
  396    H    LEU  62           H        LEU  62   4.106   4.242  -0.772
  397    HA   LEU  62           HA       LEU  62   4.773   5.753   1.664
  398    HB2  LEU  62           2HB      LEU  62   4.358   2.894   1.099
  399    HB3  LEU  62           1HB      LEU  62   5.712   3.262   2.147
  400    HG   LEU  62           HG       LEU  62   4.368   3.965   3.872
  401   HD11  LEU  62          1HD1      LEU  62   2.151   4.546   1.915
  402   HD12  LEU  62          2HD1      LEU  62   3.229   5.743   2.633
  403   HD13  LEU  62          3HD1      LEU  62   2.112   4.838   3.654
  404   HD21  LEU  62          3HD2      LEU  62   3.883   1.626   3.405
  405   HD22  LEU  62          1HD2      LEU  62   2.567   2.111   2.334
  406   HD23  LEU  62          2HD2      LEU  62   2.468   2.450   4.063
  407    H    ASP  63           H        ASP  63   6.907   5.586   2.457
  408    HA   ASP  63           HA       ASP  63   8.917   5.733   0.360
  409    HB2  ASP  63           2HB      ASP  63   8.907   7.560   1.917
  410    HB3  ASP  63           1HB      ASP  63   8.874   6.472   3.296
  411    H    ARG  64           H        ARG  64  11.135   4.804   1.000
  412    HA   ARG  64           HA       ARG  64  11.013   2.023   1.048
  413    HB2  ARG  64           2HB      ARG  64  13.410   3.594   1.976
  414    HB3  ARG  64           1HB      ARG  64  13.377   2.057   1.125
  415    HG2  ARG  64           2HG      ARG  64  13.387   3.050  -0.863
  416    HG3  ARG  64           1HG      ARG  64  12.099   4.166  -0.399
  417    HD2  ARG  64           2HD      ARG  64  15.046   4.445   0.174
  418    HD3  ARG  64           1HD      ARG  64  14.078   5.434  -0.922
  419    HE   ARG  64           HE       ARG  64  12.836   6.186   1.109
  420   HH11  ARG  64          1HH1      ARG  64  16.147   5.045   1.351
  421   HH12  ARG  64          2HH1      ARG  64  16.408   5.769   2.909
  422   HH21  ARG  64          1HH2      ARG  64  13.187   7.137   3.138
  423   HH22  ARG  64          2HH2      ARG  64  14.733   6.986   3.908
  424    H    ASP  65           H        ASP  65  11.305   4.338   3.683
  425    HA   ASP  65           HA       ASP  65  11.703   2.178   5.615
  426    HB2  ASP  65           2HB      ASP  65  11.742   5.183   5.903
  427    HB3  ASP  65           1HB      ASP  65  11.819   4.093   7.283
  428    H    PHE  66           H        PHE  66   9.170   2.921   4.044
  429    HA   PHE  66           HA       PHE  66   6.960   2.613   4.330
  430    HB2  PHE  66           2HB      PHE  66   8.156   1.181   6.539
  431    HB3  PHE  66           1HB      PHE  66   6.552   1.780   6.952
  432    HD1  PHE  66           1HD      PHE  66   8.456  -0.368   4.661
  433    HD2  PHE  66           2HD      PHE  66   4.596   0.913   5.905
  434    HE1  PHE  66           1HE      PHE  66   7.437  -2.199   3.371
  435    HE2  PHE  66           2HE      PHE  66   3.569  -0.913   4.619
  436    HZ   PHE  66           HZ       PHE  66   4.990  -2.470   3.350
  437    H    ARG  67           H        ARG  67   8.011   5.212   4.881
  438    HA   ARG  67           HA       ARG  67   6.000   6.187   6.774
  439    HB2  ARG  67           2HB      ARG  67   8.439   7.375   5.547
  440    HB3  ARG  67           1HB      ARG  67   7.107   8.459   5.927
  441    HG2  ARG  67           2HG      ARG  67   7.151   7.575   8.256
  442    HG3  ARG  67           1HG      ARG  67   8.613   6.683   7.826
  443    HD2  ARG  67           2HD      ARG  67   9.843   8.641   7.487
  444    HD3  ARG  67           1HD      ARG  67   8.393   9.639   7.388
  445    HE   ARG  67           HE       ARG  67   8.649   8.390   9.937
  446   HH11  ARG  67          1HH1      ARG  67   9.750  11.068   7.974
  447   HH12  ARG  67          2HH1      ARG  67  10.164  12.066   9.335
  448   HH21  ARG  67          1HH2      ARG  67   9.152   9.722  11.744
  449   HH22  ARG  67          2HH2      ARG  67   9.841  11.300  11.476
  450    H    VAL  68           H        VAL  68   4.350   7.603   6.112
  451    HA   VAL  68           HA       VAL  68   3.411   7.115   3.454
  452    HB   VAL  68           HB       VAL  68   1.773   7.255   5.212
  453   HG11  VAL  68          1HG1      VAL  68   2.946   8.739   6.738
  454   HG12  VAL  68          2HG1      VAL  68   1.311   9.323   6.428
  455   HG13  VAL  68          3HG1      VAL  68   2.688  10.094   5.640
  456   HG21  VAL  68          3HG2      VAL  68   0.223   8.904   4.269
  457   HG22  VAL  68          1HG2      VAL  68   1.049   7.986   3.010
  458   HG23  VAL  68          2HG2      VAL  68   1.555   9.636   3.372
  459    H    LEU  69           H        LEU  69   3.974   8.179   1.710
  460    HA   LEU  69           HA       LEU  69   5.299  10.751   1.949
  461    HB2  LEU  69           2HB      LEU  69   4.773   9.000  -0.449
  462    HB3  LEU  69           1HB      LEU  69   5.691  10.493  -0.482
  463    HG   LEU  69           HG       LEU  69   6.442   7.988   1.027
  464   HD11  LEU  69          1HD1      LEU  69   8.281   7.882  -0.588
  465   HD12  LEU  69          2HD1      LEU  69   7.596   9.264  -1.445
  466   HD13  LEU  69          3HD1      LEU  69   6.705   7.743  -1.364
  467   HD21  LEU  69          3HD2      LEU  69   7.915  10.604   0.720
  468   HD22  LEU  69          1HD2      LEU  69   8.543   9.149   1.495
  469   HD23  LEU  69          2HD2      LEU  69   7.169  10.001   2.200
  470    H    ASP  70           H        ASP  70   2.455   9.351   0.351
  471    HA   ASP  70           HA       ASP  70   0.993  11.784   0.639
  472    HB2  ASP  70           2HB      ASP  70   2.399  12.406  -1.295
  473    HB3  ASP  70           1HB      ASP  70   1.805  10.999  -2.171
  474    H    THR  71           H        THR  71  -1.196  11.593  -0.118
  475    HA   THR  71           HA       THR  71  -2.044   8.807  -0.538
  476    HB   THR  71           HB       THR  71  -3.584  10.850   1.065
  477    HG1  THR  71           1HG      THR  71  -1.865   8.788   2.044
  478   HG21  THR  71          3HG2      THR  71  -4.864   8.960   0.164
  479   HG22  THR  71          1HG2      THR  71  -4.750   8.884   1.923
  480   HG23  THR  71          2HG2      THR  71  -3.736   7.839   0.928
  481    H    GLU  72           H        GLU  72  -3.072   8.595  -2.438
  482    HA   GLU  72           HA       GLU  72  -4.655  10.855  -3.449
  483    HB2  GLU  72           2HB      GLU  72  -3.756  10.356  -5.751
  484    HB3  GLU  72           1HB      GLU  72  -2.604  11.077  -4.639
  485    HG2  GLU  72           2HG      GLU  72  -1.592   8.904  -4.243
  486    HG3  GLU  72           1HG      GLU  72  -2.778   8.144  -5.302
  487    HA   PRO  73           HA       PRO  73  -7.647   7.530  -3.958
  488    HB2  PRO  73           2HB      PRO  73  -9.080   9.657  -5.444
  489    HB3  PRO  73           1HB      PRO  73  -9.626   8.680  -4.077
  490    HG2  PRO  73           2HG      PRO  73  -9.004  11.258  -3.764
  491    HG3  PRO  73           1HG      PRO  73  -8.615  10.060  -2.515
  492    HD2  PRO  73           2HD      PRO  73  -6.819  11.327  -4.551
  493    HD3  PRO  73           1HD      PRO  73  -6.501  10.952  -2.844
  494    H    ALA  74           H        ALA  74  -7.417   6.033  -5.524
  495    HA   ALA  74           HA       ALA  74  -7.183   6.892  -8.306
  496    HB1  ALA  74           1HB      ALA  74  -5.157   5.648  -8.691
  497    HB2  ALA  74           2HB      ALA  74  -5.126   5.122  -7.008
  498    HB3  ALA  74           3HB      ALA  74  -4.890   6.825  -7.404
  499    H    ASP  75           H        ASP  75  -7.220   5.038  -9.816
  500    HA   ASP  75           HA       ASP  75  -8.734   2.782  -8.691
  501    HB2  ASP  75           2HB      ASP  75 -10.094   4.210 -10.192
  502    HB3  ASP  75           1HB      ASP  75  -8.931   3.927 -11.486
  503    H    GLY  76           H        GLY  76  -7.767   0.884  -8.841
  504    HA2  GLY  76           2HA      GLY  76  -5.480   0.624 -10.669
  505    HA3  GLY  76           1HA      GLY  76  -5.729  -0.327  -9.212
  506    H    ASP  77           H        ASP  77  -8.484   0.205 -11.186
  507    HA   ASP  77           HA       ASP  77  -8.414  -2.622 -11.970
  508    HB2  ASP  77           2HB      ASP  77 -10.417  -1.710 -10.742
  509    HB3  ASP  77           1HB      ASP  77 -10.745  -0.702 -12.151
  510    H    GLY  78           H        GLY  78  -9.161   0.587 -13.299
  511    HA2  GLY  78           2HA      GLY  78  -7.727   0.831 -15.460
  512    HA3  GLY  78           1HA      GLY  78  -8.744  -0.496 -16.002
  513    H    GLY  79           H        GLY  79  -8.603   2.891 -15.228
  514    HA2  GLY  79           2HA      GLY  79 -11.381   3.296 -16.054
  515    HA3  GLY  79           1HA      GLY  79 -10.286   4.529 -15.444
  516    H    LEU  80           H        LEU  80 -12.024   4.214 -17.950
  517    HA   LEU  80           HA       LEU  80  -9.910   4.582 -19.965
  518    HB2  LEU  80           2HB      LEU  80 -12.847   3.973 -20.333
  519    HB3  LEU  80           1HB      LEU  80 -11.697   4.205 -21.636
  520    HG   LEU  80           HG       LEU  80 -11.631   1.978 -19.601
  521   HD11  LEU  80          1HD1      LEU  80 -12.186   0.544 -21.492
  522   HD12  LEU  80          2HD1      LEU  80 -12.304   1.959 -22.538
  523   HD13  LEU  80          3HD1      LEU  80 -13.444   1.748 -21.209
  524   HD21  LEU  80          3HD2      LEU  80  -9.387   2.648 -20.313
  525   HD22  LEU  80          1HD2      LEU  80  -9.872   2.476 -22.000
  526   HD23  LEU  80          2HD2      LEU  80  -9.819   1.060 -20.949
  527    H    GLU  81           H        GLU  81  -9.422   6.613 -20.378
  528    HA   GLU  81           HA       GLU  81 -11.427   8.484 -21.154
  529    HB2  GLU  81           2HB      GLU  81 -10.668  10.243 -19.460
  530    HB3  GLU  81           1HB      GLU  81 -11.743   8.982 -18.877
  531    HG2  GLU  81           2HG      GLU  81  -9.812   7.796 -17.932
  532    HG3  GLU  81           1HG      GLU  81  -8.759   9.097 -18.486
  Start of MODEL    7
    1    H1   GLY   1           1HT      GLY   1   8.058   4.245  17.219
    2    H2   GLY   1           2HT      GLY   1   9.243   3.206  16.596
    3    H3   GLY   1           3HT      GLY   1   8.060   2.606  17.649
    4    HA2  GLY   1           1HA      GLY   1   6.335   3.078  16.023
    5    HA3  GLY   1           2HA      GLY   1   7.571   3.686  14.928
    6    H    ALA   2           H        ALA   2   6.266   1.876  13.721
    7    HA   ALA   2           HA       ALA   2   7.948  -0.518  13.838
    8    HB1  ALA   2           1HB      ALA   2   5.990  -1.993  13.651
    9    HB2  ALA   2           2HB      ALA   2   4.932  -0.599  13.853
   10    HB3  ALA   2           3HB      ALA   2   5.997  -1.094  15.167
   11    H    MET   3           H        MET   3   8.782  -0.724  11.880
   12    HA   MET   3           HA       MET   3   7.326   0.262   9.560
   13    HB2  MET   3           2HB      MET   3  10.165  -0.651   9.975
   14    HB3  MET   3           1HB      MET   3   9.502  -0.405   8.366
   15    HG2  MET   3           2HG      MET   3  10.709   1.545   8.982
   16    HG3  MET   3           1HG      MET   3   8.992   1.940   8.999
   17    HE1  MET   3           3HE      MET   3  11.098   3.828  10.269
   18    HE2  MET   3           1HE      MET   3  10.392   4.209  11.841
   19    HE3  MET   3           2HE      MET   3   9.367   4.146  10.408
   20    H    ALA   4           H        ALA   4   6.718  -1.026   7.847
   21    HA   ALA   4           HA       ALA   4   6.002  -3.700   8.563
   22    HB1  ALA   4           1HB      ALA   4   5.675  -2.297   5.919
   23    HB2  ALA   4           2HB      ALA   4   4.523  -2.248   7.254
   24    HB3  ALA   4           3HB      ALA   4   4.859  -3.774   6.434
   25    H    PHE   5           H        PHE   5   8.318  -4.337   8.853
   26    HA   PHE   5           HA       PHE   5   9.176  -5.639   6.360
   27    HB2  PHE   5           2HB      PHE   5  10.968  -4.507   8.524
   28    HB3  PHE   5           1HB      PHE   5  11.526  -5.541   7.213
   29    HD1  PHE   5           2HD      PHE   5  10.915  -4.692   4.797
   30    HD2  PHE   5           1HD      PHE   5  11.083  -2.231   8.267
   31    HE1  PHE   5           2HE      PHE   5  11.227  -2.712   3.374
   32    HE2  PHE   5           1HE      PHE   5  11.391  -0.247   6.848
   33    HZ   PHE   5           HZ       PHE   5  11.466  -0.485   4.398
   34    H    ASP   6           H        ASP   6   8.657  -7.682   6.570
   35    HA   ASP   6           HA       ASP   6   8.284  -9.758   7.365
   36    HB2  ASP   6           2HB      ASP   6  10.587  -9.832   8.092
   37    HB3  ASP   6           1HB      ASP   6  10.196  -8.930   9.556
   38    H    GLY   7           H        GLY   7   6.265 -10.096   7.960
   39    HA2  GLY   7           2HA      GLY   7   5.459  -9.244  10.661
   40    HA3  GLY   7           1HA      GLY   7   4.409  -8.934   9.285
   41    H    GLU   8           H        GLU   8   3.623 -10.800   8.079
   42    HA   GLU   8           HA       GLU   8   2.965 -12.979   9.877
   43    HB2  GLU   8           2HB      GLU   8   1.259 -11.915   8.411
   44    HB3  GLU   8           1HB      GLU   8   2.130 -12.506   7.006
   45    HG2  GLU   8           2HG      GLU   8   0.166 -13.870   7.586
   46    HG3  GLU   8           1HG      GLU   8   1.676 -14.776   7.601
   47    H    ASP   9           H        ASP   9   3.223 -15.231   9.246
   48    HA   ASP   9           HA       ASP   9   5.862 -15.712   8.132
   49    HB2  ASP   9           2HB      ASP   9   4.795 -16.867  10.195
   50    HB3  ASP   9           1HB      ASP   9   3.920 -17.839   9.019
   51    H    GLU  10           H        GLU  10   2.756 -15.472   6.992
   52    HA   GLU  10           HA       GLU  10   2.950 -17.403   4.844
   53    HB2  GLU  10           2HB      GLU  10   0.933 -15.183   5.232
   54    HB3  GLU  10           1HB      GLU  10   0.771 -16.578   4.178
   55    HG2  GLU  10           2HG      GLU  10   0.981 -16.758   7.170
   56    HG3  GLU  10           1HG      GLU  10  -0.545 -16.691   6.290
   57    H    VAL  11           H        VAL  11   4.772 -16.721   3.675
   58    HA   VAL  11           HA       VAL  11   4.964 -13.948   2.854
   59    HB   VAL  11           HB       VAL  11   6.775 -16.221   2.032
   60   HG11  VAL  11          1HG1      VAL  11   7.179 -13.230   2.085
   61   HG12  VAL  11          2HG1      VAL  11   6.976 -14.232   0.649
   62   HG13  VAL  11          3HG1      VAL  11   8.408 -14.420   1.660
   63   HG21  VAL  11          3HG2      VAL  11   8.263 -15.475   3.853
   64   HG22  VAL  11          1HG2      VAL  11   6.733 -16.117   4.451
   65   HG23  VAL  11          2HG2      VAL  11   7.000 -14.373   4.407
   66    H    THR  12           H        THR  12   3.203 -13.672   1.493
   67    HA   THR  12           HA       THR  12   3.037 -15.302  -0.920
   68    HB   THR  12           HB       THR  12   1.017 -13.877  -1.391
   69    HG1  THR  12           1HG      THR  12   0.574 -12.247  -0.099
   70   HG21  THR  12          3HG2      THR  12   1.077 -15.313   1.270
   71   HG22  THR  12          1HG2      THR  12   0.771 -16.047  -0.305
   72   HG23  THR  12          2HG2      THR  12  -0.382 -14.894   0.369
   73    H    GLY  13           H        GLY  13   4.680 -12.632   0.103
   74    HA2  GLY  13           2HA      GLY  13   5.813 -11.981  -2.343
   75    HA3  GLY  13           1HA      GLY  13   4.470 -10.868  -2.098
   76    HA   PRO  14           HA       PRO  14   8.499  -9.972   0.474
   77    HB2  PRO  14           2HB      PRO  14   9.662  -8.113  -1.187
   78    HB3  PRO  14           1HB      PRO  14  10.112  -9.820  -1.136
   79    HG2  PRO  14           2HG      PRO  14   8.315  -8.388  -3.050
   80    HG3  PRO  14           1HG      PRO  14   9.519  -9.650  -3.372
   81    HD2  PRO  14           2HD      PRO  14   6.883 -10.189  -3.271
   82    HD3  PRO  14           1HD      PRO  14   8.101 -11.351  -2.699
   83    H    ASP  15           H        ASP  15   7.049  -7.597  -1.751
   84    HA   ASP  15           HA       ASP  15   6.752  -5.715   0.469
   85    HB2  ASP  15           2HB      ASP  15   6.275  -4.062  -1.305
   86    HB3  ASP  15           1HB      ASP  15   7.826  -4.858  -1.542
   87    H    ALA  16           H        ALA  16   4.909  -7.491  -1.926
   88    HA   ALA  16           HA       ALA  16   2.440  -6.314  -1.796
   89    HB1  ALA  16           1HB      ALA  16   1.514  -8.464  -2.502
   90    HB2  ALA  16           2HB      ALA  16   3.025  -9.259  -2.053
   91    HB3  ALA  16           3HB      ALA  16   3.005  -8.082  -3.365
   92    H    ASP  17           H        ASP  17   3.635  -8.913   0.315
   93    HA   ASP  17           HA       ASP  17   1.271  -9.165   1.841
   94    HB2  ASP  17           2HB      ASP  17   2.682 -11.006   1.993
   95    HB3  ASP  17           1HB      ASP  17   4.123 -10.019   2.204
   96    H    ARG  18           H        ARG  18   4.270  -7.389   2.418
   97    HA   ARG  18           HA       ARG  18   3.559  -6.738   5.097
   98    HB2  ARG  18           2HB      ARG  18   5.723  -5.381   3.518
   99    HB3  ARG  18           1HB      ARG  18   5.667  -5.727   5.246
  100    HG2  ARG  18           2HG      ARG  18   5.604  -8.198   4.503
  101    HG3  ARG  18           1HG      ARG  18   6.212  -7.577   2.970
  102    HD2  ARG  18           2HD      ARG  18   8.100  -6.548   4.158
  103    HD3  ARG  18           1HD      ARG  18   7.505  -7.223   5.673
  104    HE   ARG  18           HE       ARG  18   9.168  -8.523   3.878
  105   HH11  ARG  18          1HH1      ARG  18   6.081  -9.274   5.410
  106   HH12  ARG  18          2HH1      ARG  18   6.398 -10.973   5.469
  107   HH21  ARG  18          1HH2      ARG  18   9.558 -10.761   3.977
  108   HH22  ARG  18          2HH2      ARG  18   8.371 -11.810   4.690
  109    H    ALA  19           H        ALA  19   3.502  -4.992   2.033
  110    HA   ALA  19           HA       ALA  19   2.805  -2.480   3.144
  111    HB1  ALA  19           1HB      ALA  19   2.245  -3.579   0.388
  112    HB2  ALA  19           2HB      ALA  19   3.693  -2.700   0.881
  113    HB3  ALA  19           3HB      ALA  19   2.128  -1.887   0.868
  114    H    ARG  20           H        ARG  20   0.932  -5.188   1.906
  115    HA   ARG  20           HA       ARG  20  -1.629  -4.070   2.157
  116    HB2  ARG  20           2HB      ARG  20  -1.191  -6.079   0.854
  117    HB3  ARG  20           1HB      ARG  20  -0.693  -6.942   2.301
  118    HG2  ARG  20           2HG      ARG  20  -2.987  -6.721   3.178
  119    HG3  ARG  20           1HG      ARG  20  -3.463  -5.961   1.655
  120    HD2  ARG  20           2HD      ARG  20  -2.869  -7.946   0.425
  121    HD3  ARG  20           1HD      ARG  20  -2.224  -8.700   1.880
  122    HE   ARG  20           HE       ARG  20  -5.064  -7.977   1.808
  123   HH11  ARG  20          1HH1      ARG  20  -2.556 -10.420   1.833
  124   HH12  ARG  20          2HH1      ARG  20  -3.641 -11.730   2.182
  125   HH21  ARG  20          1HH2      ARG  20  -6.515  -9.711   2.244
  126   HH22  ARG  20          2HH2      ARG  20  -5.889 -11.333   2.385
  127    H    ALA  21           H        ALA  21   0.309  -6.028   4.393
  128    HA   ALA  21           HA       ALA  21  -1.674  -6.169   6.423
  129    HB1  ALA  21           1HB      ALA  21   0.139  -7.799   6.229
  130    HB2  ALA  21           2HB      ALA  21   0.101  -7.058   7.829
  131    HB3  ALA  21           3HB      ALA  21   1.309  -6.547   6.650
  132    H    ALA  22           H        ALA  22   0.618  -3.739   5.550
  133    HA   ALA  22           HA       ALA  22   0.553  -2.449   8.144
  134    HB1  ALA  22           1HB      ALA  22   1.997  -0.776   7.145
  135    HB2  ALA  22           2HB      ALA  22   1.739  -1.480   5.548
  136    HB3  ALA  22           3HB      ALA  22   2.597  -2.397   6.788
  137    H    ALA  23           H        ALA  23  -0.851  -1.993   4.947
  138    HA   ALA  23           HA       ALA  23  -1.814   0.627   5.415
  139    HB1  ALA  23           1HB      ALA  23  -3.012   0.352   3.327
  140    HB2  ALA  23           2HB      ALA  23  -2.700  -1.383   3.361
  141    HB3  ALA  23           3HB      ALA  23  -1.360  -0.250   3.187
  142    H    VAL  24           H        VAL  24  -3.085  -2.494   6.231
  143    HA   VAL  24           HA       VAL  24  -5.826  -1.857   6.267
  144    HB   VAL  24           HB       VAL  24  -4.965  -4.170   6.371
  145   HG11  VAL  24          1HG1      VAL  24  -3.131  -3.857   7.924
  146   HG12  VAL  24          2HG1      VAL  24  -4.226  -5.115   8.502
  147   HG13  VAL  24          3HG1      VAL  24  -4.270  -3.506   9.224
  148   HG21  VAL  24          3HG2      VAL  24  -7.269  -3.746   6.957
  149   HG22  VAL  24          1HG2      VAL  24  -6.807  -3.396   8.624
  150   HG23  VAL  24          2HG2      VAL  24  -6.618  -5.027   7.980
  151    H    GLN  25           H        GLN  25  -3.264  -1.018   8.435
  152    HA   GLN  25           HA       GLN  25  -4.976  -0.351  10.648
  153    HB2  GLN  25           2HB      GLN  25  -2.071   0.066  10.050
  154    HB3  GLN  25           1HB      GLN  25  -2.825   0.970  11.352
  155    HG2  GLN  25           2HG      GLN  25  -1.873  -0.891  12.380
  156    HG3  GLN  25           1HG      GLN  25  -3.591  -1.262  12.269
  157   HE21  GLN  25          1HE2      GLN  25  -1.346  -1.419   9.582
  158   HE22  GLN  25          2HE2      GLN  25  -1.402  -3.142   9.397
  159    H    ALA  26           H        ALA  26  -4.198   1.146   7.705
  160    HA   ALA  26           HA       ALA  26  -4.638   3.849   8.736
  161    HB1  ALA  26           1HB      ALA  26  -3.846   2.927   5.975
  162    HB2  ALA  26           2HB      ALA  26  -2.749   3.520   7.223
  163    HB3  ALA  26           3HB      ALA  26  -3.948   4.604   6.515
  164    H    VAL  27           H        VAL  27  -6.367   1.309   7.308
  165    HA   VAL  27           HA       VAL  27  -8.458   3.187   6.439
  166    HB   VAL  27           HB       VAL  27  -7.589   1.946   4.540
  167   HG11  VAL  27          1HG1      VAL  27  -7.845  -0.485   4.355
  168   HG12  VAL  27          2HG1      VAL  27  -8.388  -0.545   6.033
  169   HG13  VAL  27          3HG1      VAL  27  -6.744  -0.031   5.656
  170   HG21  VAL  27          3HG2      VAL  27 -10.334   0.980   5.317
  171   HG22  VAL  27          1HG2      VAL  27  -9.671   1.010   3.683
  172   HG23  VAL  27          2HG2      VAL  27  -9.958   2.521   4.547
  173    HA   PRO  28           HA       PRO  28 -10.690   1.389   9.835
  174    HB2  PRO  28           2HB      PRO  28 -12.940   3.038   9.069
  175    HB3  PRO  28           1HB      PRO  28 -11.870   3.208  10.462
  176    HG2  PRO  28           2HG      PRO  28 -11.932   4.958   8.362
  177    HG3  PRO  28           1HG      PRO  28 -10.514   4.701   9.392
  178    HD2  PRO  28           2HD      PRO  28 -11.099   3.634   6.663
  179    HD3  PRO  28           1HD      PRO  28  -9.560   4.195   7.351
  180    H    GLY  29           H        GLY  29 -11.123  -0.685   9.202
  181    HA2  GLY  29           2HA      GLY  29 -12.395  -2.462   8.508
  182    HA3  GLY  29           1HA      GLY  29 -13.762  -1.363   8.576
  183    H    GLY  30           H        GLY  30 -10.925  -1.121   6.493
  184    HA2  GLY  30           2HA      GLY  30 -12.765  -1.103   4.202
  185    HA3  GLY  30           1HA      GLY  30 -11.171  -0.363   4.237
  186    H    THR  31           H        THR  31 -11.223  -1.613   2.126
  187    HA   THR  31           HA       THR  31 -10.546  -4.438   2.482
  188    HB   THR  31           HB       THR  31 -10.868  -2.919  -0.110
  189    HG1  THR  31           1HG      THR  31 -12.895  -4.615   0.761
  190   HG21  THR  31          3HG2      THR  31 -11.223  -5.138  -1.076
  191   HG22  THR  31          1HG2      THR  31 -11.007  -5.876   0.511
  192   HG23  THR  31          2HG2      THR  31  -9.657  -5.054  -0.270
  193    H    ALA  32           H        ALA  32  -8.479  -4.883   2.814
  194    HA   ALA  32           HA       ALA  32  -6.411  -3.179   1.614
  195    HB1  ALA  32           1HB      ALA  32  -4.869  -4.235   3.196
  196    HB2  ALA  32           2HB      ALA  32  -6.177  -5.261   3.787
  197    HB3  ALA  32           3HB      ALA  32  -6.248  -3.516   4.032
  198    H    GLY  33           H        GLY  33  -5.905  -3.847  -0.359
  199    HA2  GLY  33           2HA      GLY  33  -5.973  -6.726  -0.947
  200    HA3  GLY  33           1HA      GLY  33  -6.062  -5.436  -2.135
  201    H    GLU  34           H        GLU  34  -4.328  -7.609  -2.395
  202    HA   GLU  34           HA       GLU  34  -1.703  -6.933  -1.511
  203    HB2  GLU  34           2HB      GLU  34  -0.976  -8.630  -3.220
  204    HB3  GLU  34           1HB      GLU  34  -2.116  -9.222  -2.022
  205    HG2  GLU  34           2HG      GLU  34  -3.929  -9.018  -3.629
  206    HG3  GLU  34           1HG      GLU  34  -2.805  -8.381  -4.828
  207    H    VAL  35           H        VAL  35  -0.023  -5.976  -2.623
  208    HA   VAL  35           HA       VAL  35  -0.824  -4.375  -4.957
  209    HB   VAL  35           HB       VAL  35   0.419  -2.464  -4.038
  210   HG11  VAL  35          1HG1      VAL  35  -1.169  -1.851  -2.278
  211   HG12  VAL  35          2HG1      VAL  35  -1.697  -3.531  -2.174
  212   HG13  VAL  35          3HG1      VAL  35  -1.979  -2.608  -3.650
  213   HG21  VAL  35          3HG2      VAL  35   0.711  -4.176  -1.568
  214   HG22  VAL  35          1HG2      VAL  35   1.128  -2.466  -1.688
  215   HG23  VAL  35          2HG2      VAL  35   2.013  -3.657  -2.639
  216    H    GLU  36           H        GLU  36   0.897  -3.638  -6.296
  217    HA   GLU  36           HA       GLU  36   3.289  -5.332  -6.143
  218    HB2  GLU  36           2HB      GLU  36   3.591  -4.772  -8.551
  219    HB3  GLU  36           1HB      GLU  36   2.091  -5.627  -8.223
  220    HG2  GLU  36           2HG      GLU  36   0.803  -3.661  -8.486
  221    HG3  GLU  36           1HG      GLU  36   2.239  -2.637  -8.469
  222    H    THR  37           H        THR  37   5.343  -4.361  -6.642
  223    HA   THR  37           HA       THR  37   5.713  -1.835  -5.376
  224    HB   THR  37           HB       THR  37   7.959  -2.814  -6.981
  225    HG1  THR  37           1HG      THR  37   6.748  -4.523  -5.019
  226   HG21  THR  37          3HG2      THR  37   8.145  -1.216  -5.102
  227   HG22  THR  37          1HG2      THR  37   9.130  -2.658  -4.857
  228   HG23  THR  37          2HG2      THR  37   7.601  -2.478  -3.997
  229    H    GLU  38           H        GLU  38   5.624   0.126  -6.298
  230    HA   GLU  38           HA       GLU  38   5.160   0.409  -9.101
  231    HB2  GLU  38           2HB      GLU  38   5.745   2.527  -7.027
  232    HB3  GLU  38           1HB      GLU  38   5.152   2.824  -8.654
  233    HG2  GLU  38           2HG      GLU  38   3.105   1.554  -8.098
  234    HG3  GLU  38           1HG      GLU  38   3.699   1.387  -6.446
  235    H    THR  39           H        THR  39   6.634   0.508 -10.640
  236    HA   THR  39           HA       THR  39   9.422   0.731 -10.000
  237    HB   THR  39           HB       THR  39   8.769  -0.761 -11.797
  238    HG1  THR  39           1HG      THR  39  10.802   0.385 -11.931
  239   HG21  THR  39          3HG2      THR  39   6.772   0.395 -12.595
  240   HG22  THR  39          1HG2      THR  39   7.888   0.083 -13.925
  241   HG23  THR  39          2HG2      THR  39   7.771   1.701 -13.233
  242    H    GLY  40           H        GLY  40  10.647   2.509 -10.022
  243    HA2  GLY  40           2HA      GLY  40  10.262   4.739 -11.684
  244    HA3  GLY  40           1HA      GLY  40   9.495   5.062 -10.136
  245    H    GLU  41           H        GLU  41  10.934   6.718  -9.656
  246    HA   GLU  41           HA       GLU  41  13.449   5.823  -8.531
  247    HB2  GLU  41           2HB      GLU  41  13.787   6.516 -10.999
  248    HB3  GLU  41           1HB      GLU  41  13.471   8.154 -10.453
  249    HG2  GLU  41           2HG      GLU  41  15.656   6.413  -9.340
  250    HG3  GLU  41           1HG      GLU  41  15.881   7.541 -10.672
  251    H    GLY  42           H        GLY  42  13.812   6.886  -6.660
  252    HA2  GLY  42           2HA      GLY  42  13.937   9.164  -5.658
  253    HA3  GLY  42           1HA      GLY  42  12.280   9.368  -6.209
  254    H    ALA  43           H        ALA  43  11.130   9.517  -4.394
  255    HA   ALA  43           HA       ALA  43  11.729   7.806  -2.133
  256    HB1  ALA  43           1HB      ALA  43  10.003   9.107  -0.972
  257    HB2  ALA  43           2HB      ALA  43   9.639   9.955  -2.475
  258    HB3  ALA  43           3HB      ALA  43  11.219  10.144  -1.715
  259    H    ALA  44           H        ALA  44   9.391   8.065  -4.711
  260    HA   ALA  44           HA       ALA  44   7.402   6.418  -3.484
  261    HB1  ALA  44           1HB      ALA  44   6.836   8.056  -5.207
  262    HB2  ALA  44           2HB      ALA  44   6.313   6.434  -5.656
  263    HB3  ALA  44           3HB      ALA  44   7.757   7.129  -6.393
  264    H    ALA  45           H        ALA  45   8.007   4.429  -2.909
  265    HA   ALA  45           HA       ALA  45   9.216   2.721  -4.985
  266    HB1  ALA  45           1HB      ALA  45  10.203   1.387  -3.195
  267    HB2  ALA  45           2HB      ALA  45   9.471   2.445  -1.990
  268    HB3  ALA  45           3HB      ALA  45  10.708   3.071  -3.077
  269    H    TYR  46           H        TYR  46   6.876   2.844  -2.321
  270    HA   TYR  46           HA       TYR  46   5.683   0.359  -3.378
  271    HB2  TYR  46           2HB      TYR  46   5.360   1.445  -0.575
  272    HB3  TYR  46           1HB      TYR  46   4.843  -0.125  -1.174
  273    HD1  TYR  46           1HD      TYR  46   6.661  -1.802  -1.848
  274    HD2  TYR  46           2HD      TYR  46   7.463   1.735   0.378
  275    HE1  TYR  46           1HE      TYR  46   8.779  -2.780  -1.057
  276    HE2  TYR  46           2HE      TYR  46   9.580   0.770   1.164
  277    HH   TYR  46           HH       TYR  46  10.488  -1.593   1.520
  278    H    GLY  47           H        GLY  47   3.640   0.447  -4.091
  279    HA2  GLY  47           2HA      GLY  47   2.024   2.805  -3.344
  280    HA3  GLY  47           1HA      GLY  47   1.929   2.032  -4.926
  281    H    VAL  48           H        VAL  48   0.489   2.248  -1.959
  282    HA   VAL  48           HA       VAL  48  -0.523  -0.519  -2.053
  283    HB   VAL  48           HB       VAL  48  -0.705   1.310   0.332
  284   HG11  VAL  48          1HG1      VAL  48  -0.966  -0.809   1.553
  285   HG12  VAL  48          2HG1      VAL  48  -0.844  -1.692   0.032
  286   HG13  VAL  48          3HG1      VAL  48  -2.210  -0.614   0.317
  287   HG21  VAL  48          3HG2      VAL  48   1.657   1.083  -0.252
  288   HG22  VAL  48          1HG2      VAL  48   1.483  -0.672  -0.293
  289   HG23  VAL  48          2HG2      VAL  48   1.284   0.198   1.227
  290    H    LEU  49           H        LEU  49  -2.685  -0.897  -2.108
  291    HA   LEU  49           HA       LEU  49  -4.377   1.457  -2.536
  292    HB2  LEU  49           2HB      LEU  49  -5.911  -0.162  -3.688
  293    HB3  LEU  49           1HB      LEU  49  -4.363   0.090  -4.469
  294    HG   LEU  49           HG       LEU  49  -3.760  -2.085  -3.012
  295   HD11  LEU  49          1HD1      LEU  49  -5.591  -3.670  -3.055
  296   HD12  LEU  49          2HD1      LEU  49  -6.674  -2.432  -3.692
  297   HD13  LEU  49          3HD1      LEU  49  -6.009  -2.271  -2.066
  298   HD21  LEU  49          3HD2      LEU  49  -5.118  -2.065  -5.702
  299   HD22  LEU  49          1HD2      LEU  49  -4.159  -3.393  -5.047
  300   HD23  LEU  49          2HD2      LEU  49  -3.396  -1.841  -5.390
  301    H    VAL  50           H        VAL  50  -5.869   1.960  -1.092
  302    HA   VAL  50           HA       VAL  50  -6.944  -0.179   0.622
  303    HB   VAL  50           HB       VAL  50  -7.218   1.681   2.402
  304   HG11  VAL  50          1HG1      VAL  50  -4.498   0.548   1.765
  305   HG12  VAL  50          2HG1      VAL  50  -5.775  -0.262   2.673
  306   HG13  VAL  50          3HG1      VAL  50  -5.004   1.183   3.329
  307   HG21  VAL  50          3HG2      VAL  50  -4.956   2.833   0.772
  308   HG22  VAL  50          1HG2      VAL  50  -5.462   3.390   2.366
  309   HG23  VAL  50          2HG2      VAL  50  -6.550   3.559   0.986
  310    H    THR  51           H        THR  51  -9.037  -0.399   0.431
  311    HA   THR  51           HA       THR  51 -10.553   1.780  -0.825
  312    HB   THR  51           HB       THR  51 -11.427  -1.094  -0.524
  313    HG1  THR  51           1HG      THR  51  -9.352  -0.395  -1.837
  314   HG21  THR  51          3HG2      THR  51 -12.868  -0.561  -2.430
  315   HG22  THR  51          1HG2      THR  51 -12.236   1.085  -2.455
  316   HG23  THR  51          2HG2      THR  51 -13.184   0.525  -1.076
  317    H    ARG  52           H        ARG  52 -11.964   2.895   0.363
  318    HA   ARG  52           HA       ARG  52 -12.725   2.001   3.014
  319    HB2  ARG  52           2HB      ARG  52 -13.078   4.485   1.414
  320    HB3  ARG  52           1HB      ARG  52 -14.313   4.139   2.612
  321    HG2  ARG  52           2HG      ARG  52 -12.719   5.574   3.612
  322    HG3  ARG  52           1HG      ARG  52 -12.508   3.975   4.322
  323    HD2  ARG  52           2HD      ARG  52 -10.589   3.570   2.890
  324    HD3  ARG  52           1HD      ARG  52 -10.822   5.135   2.107
  325    HE   ARG  52           HE       ARG  52 -10.593   5.575   4.855
  326   HH11  ARG  52          1HH1      ARG  52  -8.581   4.485   2.198
  327   HH12  ARG  52          2HH1      ARG  52  -7.110   5.041   2.925
  328   HH21  ARG  52          1HH2      ARG  52  -8.669   6.289   5.814
  329   HH22  ARG  52          2HH2      ARG  52  -7.149   6.074   4.985
  330    HA   PRO  53           HA       PRO  53 -16.418  -0.183   2.041
  331    HB2  PRO  53           2HB      PRO  53 -17.806   1.463   4.090
  332    HB3  PRO  53           1HB      PRO  53 -17.667  -0.294   3.961
  333    HG2  PRO  53           2HG      PRO  53 -16.254   1.049   5.774
  334    HG3  PRO  53           1HG      PRO  53 -15.549  -0.328   4.908
  335    HD2  PRO  53           2HD      PRO  53 -15.117   2.601   4.492
  336    HD3  PRO  53           1HD      PRO  53 -13.952   1.265   4.399
  337    H    ASP  54           H        ASP  54 -16.525   3.312   2.152
  338    HA   ASP  54           HA       ASP  54 -19.024   3.723   0.914
  339    HB2  ASP  54           2HB      ASP  54 -16.525   5.384   1.105
  340    HB3  ASP  54           1HB      ASP  54 -17.890   5.923   0.136
  341    H    GLY  55           H        GLY  55 -15.938   2.754  -0.338
  342    HA2  GLY  55           2HA      GLY  55 -15.991   1.640  -2.525
  343    HA3  GLY  55           1HA      GLY  55 -17.046   2.938  -3.074
  344    H    THR  56           H        THR  56 -15.130   4.685  -1.308
  345    HA   THR  56           HA       THR  56 -13.498   5.532  -3.478
  346    HB   THR  56           HB       THR  56 -14.259   7.206  -1.929
  347    HG1  THR  56           1HG      THR  56 -12.171   8.111  -1.339
  348   HG21  THR  56          3HG2      THR  56 -12.711   5.720   0.190
  349   HG22  THR  56          1HG2      THR  56 -14.465   5.865   0.085
  350   HG23  THR  56          2HG2      THR  56 -13.478   7.294   0.401
  351    H    ARG  57           H        ARG  57 -11.501   5.011  -3.989
  352    HA   ARG  57           HA       ARG  57 -10.066   3.133  -2.235
  353    HB2  ARG  57           2HB      ARG  57 -11.115   2.157  -4.293
  354    HB3  ARG  57           1HB      ARG  57 -10.096   3.208  -5.258
  355    HG2  ARG  57           2HG      ARG  57  -8.187   1.990  -4.801
  356    HG3  ARG  57           1HG      ARG  57  -8.865   1.292  -3.321
  357    HD2  ARG  57           2HD      ARG  57 -10.320  -0.119  -4.542
  358    HD3  ARG  57           1HD      ARG  57 -10.010   0.740  -6.045
  359    HE   ARG  57           HE       ARG  57  -7.714  -0.225  -5.930
  360   HH11  ARG  57          1HH1      ARG  57 -10.271  -1.728  -4.069
  361   HH12  ARG  57          2HH1      ARG  57  -9.694  -3.344  -4.324
  362   HH21  ARG  57          1HH2      ARG  57  -6.966  -2.372  -6.316
  363   HH22  ARG  57          2HH2      ARG  57  -7.806  -3.706  -5.587
  364    H    VAL  58           H        VAL  58  -8.168   3.880  -1.558
  365    HA   VAL  58           HA       VAL  58  -7.067   6.252  -2.910
  366    HB   VAL  58           HB       VAL  58  -6.672   5.350  -0.048
  367   HG11  VAL  58          1HG1      VAL  58  -4.786   6.642  -0.886
  368   HG12  VAL  58          2HG1      VAL  58  -5.701   7.565   0.306
  369   HG13  VAL  58          3HG1      VAL  58  -5.882   7.921  -1.412
  370   HG21  VAL  58          3HG2      VAL  58  -8.127   7.211   0.561
  371   HG22  VAL  58          1HG2      VAL  58  -8.973   6.047  -0.460
  372   HG23  VAL  58          2HG2      VAL  58  -8.396   7.567  -1.145
  373    H    GLU  59           H        GLU  59  -5.005   6.277  -3.634
  374    HA   GLU  59           HA       GLU  59  -3.411   3.847  -3.287
  375    HB2  GLU  59           2HB      GLU  59  -1.967   4.816  -5.081
  376    HB3  GLU  59           1HB      GLU  59  -3.626   4.547  -5.589
  377    HG2  GLU  59           2HG      GLU  59  -4.112   6.911  -5.320
  378    HG3  GLU  59           1HG      GLU  59  -2.468   7.195  -4.754
  379    H    VAL  60           H        VAL  60  -2.106   3.833  -1.615
  380    HA   VAL  60           HA       VAL  60  -1.084   6.365  -0.546
  381    HB   VAL  60           HB       VAL  60  -0.869   3.613   0.676
  382   HG11  VAL  60          1HG1      VAL  60  -0.452   4.854   2.754
  383   HG12  VAL  60          2HG1      VAL  60  -0.509   6.367   1.850
  384   HG13  VAL  60          3HG1      VAL  60   0.766   5.193   1.525
  385   HG21  VAL  60          3HG2      VAL  60  -2.928   5.756   1.194
  386   HG22  VAL  60          1HG2      VAL  60  -2.749   4.260   2.112
  387   HG23  VAL  60          2HG2      VAL  60  -3.218   4.200   0.412
  388    H    HIS  61           H        HIS  61   0.829   6.992  -1.267
  389    HA   HIS  61           HA       HIS  61   2.695   5.019  -2.306
  390    HB2  HIS  61           2HB      HIS  61   2.620   8.021  -2.382
  391    HB3  HIS  61           1HB      HIS  61   4.049   7.119  -2.879
  392    HD1  HIS  61           1HD      HIS  61   2.878   8.728  -5.065
  393    HD2  HIS  61           2HD      HIS  61   1.496   4.906  -4.178
  394    HE1  HIS  61           1HE      HIS  61   1.775   7.898  -7.165
  395    HE2  HIS  61           2HE      HIS  61   1.216   5.494  -6.674
  396    H    LEU  62           H        LEU  62   4.270   4.217  -1.213
  397    HA   LEU  62           HA       LEU  62   5.056   5.456   1.343
  398    HB2  LEU  62           2HB      LEU  62   4.428   2.716   0.495
  399    HB3  LEU  62           1HB      LEU  62   5.885   2.848   1.456
  400    HG   LEU  62           HG       LEU  62   4.747   3.363   3.374
  401   HD11  LEU  62          1HD1      LEU  62   2.551   4.470   3.453
  402   HD12  LEU  62          2HD1      LEU  62   2.509   4.501   1.690
  403   HD13  LEU  62          3HD1      LEU  62   3.729   5.433   2.560
  404   HD21  LEU  62          3HD2      LEU  62   2.603   2.009   1.753
  405   HD22  LEU  62          1HD2      LEU  62   2.717   2.042   3.513
  406   HD23  LEU  62          2HD2      LEU  62   3.943   1.197   2.566
  407    H    ASP  63           H        ASP  63   7.252   5.557   1.858
  408    HA   ASP  63           HA       ASP  63   8.980   5.461  -0.483
  409    HB2  ASP  63           2HB      ASP  63  10.609   6.721   0.865
  410    HB3  ASP  63           1HB      ASP  63   9.053   7.526   0.781
  411    H    ARG  64           H        ARG  64  11.442   5.179   0.754
  412    HA   ARG  64           HA       ARG  64  11.672   2.381   0.481
  413    HB2  ARG  64           2HB      ARG  64  13.796   4.193   1.612
  414    HB3  ARG  64           1HB      ARG  64  14.008   2.705   0.699
  415    HG2  ARG  64           2HG      ARG  64  13.120   3.794  -1.297
  416    HG3  ARG  64           1HG      ARG  64  12.906   5.289  -0.385
  417    HD2  ARG  64           2HD      ARG  64  15.420   5.096   0.121
  418    HD3  ARG  64           1HD      ARG  64  15.455   3.928  -1.200
  419    HE   ARG  64           HE       ARG  64  14.349   6.617  -1.647
  420   HH11  ARG  64          1HH1      ARG  64  16.785   4.191  -2.341
  421   HH12  ARG  64          2HH1      ARG  64  17.448   5.066  -3.688
  422   HH21  ARG  64          1HH2      ARG  64  15.223   7.765  -3.399
  423   HH22  ARG  64          2HH2      ARG  64  16.585   7.124  -4.270
  424    H    ASP  65           H        ASP  65  11.024   4.335   3.217
  425    HA   ASP  65           HA       ASP  65  11.853   2.158   5.024
  426    HB2  ASP  65           2HB      ASP  65  11.483   5.110   5.517
  427    HB3  ASP  65           1HB      ASP  65  11.584   3.944   6.831
  428    H    PHE  66           H        PHE  66   9.290   2.801   3.367
  429    HA   PHE  66           HA       PHE  66   7.080   2.331   3.541
  430    HB2  PHE  66           2HB      PHE  66   8.239   0.888   5.822
  431    HB3  PHE  66           1HB      PHE  66   6.530   1.274   6.005
  432    HD1  PHE  66           2HD      PHE  66   4.907   0.477   4.335
  433    HD2  PHE  66           1HD      PHE  66   8.967  -0.786   4.312
  434    HE1  PHE  66           2HE      PHE  66   4.305  -1.412   2.886
  435    HE2  PHE  66           1HE      PHE  66   8.373  -2.677   2.855
  436    HZ   PHE  66           HZ       PHE  66   6.036  -2.983   2.139
  437    H    ARG  67           H        ARG  67   8.190   4.858   4.406
  438    HA   ARG  67           HA       ARG  67   6.288   5.745   6.429
  439    HB2  ARG  67           2HB      ARG  67   8.479   6.604   6.726
  440    HB3  ARG  67           1HB      ARG  67   8.624   7.030   5.031
  441    HG2  ARG  67           2HG      ARG  67   6.972   8.808   5.339
  442    HG3  ARG  67           1HG      ARG  67   6.844   8.378   7.049
  443    HD2  ARG  67           2HD      ARG  67   8.409  10.306   6.438
  444    HD3  ARG  67           1HD      ARG  67   9.045   9.045   7.499
  445    HE   ARG  67           HE       ARG  67   9.525   8.692   4.649
  446   HH11  ARG  67          1HH1      ARG  67  10.790   9.811   7.724
  447   HH12  ARG  67          2HH1      ARG  67  12.452   9.661   7.237
  448   HH21  ARG  67          1HH2      ARG  67  11.685   8.473   4.025
  449   HH22  ARG  67          2HH2      ARG  67  12.960   8.902   5.121
  450    H    VAL  68           H        VAL  68   4.559   7.043   6.000
  451    HA   VAL  68           HA       VAL  68   3.431   6.870   3.421
  452    HB   VAL  68           HB       VAL  68   1.976   6.910   5.328
  453   HG11  VAL  68          1HG1      VAL  68   3.314   8.264   6.841
  454   HG12  VAL  68          2HG1      VAL  68   1.669   8.891   6.732
  455   HG13  VAL  68          3HG1      VAL  68   2.979   9.700   5.873
  456   HG21  VAL  68          3HG2      VAL  68   1.644   9.379   3.637
  457   HG22  VAL  68          1HG2      VAL  68   0.390   8.690   4.669
  458   HG23  VAL  68          2HG2      VAL  68   1.014   7.767   3.301
  459    H    LEU  69           H        LEU  69   3.919   7.993   1.700
  460    HA   LEU  69           HA       LEU  69   5.211  10.593   1.924
  461    HB2  LEU  69           2HB      LEU  69   4.587   8.860  -0.467
  462    HB3  LEU  69           1HB      LEU  69   5.430  10.393  -0.548
  463    HG   LEU  69           HG       LEU  69   6.417   7.945   0.913
  464   HD11  LEU  69          1HD1      LEU  69   7.277   9.149  -1.714
  465   HD12  LEU  69          2HD1      LEU  69   6.388   7.639  -1.507
  466   HD13  LEU  69          3HD1      LEU  69   8.039   7.782  -0.901
  467   HD21  LEU  69          3HD2      LEU  69   7.735  10.598   0.339
  468   HD22  LEU  69          1HD2      LEU  69   8.519   9.201   1.076
  469   HD23  LEU  69          2HD2      LEU  69   7.203  10.019   1.918
  470    H    ASP  70           H        ASP  70   2.459   9.224   0.111
  471    HA   ASP  70           HA       ASP  70   0.945  11.665   0.392
  472    HB2  ASP  70           2HB      ASP  70   2.511  12.266  -1.417
  473    HB3  ASP  70           1HB      ASP  70   2.012  10.845  -2.324
  474    H    THR  71           H        THR  71  -1.231  11.401  -0.214
  475    HA   THR  71           HA       THR  71  -1.964   8.658  -1.000
  476    HB   THR  71           HB       THR  71  -4.056   9.029   0.423
  477    HG1  THR  71           1HG      THR  71  -2.821  11.384   0.824
  478   HG21  THR  71          3HG2      THR  71  -1.385   8.819   1.817
  479   HG22  THR  71          1HG2      THR  71  -2.276   7.487   1.078
  480   HG23  THR  71          2HG2      THR  71  -2.938   8.319   2.485
  481    H    GLU  72           H        GLU  72  -2.764   8.771  -2.984
  482    HA   GLU  72           HA       GLU  72  -4.399  11.098  -3.749
  483    HB2  GLU  72           2HB      GLU  72  -2.677   9.202  -5.320
  484    HB3  GLU  72           1HB      GLU  72  -3.945  10.124  -6.111
  485    HG2  GLU  72           2HG      GLU  72  -1.786  11.402  -4.466
  486    HG3  GLU  72           1HG      GLU  72  -1.630  11.101  -6.197
  487    HA   PRO  73           HA       PRO  73  -7.893   8.364  -4.319
  488    HB2  PRO  73           2HB      PRO  73  -8.864  10.030  -6.494
  489    HB3  PRO  73           1HB      PRO  73  -9.517   9.847  -4.866
  490    HG2  PRO  73           2HG      PRO  73  -8.333  12.135  -5.746
  491    HG3  PRO  73           1HG      PRO  73  -8.336  11.630  -4.047
  492    HD2  PRO  73           2HD      PRO  73  -6.165  11.391  -6.095
  493    HD3  PRO  73           1HD      PRO  73  -6.052  11.817  -4.373
  494    H    ALA  74           H        ALA  74  -7.778   6.479  -5.370
  495    HA   ALA  74           HA       ALA  74  -6.359   6.300  -7.884
  496    HB1  ALA  74           1HB      ALA  74  -6.003   4.616  -6.140
  497    HB2  ALA  74           2HB      ALA  74  -6.615   3.891  -7.627
  498    HB3  ALA  74           3HB      ALA  74  -7.696   4.140  -6.256
  499    H    ASP  75           H        ASP  75  -7.264   5.261  -9.769
  500    HA   ASP  75           HA       ASP  75  -9.993   6.153 -10.225
  501    HB2  ASP  75           2HB      ASP  75  -8.277   6.624 -11.924
  502    HB3  ASP  75           1HB      ASP  75  -8.007   4.895 -12.132
  503    H    GLY  76           H        GLY  76 -11.740   4.869 -10.602
  504    HA2  GLY  76           2HA      GLY  76 -11.367   2.084  -9.747
  505    HA3  GLY  76           1HA      GLY  76 -12.870   2.990  -9.669
  506    H    ASP  77           H        ASP  77 -11.519   3.625 -12.620
  507    HA   ASP  77           HA       ASP  77 -13.268   1.643 -13.886
  508    HB2  ASP  77           2HB      ASP  77 -13.659   3.973 -14.520
  509    HB3  ASP  77           1HB      ASP  77 -11.980   4.132 -15.032
  510    H    GLY  78           H        GLY  78 -10.055   3.090 -14.370
  511    HA2  GLY  78           2HA      GLY  78  -8.144   1.550 -14.600
  512    HA3  GLY  78           1HA      GLY  78  -9.196   0.512 -15.554
  513    H    GLY  79           H        GLY  79 -10.426   2.783 -16.943
  514    HA2  GLY  79           2HA      GLY  79  -8.371   3.098 -18.979
  515    HA3  GLY  79           1HA      GLY  79 -10.067   3.534 -19.129
  516    H    LEU  80           H        LEU  80  -7.059   4.482 -17.529
  517    HA   LEU  80           HA       LEU  80  -7.944   7.073 -16.807
  518    HB2  LEU  80           2HB      LEU  80  -5.221   5.826 -17.068
  519    HB3  LEU  80           1HB      LEU  80  -5.424   7.514 -16.634
  520    HG   LEU  80           HG       LEU  80  -6.548   5.186 -15.070
  521   HD11  LEU  80          1HD1      LEU  80  -4.160   6.950 -14.527
  522   HD12  LEU  80          2HD1      LEU  80  -4.114   5.239 -14.951
  523   HD13  LEU  80          3HD1      LEU  80  -4.823   5.748 -13.419
  524   HD21  LEU  80          3HD2      LEU  80  -6.431   8.141 -14.481
  525   HD22  LEU  80          1HD2      LEU  80  -6.990   6.896 -13.365
  526   HD23  LEU  80          2HD2      LEU  80  -7.879   7.207 -14.856
  527    H    GLU  81           H        GLU  81  -7.928   8.943 -17.863
  528    HA   GLU  81           HA       GLU  81  -6.961   8.943 -20.626
  529    HB2  GLU  81           2HB      GLU  81  -8.415  11.054 -20.768
  530    HB3  GLU  81           1HB      GLU  81  -9.235   9.505 -20.656
  531    HG2  GLU  81           2HG      GLU  81  -9.722   9.855 -18.341
  532    HG3  GLU  81           1HG      GLU  81  -8.724  11.307 -18.304
  Start of MODEL    8
    1    H1   GLY   1           1HT      GLY   1  12.209   3.475  16.867
    2    H2   GLY   1           2HT      GLY   1  12.147   1.919  16.192
    3    H3   GLY   1           3HT      GLY   1  10.828   2.514  17.063
    4    HA2  GLY   1           1HA      GLY   1  10.529   4.268  15.391
    5    HA3  GLY   1           2HA      GLY   1  11.823   3.523  14.463
    6    H    ALA   2           H        ALA   2   9.938   3.531  12.887
    7    HA   ALA   2           HA       ALA   2   8.519   0.975  13.181
    8    HB1  ALA   2           1HB      ALA   2   6.932   2.752  13.645
    9    HB2  ALA   2           2HB      ALA   2   6.537   1.945  12.128
   10    HB3  ALA   2           3HB      ALA   2   7.323   3.523  12.109
   11    H    MET   3           H        MET   3  10.139   0.041  11.879
   12    HA   MET   3           HA       MET   3   9.945   0.770   9.039
   13    HB2  MET   3           2HB      MET   3  11.970  -1.007  10.425
   14    HB3  MET   3           1HB      MET   3  11.932  -0.671   8.701
   15    HG2  MET   3           2HG      MET   3  13.595   0.724   9.526
   16    HG3  MET   3           1HG      MET   3  12.197   1.778   9.343
   17    HE1  MET   3           3HE      MET   3  13.983   3.261  12.494
   18    HE2  MET   3           1HE      MET   3  13.377   3.587  10.869
   19    HE3  MET   3           2HE      MET   3  14.777   2.538  11.097
   20    H    ALA   4           H        ALA   4   8.060  -0.216   8.456
   21    HA   ALA   4           HA       ALA   4   7.361  -2.790   9.491
   22    HB1  ALA   4           1HB      ALA   4   6.036  -1.227   7.283
   23    HB2  ALA   4           2HB      ALA   4   5.668  -1.082   9.001
   24    HB3  ALA   4           3HB      ALA   4   5.356  -2.598   8.158
   25    H    PHE   5           H        PHE   5   9.395  -3.807   8.697
   26    HA   PHE   5           HA       PHE   5   8.926  -4.878   5.988
   27    HB2  PHE   5           2HB      PHE   5  11.486  -4.674   7.593
   28    HB3  PHE   5           1HB      PHE   5  11.343  -5.619   6.115
   29    HD1  PHE   5           2HD      PHE   5  11.062  -4.527   3.961
   30    HD2  PHE   5           1HD      PHE   5  11.551  -2.271   7.535
   31    HE1  PHE   5           2HE      PHE   5  11.564  -2.528   2.623
   32    HE2  PHE   5           1HE      PHE   5  12.052  -0.262   6.201
   33    HZ   PHE   5           HZ       PHE   5  12.060  -0.390   3.743
   34    H    ASP   6           H        ASP   6   7.288  -5.820   7.680
   35    HA   ASP   6           HA       ASP   6   7.526  -8.566   7.732
   36    HB2  ASP   6           2HB      ASP   6   9.283  -8.167   9.479
   37    HB3  ASP   6           1HB      ASP   6   8.069  -7.367  10.471
   38    H    GLY   7           H        GLY   7   5.394  -8.683   7.238
   39    HA2  GLY   7           2HA      GLY   7   3.537  -6.815   8.464
   40    HA3  GLY   7           1HA      GLY   7   3.198  -7.926   7.147
   41    H    GLU   8           H        GLU   8   2.974 -10.231   7.703
   42    HA   GLU   8           HA       GLU   8   2.396 -10.849  10.459
   43    HB2  GLU   8           2HB      GLU   8   0.358  -9.600   9.372
   44    HB3  GLU   8           1HB      GLU   8   0.050 -11.167   8.631
   45    HG2  GLU   8           2HG      GLU   8  -0.278 -12.208  10.701
   46    HG3  GLU   8           1HG      GLU   8   0.456 -10.871  11.584
   47    H    ASP   9           H        ASP   9   0.744 -13.070   9.992
   48    HA   ASP   9           HA       ASP   9   2.782 -14.968   9.552
   49    HB2  ASP   9           2HB      ASP   9  -0.200 -15.379   9.797
   50    HB3  ASP   9           1HB      ASP   9   1.016 -16.646   9.917
   51    H    GLU  10           H        GLU  10   0.972 -13.359   7.239
   52    HA   GLU  10           HA       GLU  10   1.108 -15.658   5.416
   53    HB2  GLU  10           2HB      GLU  10  -0.584 -13.165   5.197
   54    HB3  GLU  10           1HB      GLU  10  -0.508 -14.441   3.989
   55    HG2  GLU  10           2HG      GLU  10  -1.262 -16.017   5.824
   56    HG3  GLU  10           1HG      GLU  10  -1.622 -14.572   6.769
   57    H    VAL  11           H        VAL  11   3.341 -15.348   5.040
   58    HA   VAL  11           HA       VAL  11   4.079 -12.917   3.605
   59    HB   VAL  11           HB       VAL  11   5.811 -15.306   4.284
   60   HG11  VAL  11          1HG1      VAL  11   6.546 -12.525   3.364
   61   HG12  VAL  11          2HG1      VAL  11   6.658 -13.997   2.399
   62   HG13  VAL  11          3HG1      VAL  11   7.684 -13.793   3.820
   63   HG21  VAL  11          3HG2      VAL  11   6.710 -13.925   6.093
   64   HG22  VAL  11          1HG2      VAL  11   4.985 -14.218   6.308
   65   HG23  VAL  11          2HG2      VAL  11   5.546 -12.658   5.706
   66    H    THR  12           H        THR  12   2.847 -13.170   1.759
   67    HA   THR  12           HA       THR  12   3.612 -15.409   0.016
   68    HB   THR  12           HB       THR  12   1.240 -15.476   0.578
   69    HG1  THR  12           1HG      THR  12   1.224 -16.215  -1.401
   70   HG21  THR  12          3HG2      THR  12   1.059 -12.726  -0.654
   71   HG22  THR  12          1HG2      THR  12   0.865 -13.109   1.056
   72   HG23  THR  12          2HG2      THR  12  -0.302 -13.712  -0.119
   73    H    GLY  13           H        GLY  13   4.586 -14.951  -1.868
   74    HA2  GLY  13           2HA      GLY  13   5.389 -13.702  -3.642
   75    HA3  GLY  13           1HA      GLY  13   4.296 -12.407  -3.169
   76    HA   PRO  14           HA       PRO  14   8.468 -10.810  -2.089
   77    HB2  PRO  14           2HB      PRO  14   7.960  -8.268  -2.849
   78    HB3  PRO  14           1HB      PRO  14   8.452  -9.516  -4.000
   79    HG2  PRO  14           2HG      PRO  14   5.709  -8.472  -3.398
   80    HG3  PRO  14           1HG      PRO  14   6.455  -8.813  -4.971
   81    HD2  PRO  14           2HD      PRO  14   4.731 -10.521  -3.758
   82    HD3  PRO  14           1HD      PRO  14   6.049 -11.073  -4.814
   83    H    ASP  15           H        ASP  15   8.036  -7.930  -1.398
   84    HA   ASP  15           HA       ASP  15   7.428  -8.323   1.363
   85    HB2  ASP  15           2HB      ASP  15   8.306  -5.977  -0.270
   86    HB3  ASP  15           1HB      ASP  15   7.711  -5.727   1.370
   87    H    ALA  16           H        ALA  16   5.295  -8.358  -0.933
   88    HA   ALA  16           HA       ALA  16   3.349  -6.457  -0.535
   89    HB1  ALA  16           1HB      ALA  16   1.737  -8.126  -1.263
   90    HB2  ALA  16           2HB      ALA  16   2.897  -9.412  -0.932
   91    HB3  ALA  16           3HB      ALA  16   3.219  -8.242  -2.211
   92    H    ASP  17           H        ASP  17   4.187  -9.184   1.479
   93    HA   ASP  17           HA       ASP  17   2.056  -9.319   3.242
   94    HB2  ASP  17           2HB      ASP  17   3.576 -11.029   3.526
   95    HB3  ASP  17           1HB      ASP  17   4.965  -9.961   3.378
   96    H    ARG  18           H        ARG  18   4.801  -7.096   3.264
   97    HA   ARG  18           HA       ARG  18   4.533  -6.311   5.967
   98    HB2  ARG  18           2HB      ARG  18   5.686  -4.400   4.002
   99    HB3  ARG  18           1HB      ARG  18   6.254  -4.837   5.603
  100    HG2  ARG  18           2HG      ARG  18   6.570  -6.426   3.069
  101    HG3  ARG  18           1HG      ARG  18   7.829  -5.586   3.970
  102    HD2  ARG  18           2HD      ARG  18   7.280  -7.118   5.906
  103    HD3  ARG  18           1HD      ARG  18   6.300  -8.048   4.772
  104    HE   ARG  18           HE       ARG  18   8.946  -7.614   3.785
  105   HH11  ARG  18          1HH1      ARG  18   6.939  -9.700   5.777
  106   HH12  ARG  18          2HH1      ARG  18   8.146 -10.952   5.894
  107   HH21  ARG  18          1HH2      ARG  18  10.476  -9.271   3.865
  108   HH22  ARG  18          2HH2      ARG  18  10.169 -10.718   4.781
  109    H    ALA  19           H        ALA  19   3.686  -4.598   2.977
  110    HA   ALA  19           HA       ALA  19   2.553  -2.392   4.386
  111    HB1  ALA  19           1HB      ALA  19   2.379  -3.105   1.464
  112    HB2  ALA  19           2HB      ALA  19   3.634  -2.121   2.216
  113    HB3  ALA  19           3HB      ALA  19   1.968  -1.546   2.178
  114    H    ARG  20           H        ARG  20   1.272  -5.376   3.111
  115    HA   ARG  20           HA       ARG  20  -1.415  -4.533   2.802
  116    HB2  ARG  20           2HB      ARG  20  -0.379  -6.609   1.823
  117    HB3  ARG  20           1HB      ARG  20  -0.485  -7.335   3.423
  118    HG2  ARG  20           2HG      ARG  20  -2.958  -6.865   3.349
  119    HG3  ARG  20           1HG      ARG  20  -2.741  -6.437   1.651
  120    HD2  ARG  20           2HD      ARG  20  -3.417  -8.675   1.633
  121    HD3  ARG  20           1HD      ARG  20  -1.673  -8.727   1.381
  122    HE   ARG  20           HE       ARG  20  -1.975  -8.970   4.081
  123   HH11  ARG  20          1HH1      ARG  20  -3.065 -10.724   1.266
  124   HH12  ARG  20          2HH1      ARG  20  -3.311 -12.221   2.126
  125   HH21  ARG  20          1HH2      ARG  20  -2.286 -10.937   5.231
  126   HH22  ARG  20          2HH2      ARG  20  -2.881 -12.339   4.396
  127    H    ALA  21           H        ALA  21   0.412  -5.814   5.519
  128    HA   ALA  21           HA       ALA  21  -1.793  -6.303   7.224
  129    HB1  ALA  21           1HB      ALA  21   1.068  -5.691   7.957
  130    HB2  ALA  21           2HB      ALA  21   0.407  -7.289   7.615
  131    HB3  ALA  21           3HB      ALA  21  -0.149  -6.388   9.023
  132    H    ALA  22           H        ALA  22   0.239  -3.485   6.669
  133    HA   ALA  22           HA       ALA  22  -0.816  -1.956   8.829
  134    HB1  ALA  22           1HB      ALA  22   1.414  -1.573   7.833
  135    HB2  ALA  22           2HB      ALA  22   0.428  -0.114   7.909
  136    HB3  ALA  22           3HB      ALA  22   0.627  -0.966   6.377
  137    H    ALA  23           H        ALA  23  -1.735  -2.474   5.520
  138    HA   ALA  23           HA       ALA  23  -3.263  -0.168   5.062
  139    HB1  ALA  23           1HB      ALA  23  -3.693  -2.915   3.903
  140    HB2  ALA  23           2HB      ALA  23  -2.531  -1.730   3.305
  141    HB3  ALA  23           3HB      ALA  23  -4.260  -1.387   3.228
  142    H    VAL  24           H        VAL  24  -3.981  -3.073   6.833
  143    HA   VAL  24           HA       VAL  24  -6.779  -3.021   6.802
  144    HB   VAL  24           HB       VAL  24  -4.984  -3.932   9.058
  145   HG11  VAL  24          1HG1      VAL  24  -7.837  -4.674   8.406
  146   HG12  VAL  24          2HG1      VAL  24  -7.311  -3.672   9.758
  147   HG13  VAL  24          3HG1      VAL  24  -6.858  -5.375   9.694
  148   HG21  VAL  24          3HG2      VAL  24  -4.415  -5.007   6.939
  149   HG22  VAL  24          1HG2      VAL  24  -6.100  -5.480   6.722
  150   HG23  VAL  24          2HG2      VAL  24  -5.160  -6.152   8.054
  151    H    GLN  25           H        GLN  25  -4.470  -1.288   8.823
  152    HA   GLN  25           HA       GLN  25  -6.524  -0.204  10.531
  153    HB2  GLN  25           2HB      GLN  25  -3.549   0.242  10.350
  154    HB3  GLN  25           1HB      GLN  25  -4.570   1.201  11.415
  155    HG2  GLN  25           2HG      GLN  25  -3.669  -0.508  12.741
  156    HG3  GLN  25           1HG      GLN  25  -5.341  -0.967  12.436
  157   HE21  GLN  25          1HE2      GLN  25  -2.711  -1.279  10.130
  158   HE22  GLN  25          2HE2      GLN  25  -2.680  -3.011  10.111
  159    H    ALA  26           H        ALA  26  -5.339   0.558   7.487
  160    HA   ALA  26           HA       ALA  26  -5.681   3.429   7.739
  161    HB1  ALA  26           1HB      ALA  26  -5.025   1.756   5.316
  162    HB2  ALA  26           2HB      ALA  26  -3.854   2.554   6.368
  163    HB3  ALA  26           3HB      ALA  26  -4.977   3.517   5.406
  164    H    VAL  27           H        VAL  27  -7.723   0.833   7.273
  165    HA   VAL  27           HA       VAL  27  -9.769   2.609   6.214
  166    HB   VAL  27           HB       VAL  27  -8.915   1.520   4.216
  167   HG11  VAL  27          1HG1      VAL  27  -9.110  -0.909   3.896
  168   HG12  VAL  27          2HG1      VAL  27  -9.579  -1.083   5.588
  169   HG13  VAL  27          3HG1      VAL  27  -7.970  -0.491   5.175
  170   HG21  VAL  27          3HG2      VAL  27 -11.283   2.032   4.312
  171   HG22  VAL  27          1HG2      VAL  27 -11.615   0.465   5.046
  172   HG23  VAL  27          2HG2      VAL  27 -11.017   0.553   3.389
  173    HA   PRO  28           HA       PRO  28 -11.968   0.412   9.425
  174    HB2  PRO  28           2HB      PRO  28 -14.250   1.864   9.272
  175    HB3  PRO  28           1HB      PRO  28 -12.792   2.461  10.071
  176    HG2  PRO  28           2HG      PRO  28 -13.866   3.096   7.358
  177    HG3  PRO  28           1HG      PRO  28 -13.086   4.166   8.536
  178    HD2  PRO  28           2HD      PRO  28 -11.813   3.100   6.352
  179    HD3  PRO  28           1HD      PRO  28 -10.986   3.598   7.839
  180    H    GLY  29           H        GLY  29 -12.402  -1.601   8.657
  181    HA2  GLY  29           2HA      GLY  29 -13.733  -3.300   7.861
  182    HA3  GLY  29           1HA      GLY  29 -15.012  -2.112   7.650
  183    H    GLY  30           H        GLY  30 -11.809  -2.152   6.148
  184    HA2  GLY  30           2HA      GLY  30 -13.167  -2.046   3.546
  185    HA3  GLY  30           1HA      GLY  30 -11.541  -1.468   3.870
  186    H    THR  31           H        THR  31 -10.601  -2.629   2.219
  187    HA   THR  31           HA       THR  31 -10.330  -5.501   2.749
  188    HB   THR  31           HB       THR  31 -10.796  -4.313   0.002
  189    HG1  THR  31           1HG      THR  31 -12.469  -5.440   1.918
  190   HG21  THR  31          3HG2      THR  31  -9.288  -6.252  -0.022
  191   HG22  THR  31          1HG2      THR  31 -10.843  -6.635  -0.762
  192   HG23  THR  31          2HG2      THR  31 -10.482  -7.189   0.873
  193    H    ALA  32           H        ALA  32  -8.274  -6.181   2.687
  194    HA   ALA  32           HA       ALA  32  -6.246  -4.288   1.698
  195    HB1  ALA  32           1HB      ALA  32  -6.064  -4.824   4.068
  196    HB2  ALA  32           2HB      ALA  32  -4.675  -5.450   3.178
  197    HB3  ALA  32           3HB      ALA  32  -5.965  -6.543   3.684
  198    H    GLY  33           H        GLY  33  -5.297  -4.769  -0.160
  199    HA2  GLY  33           2HA      GLY  33  -5.286  -7.586  -1.041
  200    HA3  GLY  33           1HA      GLY  33  -5.251  -6.195  -2.120
  201    H    GLU  34           H        GLU  34  -3.397  -8.307  -2.270
  202    HA   GLU  34           HA       GLU  34  -0.974  -7.770  -0.943
  203    HB2  GLU  34           2HB      GLU  34  -1.626  -9.207  -3.504
  204    HB3  GLU  34           1HB      GLU  34   0.038  -8.980  -2.990
  205    HG2  GLU  34           2HG      GLU  34  -0.659 -11.143  -2.300
  206    HG3  GLU  34           1HG      GLU  34  -0.522 -10.135  -0.863
  207    H    VAL  35           H        VAL  35   0.560  -6.298  -1.254
  208    HA   VAL  35           HA       VAL  35   0.015  -4.230  -3.218
  209    HB   VAL  35           HB       VAL  35   1.588  -2.845  -2.004
  210   HG11  VAL  35          1HG1      VAL  35  -0.268  -4.339  -0.156
  211   HG12  VAL  35          2HG1      VAL  35  -0.669  -2.932  -1.140
  212   HG13  VAL  35          3HG1      VAL  35   0.476  -2.779   0.192
  213   HG21  VAL  35          3HG2      VAL  35   2.746  -3.651  -0.000
  214   HG22  VAL  35          1HG2      VAL  35   3.263  -4.522  -1.444
  215   HG23  VAL  35          2HG2      VAL  35   2.145  -5.279  -0.309
  216    H    GLU  36           H        GLU  36   1.735  -3.312  -4.512
  217    HA   GLU  36           HA       GLU  36   3.552  -5.440  -5.426
  218    HB2  GLU  36           2HB      GLU  36   3.353  -4.463  -7.660
  219    HB3  GLU  36           1HB      GLU  36   1.773  -4.900  -7.027
  220    HG2  GLU  36           2HG      GLU  36   1.384  -2.556  -6.417
  221    HG3  GLU  36           1HG      GLU  36   2.954  -2.131  -7.093
  222    H    THR  37           H        THR  37   5.633  -4.866  -6.128
  223    HA   THR  37           HA       THR  37   6.719  -2.401  -5.059
  224    HB   THR  37           HB       THR  37   8.198  -4.386  -6.790
  225    HG1  THR  37           1HG      THR  37   7.663  -5.750  -5.229
  226   HG21  THR  37          3HG2      THR  37   9.078  -2.509  -4.592
  227   HG22  THR  37          1HG2      THR  37   9.349  -2.285  -6.319
  228   HG23  THR  37          2HG2      THR  37  10.130  -3.619  -5.468
  229    H    GLU  38           H        GLU  38   6.640  -0.569  -6.210
  230    HA   GLU  38           HA       GLU  38   5.645  -0.655  -8.894
  231    HB2  GLU  38           2HB      GLU  38   6.543   1.701  -7.235
  232    HB3  GLU  38           1HB      GLU  38   5.711   1.805  -8.779
  233    HG2  GLU  38           2HG      GLU  38   3.882   0.401  -7.624
  234    HG3  GLU  38           1HG      GLU  38   4.664   0.920  -6.129
  235    H    THR  39           H        THR  39   6.726  -0.610 -10.722
  236    HA   THR  39           HA       THR  39   9.572  -0.028 -10.753
  237    HB   THR  39           HB       THR  39   9.295  -0.510 -13.242
  238    HG1  THR  39           1HG      THR  39   7.078  -0.195 -13.489
  239   HG21  THR  39          3HG2      THR  39  10.140  -2.187 -11.679
  240   HG22  THR  39          1HG2      THR  39   9.125  -2.934 -12.915
  241   HG23  THR  39          2HG2      THR  39   8.487  -2.668 -11.293
  242    H    GLY  40           H        GLY  40  10.273   2.021 -11.029
  243    HA2  GLY  40           2HA      GLY  40   9.087   3.808 -12.896
  244    HA3  GLY  40           1HA      GLY  40   8.563   4.190 -11.266
  245    H    GLU  41           H        GLU  41   9.672   5.776 -10.394
  246    HA   GLU  41           HA       GLU  41  12.538   6.027 -10.828
  247    HB2  GLU  41           2HB      GLU  41  11.567   7.175 -12.750
  248    HB3  GLU  41           1HB      GLU  41  10.522   8.113 -11.696
  249    HG2  GLU  41           2HG      GLU  41  12.343   9.471 -12.467
  250    HG3  GLU  41           1HG      GLU  41  12.502   9.199 -10.733
  251    H    GLY  42           H        GLY  42  13.523   7.601  -9.404
  252    HA2  GLY  42           2HA      GLY  42  13.626   9.051  -7.602
  253    HA3  GLY  42           1HA      GLY  42  11.875   9.014  -7.505
  254    H    ALA  43           H        ALA  43  11.053   8.084  -5.775
  255    HA   ALA  43           HA       ALA  43  12.658   6.067  -4.360
  256    HB1  ALA  43           1HB      ALA  43  11.147   8.349  -3.092
  257    HB2  ALA  43           2HB      ALA  43  12.902   8.205  -3.218
  258    HB3  ALA  43           3HB      ALA  43  11.992   7.064  -2.227
  259    H    ALA  44           H        ALA  44  10.019   6.356  -6.091
  260    HA   ALA  44           HA       ALA  44   7.956   5.358  -4.392
  261    HB1  ALA  44           1HB      ALA  44   6.740   4.916  -6.468
  262    HB2  ALA  44           2HB      ALA  44   8.204   5.220  -7.400
  263    HB3  ALA  44           3HB      ALA  44   7.452   6.529  -6.487
  264    H    ALA  45           H        ALA  45   8.188   3.477  -3.387
  265    HA   ALA  45           HA       ALA  45   9.458   1.265  -4.853
  266    HB1  ALA  45           1HB      ALA  45   9.363   1.710  -1.874
  267    HB2  ALA  45           2HB      ALA  45  10.748   2.021  -2.921
  268    HB3  ALA  45           3HB      ALA  45  10.161   0.372  -2.702
  269    H    TYR  46           H        TYR  46   7.009   1.905  -2.334
  270    HA   TYR  46           HA       TYR  46   5.741  -0.636  -3.123
  271    HB2  TYR  46           2HB      TYR  46   5.753   0.714  -0.418
  272    HB3  TYR  46           1HB      TYR  46   4.854  -0.747  -0.810
  273    HD1  TYR  46           1HD      TYR  46   6.193  -2.790  -1.569
  274    HD2  TYR  46           2HD      TYR  46   7.969   0.585   0.318
  275    HE1  TYR  46           1HE      TYR  46   8.142  -4.160  -0.964
  276    HE2  TYR  46           2HE      TYR  46   9.923  -0.777   0.927
  277    HH   TYR  46           HH       TYR  46  10.430  -3.198   1.296
  278    H    GLY  47           H        GLY  47   3.699  -0.599  -3.798
  279    HA2  GLY  47           2HA      GLY  47   2.147   1.874  -3.342
  280    HA3  GLY  47           1HA      GLY  47   1.916   0.790  -4.710
  281    H    VAL  48           H        VAL  48   0.744   1.666  -1.735
  282    HA   VAL  48           HA       VAL  48  -0.238  -0.994  -1.020
  283    HB   VAL  48           HB       VAL  48  -0.610   1.602   0.482
  284   HG11  VAL  48          1HG1      VAL  48  -0.891  -1.263   1.375
  285   HG12  VAL  48          2HG1      VAL  48  -2.215  -0.141   1.064
  286   HG13  VAL  48          3HG1      VAL  48  -1.093   0.166   2.391
  287   HG21  VAL  48          3HG2      VAL  48   1.757   1.143   0.269
  288   HG22  VAL  48          1HG2      VAL  48   1.511  -0.510   0.825
  289   HG23  VAL  48          2HG2      VAL  48   1.234   0.839   1.924
  290    H    LEU  49           H        LEU  49  -2.060  -1.597  -2.009
  291    HA   LEU  49           HA       LEU  49  -3.965   0.399  -2.890
  292    HB2  LEU  49           2HB      LEU  49  -5.210  -1.612  -3.799
  293    HB3  LEU  49           1HB      LEU  49  -3.644  -1.271  -4.504
  294    HG   LEU  49           HG       LEU  49  -3.831  -3.273  -2.287
  295   HD11  LEU  49          1HD1      LEU  49  -5.605  -3.917  -3.826
  296   HD12  LEU  49          2HD1      LEU  49  -4.245  -5.033  -3.940
  297   HD13  LEU  49          3HD1      LEU  49  -4.484  -3.805  -5.184
  298   HD21  LEU  49          3HD2      LEU  49  -1.636  -2.597  -3.101
  299   HD22  LEU  49          1HD2      LEU  49  -2.105  -3.011  -4.750
  300   HD23  LEU  49          2HD2      LEU  49  -1.968  -4.276  -3.528
  301    H    VAL  50           H        VAL  50  -5.139   1.223  -1.302
  302    HA   VAL  50           HA       VAL  50  -6.305  -0.556   0.710
  303    HB   VAL  50           HB       VAL  50  -6.327   2.466   0.559
  304   HG11  VAL  50          1HG1      VAL  50  -7.093   2.368   2.884
  305   HG12  VAL  50          2HG1      VAL  50  -7.162   0.610   2.782
  306   HG13  VAL  50          3HG1      VAL  50  -8.235   1.593   1.789
  307   HG21  VAL  50          3HG2      VAL  50  -4.703   2.334   2.422
  308   HG22  VAL  50          1HG2      VAL  50  -4.080   1.664   0.913
  309   HG23  VAL  50          2HG2      VAL  50  -4.632   0.587   2.196
  310    H    THR  51           H        THR  51  -8.168  -1.451   0.125
  311    HA   THR  51           HA       THR  51  -9.950  -0.053  -1.707
  312    HB   THR  51           HB       THR  51 -10.307  -2.807  -0.514
  313    HG1  THR  51           1HG      THR  51  -8.383  -2.002  -2.125
  314   HG21  THR  51          3HG2      THR  51 -11.683  -3.184  -2.518
  315   HG22  THR  51          1HG2      THR  51 -11.404  -1.515  -3.017
  316   HG23  THR  51          2HG2      THR  51 -12.310  -1.854  -1.543
  317    H    ARG  52           H        ARG  52 -11.453   1.256  -0.917
  318    HA   ARG  52           HA       ARG  52 -12.431   0.837   1.814
  319    HB2  ARG  52           2HB      ARG  52 -12.880   3.156  -0.075
  320    HB3  ARG  52           1HB      ARG  52 -13.432   3.074   1.589
  321    HG2  ARG  52           2HG      ARG  52 -11.083   2.998   2.336
  322    HG3  ARG  52           1HG      ARG  52 -10.570   3.167   0.653
  323    HD2  ARG  52           2HD      ARG  52 -11.789   5.287   0.506
  324    HD3  ARG  52           1HD      ARG  52 -12.271   5.124   2.192
  325    HE   ARG  52           HE       ARG  52  -9.435   5.043   1.880
  326   HH11  ARG  52          1HH1      ARG  52 -12.203   7.182   2.019
  327   HH12  ARG  52          2HH1      ARG  52 -11.283   8.550   2.572
  328   HH21  ARG  52          1HH2      ARG  52  -8.205   6.871   2.558
  329   HH22  ARG  52          2HH2      ARG  52  -9.007   8.384   2.843
  330    HA   PRO  53           HA       PRO  53 -16.211  -0.980   0.269
  331    HB2  PRO  53           2HB      PRO  53 -17.749  -0.535   2.484
  332    HB3  PRO  53           1HB      PRO  53 -16.562  -1.838   2.372
  333    HG2  PRO  53           2HG      PRO  53 -16.301   0.854   3.656
  334    HG3  PRO  53           1HG      PRO  53 -15.772  -0.728   4.258
  335    HD2  PRO  53           2HD      PRO  53 -14.052   1.008   3.137
  336    HD3  PRO  53           1HD      PRO  53 -13.886  -0.747   2.919
  337    H    ASP  54           H        ASP  54 -15.693   2.231   1.144
  338    HA   ASP  54           HA       ASP  54 -18.192   3.420   0.650
  339    HB2  ASP  54           2HB      ASP  54 -16.454   4.683   1.722
  340    HB3  ASP  54           1HB      ASP  54 -15.363   4.444   0.364
  341    H    GLY  55           H        GLY  55 -15.745   2.132  -1.457
  342    HA2  GLY  55           2HA      GLY  55 -16.491   1.436  -3.670
  343    HA3  GLY  55           1HA      GLY  55 -17.406   2.934  -3.761
  344    H    THR  56           H        THR  56 -14.119   2.668  -2.563
  345    HA   THR  56           HA       THR  56 -13.084   3.840  -5.010
  346    HB   THR  56           HB       THR  56 -13.783   5.798  -3.744
  347    HG1  THR  56           1HG      THR  56 -12.015   6.495  -4.672
  348   HG21  THR  56          3HG2      THR  56 -11.988   4.777  -1.543
  349   HG22  THR  56          1HG2      THR  56 -13.750   4.838  -1.495
  350   HG23  THR  56          2HG2      THR  56 -12.818   6.333  -1.564
  351    H    ARG  57           H        ARG  57 -10.915   3.523  -5.318
  352    HA   ARG  57           HA       ARG  57  -9.549   1.815  -3.349
  353    HB2  ARG  57           2HB      ARG  57  -9.788   0.702  -5.477
  354    HB3  ARG  57           1HB      ARG  57  -9.207   2.115  -6.340
  355    HG2  ARG  57           2HG      ARG  57  -6.993   1.794  -5.237
  356    HG3  ARG  57           1HG      ARG  57  -7.610   0.278  -4.573
  357    HD2  ARG  57           2HD      ARG  57  -7.913  -0.645  -6.748
  358    HD3  ARG  57           1HD      ARG  57  -7.605   0.912  -7.517
  359    HE   ARG  57           HE       ARG  57  -5.651  -0.981  -6.541
  360   HH11  ARG  57          1HH1      ARG  57  -6.270   2.340  -7.488
  361   HH12  ARG  57          2HH1      ARG  57  -4.600   2.693  -7.849
  362   HH21  ARG  57          1HH2      ARG  57  -3.441  -0.519  -7.049
  363   HH22  ARG  57          2HH2      ARG  57  -3.016   1.065  -7.617
  364    H    VAL  58           H        VAL  58  -8.034   2.811  -2.203
  365    HA   VAL  58           HA       VAL  58  -6.780   5.227  -3.338
  366    HB   VAL  58           HB       VAL  58  -7.083   4.500  -0.419
  367   HG11  VAL  58          1HG1      VAL  58  -6.378   6.812  -0.015
  368   HG12  VAL  58          2HG1      VAL  58  -6.136   7.036  -1.747
  369   HG13  VAL  58          3HG1      VAL  58  -5.139   5.884  -0.858
  370   HG21  VAL  58          3HG2      VAL  58  -8.632   6.505  -2.055
  371   HG22  VAL  58          1HG2      VAL  58  -8.763   6.266  -0.312
  372   HG23  VAL  58          2HG2      VAL  58  -9.253   4.982  -1.416
  373    H    GLU  59           H        GLU  59  -4.739   4.881  -3.972
  374    HA   GLU  59           HA       GLU  59  -3.283   2.712  -2.651
  375    HB2  GLU  59           2HB      GLU  59  -1.750   2.791  -4.614
  376    HB3  GLU  59           1HB      GLU  59  -3.402   2.347  -5.004
  377    HG2  GLU  59           2HG      GLU  59  -3.815   4.626  -5.803
  378    HG3  GLU  59           1HG      GLU  59  -2.140   5.043  -5.433
  379    H    VAL  60           H        VAL  60  -2.011   3.266  -1.105
  380    HA   VAL  60           HA       VAL  60  -0.896   5.951  -0.963
  381    HB   VAL  60           HB       VAL  60  -0.530   3.694   1.014
  382   HG11  VAL  60          1HG1      VAL  60  -0.308   6.684   1.314
  383   HG12  VAL  60          2HG1      VAL  60   1.037   5.549   1.237
  384   HG13  VAL  60          3HG1      VAL  60  -0.081   5.499   2.599
  385   HG21  VAL  60          3HG2      VAL  60  -2.912   4.072   0.721
  386   HG22  VAL  60          1HG2      VAL  60  -2.683   5.804   0.955
  387   HG23  VAL  60          2HG2      VAL  60  -2.385   4.688   2.287
  388    H    HIS  61           H        HIS  61   1.038   6.370  -1.790
  389    HA   HIS  61           HA       HIS  61   2.766   4.137  -2.547
  390    HB2  HIS  61           2HB      HIS  61   2.862   7.066  -3.273
  391    HB3  HIS  61           1HB      HIS  61   3.978   5.849  -3.884
  392    HD1  HIS  61           1HD      HIS  61   1.021   7.561  -4.881
  393    HD2  HIS  61           2HD      HIS  61   2.347   3.636  -5.194
  394    HE1  HIS  61           1HE      HIS  61  -0.319   6.540  -6.737
  395    HE2  HIS  61           2HE      HIS  61   0.337   4.114  -6.753
  396    H    LEU  62           H        LEU  62   4.515   3.621  -1.458
  397    HA   LEU  62           HA       LEU  62   5.449   5.479   0.636
  398    HB2  LEU  62           2HB      LEU  62   4.861   2.579   0.628
  399    HB3  LEU  62           1HB      LEU  62   6.278   3.075   1.528
  400    HG   LEU  62           HG       LEU  62   5.038   4.191   3.137
  401   HD11  LEU  62          1HD1      LEU  62   2.769   4.995   2.866
  402   HD12  LEU  62          2HD1      LEU  62   2.691   4.299   1.247
  403   HD13  LEU  62          3HD1      LEU  62   3.791   5.637   1.580
  404   HD21  LEU  62          3HD2      LEU  62   4.572   1.802   3.210
  405   HD22  LEU  62          1HD2      LEU  62   3.194   2.033   2.134
  406   HD23  LEU  62          2HD2      LEU  62   3.177   2.736   3.752
  407    H    ASP  63           H        ASP  63   7.667   5.510   1.130
  408    HA   ASP  63           HA       ASP  63   9.356   4.839  -1.158
  409    HB2  ASP  63           2HB      ASP  63  10.931   6.400  -0.326
  410    HB3  ASP  63           1HB      ASP  63   9.357   7.145  -0.064
  411    H    ARG  64           H        ARG  64  11.813   4.696   0.183
  412    HA   ARG  64           HA       ARG  64  11.842   1.906   0.755
  413    HB2  ARG  64           2HB      ARG  64  14.116   3.811   1.252
  414    HB3  ARG  64           1HB      ARG  64  14.194   2.105   0.829
  415    HG2  ARG  64           2HG      ARG  64  13.327   2.614  -1.394
  416    HG3  ARG  64           1HG      ARG  64  13.253   4.325  -0.975
  417    HD2  ARG  64           2HD      ARG  64  15.747   4.121  -0.469
  418    HD3  ARG  64           1HD      ARG  64  15.670   2.579  -1.323
  419    HE   ARG  64           HE       ARG  64  15.086   5.218  -2.513
  420   HH11  ARG  64          1HH1      ARG  64  16.070   1.861  -2.822
  421   HH12  ARG  64          2HH1      ARG  64  16.380   1.987  -4.532
  422   HH21  ARG  64          1HH2      ARG  64  15.496   5.367  -4.754
  423   HH22  ARG  64          2HH2      ARG  64  16.055   3.972  -5.619
  424    H    ASP  65           H        ASP  65  11.681   4.784   2.690
  425    HA   ASP  65           HA       ASP  65  12.442   3.395   5.138
  426    HB2  ASP  65           2HB      ASP  65  12.782   5.951   4.425
  427    HB3  ASP  65           1HB      ASP  65  11.204   6.106   5.186
  428    H    PHE  66           H        PHE  66   9.818   3.420   3.246
  429    HA   PHE  66           HA       PHE  66   7.669   2.760   3.470
  430    HB2  PHE  66           2HB      PHE  66   8.977   1.595   5.683
  431    HB3  PHE  66           1HB      PHE  66   7.478   2.277   6.306
  432    HD1  PHE  66           1HD      PHE  66   8.917  -0.093   3.882
  433    HD2  PHE  66           2HD      PHE  66   5.381   1.310   5.786
  434    HE1  PHE  66           1HE      PHE  66   7.686  -2.037   3.016
  435    HE2  PHE  66           2HE      PHE  66   4.139  -0.631   4.919
  436    HZ   PHE  66           HZ       PHE  66   5.295  -2.306   3.530
  437    H    ARG  67           H        ARG  67   8.490   5.515   3.829
  438    HA   ARG  67           HA       ARG  67   6.355   6.504   5.575
  439    HB2  ARG  67           2HB      ARG  67   8.888   7.668   4.559
  440    HB3  ARG  67           1HB      ARG  67   7.528   8.772   4.720
  441    HG2  ARG  67           2HG      ARG  67   8.920   8.785   6.714
  442    HG3  ARG  67           1HG      ARG  67   7.303   8.176   7.069
  443    HD2  ARG  67           2HD      ARG  67   8.359   5.848   6.668
  444    HD3  ARG  67           1HD      ARG  67   9.893   6.684   6.897
  445    HE   ARG  67           HE       ARG  67   8.725   7.455   9.088
  446   HH11  ARG  67          1HH1      ARG  67   8.503   4.321   7.558
  447   HH12  ARG  67          2HH1      ARG  67   8.175   3.469   9.041
  448   HH21  ARG  67          1HH2      ARG  67   8.307   6.354  11.044
  449   HH22  ARG  67          2HH2      ARG  67   8.073   4.637  11.028
  450    H    VAL  68           H        VAL  68   4.903   8.138   4.749
  451    HA   VAL  68           HA       VAL  68   3.840   7.299   2.242
  452    HB   VAL  68           HB       VAL  68   2.337   7.956   4.035
  453   HG11  VAL  68          1HG1      VAL  68   3.647   9.670   5.127
  454   HG12  VAL  68          2HG1      VAL  68   2.066  10.317   4.689
  455   HG13  VAL  68          3HG1      VAL  68   3.485  10.728   3.726
  456   HG21  VAL  68          3HG2      VAL  68   2.165   9.813   1.667
  457   HG22  VAL  68          1HG2      VAL  68   0.846   9.444   2.779
  458   HG23  VAL  68          2HG2      VAL  68   1.525   8.173   1.763
  459    H    LEU  69           H        LEU  69   4.536   7.906   0.337
  460    HA   LEU  69           HA       LEU  69   5.825  10.470  -0.083
  461    HB2  LEU  69           2HB      LEU  69   5.031   8.291  -2.024
  462    HB3  LEU  69           1HB      LEU  69   5.933   9.729  -2.456
  463    HG   LEU  69           HG       LEU  69   6.893   7.600  -0.544
  464   HD11  LEU  69          1HD1      LEU  69   8.419   6.966  -2.341
  465   HD12  LEU  69          2HD1      LEU  69   7.660   8.149  -3.408
  466   HD13  LEU  69          3HD1      LEU  69   6.735   6.763  -2.827
  467   HD21  LEU  69          3HD2      LEU  69   9.037   8.734  -0.711
  468   HD22  LEU  69          1HD2      LEU  69   7.802   9.828  -0.086
  469   HD23  LEU  69          2HD2      LEU  69   8.326   9.955  -1.766
  470    H    ASP  70           H        ASP  70   2.905   8.776  -1.176
  471    HA   ASP  70           HA       ASP  70   1.436  11.262  -1.238
  472    HB2  ASP  70           2HB      ASP  70   2.674  11.015  -3.485
  473    HB3  ASP  70           1HB      ASP  70   1.571   9.681  -3.805
  474    H    THR  71           H        THR  71  -0.874  10.824  -1.904
  475    HA   THR  71           HA       THR  71  -1.780   8.084  -1.532
  476    HB   THR  71           HB       THR  71  -2.732  10.283   0.323
  477    HG1  THR  71           1HG      THR  71  -0.629   8.508   0.506
  478   HG21  THR  71          3HG2      THR  71  -3.264   7.309   0.319
  479   HG22  THR  71          1HG2      THR  71  -4.405   8.557  -0.181
  480   HG23  THR  71          2HG2      THR  71  -3.874   8.470   1.498
  481    H    GLU  72           H        GLU  72  -3.035   7.922  -3.302
  482    HA   GLU  72           HA       GLU  72  -4.999  10.056  -3.766
  483    HB2  GLU  72           2HB      GLU  72  -4.714   9.672  -6.217
  484    HB3  GLU  72           1HB      GLU  72  -3.310  10.377  -5.432
  485    HG2  GLU  72           2HG      GLU  72  -3.311   7.446  -5.597
  486    HG3  GLU  72           1HG      GLU  72  -3.228   8.293  -7.141
  487    HA   PRO  73           HA       PRO  73  -7.820   6.597  -4.152
  488    HB2  PRO  73           2HB      PRO  73  -9.873   8.500  -4.852
  489    HB3  PRO  73           1HB      PRO  73  -9.676   7.615  -3.338
  490    HG2  PRO  73           2HG      PRO  73  -9.364  10.333  -3.588
  491    HG3  PRO  73           1HG      PRO  73  -8.604   9.354  -2.322
  492    HD2  PRO  73           2HD      PRO  73  -7.432  10.405  -4.867
  493    HD3  PRO  73           1HD      PRO  73  -6.699  10.281  -3.253
  494    H    ALA  74           H        ALA  74  -6.970   5.727  -6.058
  495    HA   ALA  74           HA       ALA  74  -7.429   7.107  -8.576
  496    HB1  ALA  74           1HB      ALA  74  -5.979   4.522  -8.019
  497    HB2  ALA  74           2HB      ALA  74  -5.233   6.115  -8.141
  498    HB3  ALA  74           3HB      ALA  74  -6.003   5.393  -9.554
  499    H    ASP  75           H        ASP  75  -9.365   6.863  -9.461
  500    HA   ASP  75           HA       ASP  75 -10.811   4.351  -9.179
  501    HB2  ASP  75           2HB      ASP  75 -12.047   6.473  -8.929
  502    HB3  ASP  75           1HB      ASP  75 -11.612   6.914 -10.577
  503    H    GLY  76           H        GLY  76 -10.207   2.781 -10.506
  504    HA2  GLY  76           2HA      GLY  76 -10.702   2.545 -13.122
  505    HA3  GLY  76           1HA      GLY  76  -9.154   3.379 -13.140
  506    H    ASP  77           H        ASP  77  -9.504   0.864 -14.264
  507    HA   ASP  77           HA       ASP  77  -8.318  -1.010 -12.344
  508    HB2  ASP  77           2HB      ASP  77  -9.250  -1.512 -15.180
  509    HB3  ASP  77           1HB      ASP  77  -8.733  -2.735 -14.025
  510    H    GLY  78           H        GLY  78  -7.649   0.804 -15.239
  511    HA2  GLY  78           2HA      GLY  78  -4.955   1.036 -14.979
  512    HA3  GLY  78           1HA      GLY  78  -5.146  -0.520 -15.778
  513    H    GLY  79           H        GLY  79  -6.332   2.820 -16.027
  514    HA2  GLY  79           2HA      GLY  79  -5.387   3.142 -18.678
  515    HA3  GLY  79           1HA      GLY  79  -7.105   2.771 -18.691
  516    H    LEU  80           H        LEU  80  -4.721   4.972 -17.254
  517    HA   LEU  80           HA       LEU  80  -6.801   7.066 -17.294
  518    HB2  LEU  80           2HB      LEU  80  -4.479   6.756 -15.385
  519    HB3  LEU  80           1HB      LEU  80  -5.550   8.142 -15.439
  520    HG   LEU  80           HG       LEU  80  -6.374   5.319 -14.751
  521   HD11  LEU  80          1HD1      LEU  80  -6.048   7.763 -13.014
  522   HD12  LEU  80          2HD1      LEU  80  -5.010   6.336 -13.011
  523   HD13  LEU  80          3HD1      LEU  80  -6.692   6.205 -12.496
  524   HD21  LEU  80          3HD2      LEU  80  -7.949   7.891 -14.724
  525   HD22  LEU  80          1HD2      LEU  80  -8.517   6.329 -14.134
  526   HD23  LEU  80          2HD2      LEU  80  -8.166   6.552 -15.849
  527    H    GLU  81           H        GLU  81  -6.414   8.617 -18.707
  528    HA   GLU  81           HA       GLU  81  -3.693   8.945 -19.744
  529    HB2  GLU  81           2HB      GLU  81  -6.331   9.912 -20.869
  530    HB3  GLU  81           1HB      GLU  81  -4.762  10.106 -21.637
  531    HG2  GLU  81           2HG      GLU  81  -4.546   7.681 -21.813
  532    HG3  GLU  81           1HG      GLU  81  -6.119   7.489 -21.042
  Start of MODEL    9
    1    H1   GLY   1           1HT      GLY   1  10.594   4.831  16.302
    2    H2   GLY   1           2HT      GLY   1  11.012   3.223  16.635
    3    H3   GLY   1           3HT      GLY   1   9.417   3.612  16.203
    4    HA2  GLY   1           1HA      GLY   1  10.151   4.288  14.003
    5    HA3  GLY   1           2HA      GLY   1  11.799   3.869  14.450
    6    H    ALA   2           H        ALA   2   8.685   2.684  13.509
    7    HA   ALA   2           HA       ALA   2   9.865   0.000  13.210
    8    HB1  ALA   2           1HB      ALA   2   6.997   0.601  13.922
    9    HB2  ALA   2           2HB      ALA   2   8.229   0.022  15.044
   10    HB3  ALA   2           3HB      ALA   2   7.710  -0.997  13.701
   11    H    MET   3           H        MET   3  10.087  -0.453  11.141
   12    HA   MET   3           HA       MET   3   8.401   0.833   9.141
   13    HB2  MET   3           2HB      MET   3  10.727  -1.066   8.760
   14    HB3  MET   3           1HB      MET   3   9.932  -0.140   7.498
   15    HG2  MET   3           2HG      MET   3  11.942   0.979   7.960
   16    HG3  MET   3           1HG      MET   3  10.671   1.935   8.717
   17    HE1  MET   3           3HE      MET   3  12.134  -1.467  10.063
   18    HE2  MET   3           1HE      MET   3  13.471  -0.896  11.063
   19    HE3  MET   3           2HE      MET   3  13.532  -0.691   9.314
   20    H    ALA   4           H        ALA   4   7.273  -0.432   7.530
   21    HA   ALA   4           HA       ALA   4   6.095  -2.803   8.680
   22    HB1  ALA   4           1HB      ALA   4   4.686  -1.155   7.548
   23    HB2  ALA   4           2HB      ALA   4   4.572  -2.740   6.782
   24    HB3  ALA   4           3HB      ALA   4   5.537  -1.466   6.035
   25    H    PHE   5           H        PHE   5   8.345  -3.779   8.581
   26    HA   PHE   5           HA       PHE   5   8.471  -5.414   6.141
   27    HB2  PHE   5           2HB      PHE   5  10.824  -4.222   7.624
   28    HB3  PHE   5           1HB      PHE   5  10.966  -5.494   6.420
   29    HD1  PHE   5           2HD      PHE   5  10.136  -4.990   4.060
   30    HD2  PHE   5           1HD      PHE   5  10.812  -1.987   6.995
   31    HE1  PHE   5           2HE      PHE   5  10.296  -3.296   2.282
   32    HE2  PHE   5           1HE      PHE   5  10.973  -0.287   5.225
   33    HZ   PHE   5           HZ       PHE   5  10.717  -0.941   2.866
   34    H    ASP   6           H        ASP   6   7.024  -6.370   8.046
   35    HA   ASP   6           HA       ASP   6   8.738  -8.407   9.305
   36    HB2  ASP   6           2HB      ASP   6   7.762  -6.821  10.982
   37    HB3  ASP   6           1HB      ASP   6   6.157  -7.318  10.459
   38    H    GLY   7           H        GLY   7   5.322  -7.746   8.543
   39    HA2  GLY   7           2HA      GLY   7   3.982  -8.865   6.993
   40    HA3  GLY   7           1HA      GLY   7   5.269 -10.039   6.765
   41    H    GLU   8           H        GLU   8   2.967 -11.202   6.856
   42    HA   GLU   8           HA       GLU   8   2.751 -12.195   9.628
   43    HB2  GLU   8           2HB      GLU   8   0.798 -10.777   8.712
   44    HB3  GLU   8           1HB      GLU   8   0.427 -12.180   7.719
   45    HG2  GLU   8           2HG      GLU   8   0.143 -13.543   9.695
   46    HG3  GLU   8           1HG      GLU   8   0.615 -12.190  10.722
   47    H    ASP   9           H        ASP   9   1.155 -14.365   9.243
   48    HA   ASP   9           HA       ASP   9   3.065 -16.183   8.125
   49    HB2  ASP   9           2HB      ASP   9   0.371 -16.666   9.408
   50    HB3  ASP   9           1HB      ASP   9   1.479 -17.942   8.909
   51    H    GLU  10           H        GLU  10   0.437 -14.516   6.831
   52    HA   GLU  10           HA       GLU  10  -0.187 -16.510   4.835
   53    HB2  GLU  10           2HB      GLU  10  -1.057 -13.654   5.217
   54    HB3  GLU  10           1HB      GLU  10  -1.440 -14.548   3.753
   55    HG2  GLU  10           2HG      GLU  10  -2.492 -16.286   5.270
   56    HG3  GLU  10           1HG      GLU  10  -2.347 -15.088   6.557
   57    H    VAL  11           H        VAL  11   1.659 -16.954   3.736
   58    HA   VAL  11           HA       VAL  11   3.332 -14.875   2.677
   59    HB   VAL  11           HB       VAL  11   3.307 -17.793   1.892
   60   HG11  VAL  11          1HG1      VAL  11   5.637 -17.394   1.273
   61   HG12  VAL  11          2HG1      VAL  11   5.471 -15.696   1.723
   62   HG13  VAL  11          3HG1      VAL  11   4.546 -16.345   0.368
   63   HG21  VAL  11          3HG2      VAL  11   4.881 -16.443   4.086
   64   HG22  VAL  11          1HG2      VAL  11   5.052 -18.122   3.571
   65   HG23  VAL  11          2HG2      VAL  11   3.550 -17.576   4.315
   66    H    THR  12           H        THR  12   1.912 -13.617   1.479
   67    HA   THR  12           HA       THR  12   0.718 -14.875  -0.893
   68    HB   THR  12           HB       THR  12  -0.812 -13.674   0.661
   69    HG1  THR  12           1HG      THR  12  -1.701 -12.258  -1.065
   70   HG21  THR  12          3HG2      THR  12  -0.761 -11.215   0.731
   71   HG22  THR  12          1HG2      THR  12   0.745 -11.226  -0.189
   72   HG23  THR  12          2HG2      THR  12   0.696 -11.921   1.431
   73    H    GLY  13           H        GLY  13   3.443 -13.316  -0.039
   74    HA2  GLY  13           2HA      GLY  13   4.654 -12.936  -2.369
   75    HA3  GLY  13           1HA      GLY  13   3.620 -11.513  -2.315
   76    HA   PRO  14           HA       PRO  14   7.576 -10.789   0.112
   77    HB2  PRO  14           2HB      PRO  14   8.437  -8.886  -1.880
   78    HB3  PRO  14           1HB      PRO  14   9.232 -10.377  -1.373
   79    HG2  PRO  14           2HG      PRO  14   8.099  -9.996  -3.842
   80    HG3  PRO  14           1HG      PRO  14   8.336 -11.582  -3.090
   81    HD2  PRO  14           2HD      PRO  14   5.861  -9.922  -3.296
   82    HD3  PRO  14           1HD      PRO  14   6.052 -11.685  -3.394
   83    H    ASP  15           H        ASP  15   6.820  -8.041  -1.962
   84    HA   ASP  15           HA       ASP  15   6.725  -6.230   0.228
   85    HB2  ASP  15           2HB      ASP  15   6.032  -4.584  -1.547
   86    HB3  ASP  15           1HB      ASP  15   7.528  -5.447  -1.896
   87    H    ALA  16           H        ALA  16   4.320  -7.853  -1.727
   88    HA   ALA  16           HA       ALA  16   2.037  -6.434  -1.105
   89    HB1  ALA  16           1HB      ALA  16   2.276  -9.418  -1.496
   90    HB2  ALA  16           2HB      ALA  16   2.119  -8.217  -2.776
   91    HB3  ALA  16           3HB      ALA  16   0.796  -8.468  -1.638
   92    H    ASP  17           H        ASP  17   3.443  -9.178   0.655
   93    HA   ASP  17           HA       ASP  17   1.429  -9.319   2.632
   94    HB2  ASP  17           2HB      ASP  17   2.589 -11.287   2.535
   95    HB3  ASP  17           1HB      ASP  17   4.125 -10.497   2.213
   96    H    ARG  18           H        ARG  18   4.563  -7.696   2.545
   97    HA   ARG  18           HA       ARG  18   4.625  -6.930   5.259
   98    HB2  ARG  18           2HB      ARG  18   5.950  -5.519   2.931
   99    HB3  ARG  18           1HB      ARG  18   6.427  -5.436   4.623
  100    HG2  ARG  18           2HG      ARG  18   6.504  -7.914   2.913
  101    HG3  ARG  18           1HG      ARG  18   7.890  -6.896   3.306
  102    HD2  ARG  18           2HD      ARG  18   8.037  -7.685   5.427
  103    HD3  ARG  18           1HD      ARG  18   6.291  -7.873   5.588
  104    HE   ARG  18           HE       ARG  18   6.428  -9.982   4.544
  105   HH11  ARG  18          1HH1      ARG  18   9.580  -8.519   5.045
  106   HH12  ARG  18          2HH1      ARG  18  10.444 -10.002   4.818
  107   HH21  ARG  18          1HH2      ARG  18   7.573 -11.925   4.224
  108   HH22  ARG  18          2HH2      ARG  18   9.310 -11.946   4.345
  109    H    ALA  19           H        ALA  19   3.416  -5.311   2.358
  110    HA   ALA  19           HA       ALA  19   2.788  -2.897   3.799
  111    HB1  ALA  19           1HB      ALA  19   2.022  -3.693   0.997
  112    HB2  ALA  19           2HB      ALA  19   3.502  -2.851   1.452
  113    HB3  ALA  19           3HB      ALA  19   1.938  -2.074   1.692
  114    H    ARG  20           H        ARG  20   1.003  -5.722   2.656
  115    HA   ARG  20           HA       ARG  20  -1.590  -4.656   3.027
  116    HB2  ARG  20           2HB      ARG  20  -1.026  -6.719   1.714
  117    HB3  ARG  20           1HB      ARG  20  -0.791  -7.563   3.243
  118    HG2  ARG  20           2HG      ARG  20  -3.174  -6.911   3.805
  119    HG3  ARG  20           1HG      ARG  20  -3.333  -6.425   2.116
  120    HD2  ARG  20           2HD      ARG  20  -3.918  -8.539   1.704
  121    HD3  ARG  20           1HD      ARG  20  -2.220  -8.950   1.961
  122    HE   ARG  20           HE       ARG  20  -3.585  -8.853   4.438
  123   HH11  ARG  20          1HH1      ARG  20  -3.264 -10.861   1.566
  124   HH12  ARG  20          2HH1      ARG  20  -3.709 -12.319   2.405
  125   HH21  ARG  20          1HH2      ARG  20  -4.204 -10.758   5.507
  126   HH22  ARG  20          2HH2      ARG  20  -4.238 -12.268   4.651
  127    H    ALA  21           H        ALA  21   0.731  -6.094   5.198
  128    HA   ALA  21           HA       ALA  21  -0.999  -6.518   7.393
  129    HB1  ALA  21           1HB      ALA  21   1.033  -6.621   8.739
  130    HB2  ALA  21           2HB      ALA  21   1.962  -5.946   7.401
  131    HB3  ALA  21           3HB      ALA  21   1.219  -7.537   7.244
  132    H    ALA  22           H        ALA  22   0.868  -3.739   6.299
  133    HA   ALA  22           HA       ALA  22   0.282  -2.136   8.606
  134    HB1  ALA  22           1HB      ALA  22   1.348  -0.333   7.396
  135    HB2  ALA  22           2HB      ALA  22   1.302  -1.271   5.903
  136    HB3  ALA  22           3HB      ALA  22   2.310  -1.804   7.249
  137    H    ALA  23           H        ALA  23  -1.131  -2.660   5.473
  138    HA   ALA  23           HA       ALA  23  -2.770  -0.455   5.167
  139    HB1  ALA  23           1HB      ALA  23  -2.380  -2.186   3.465
  140    HB2  ALA  23           2HB      ALA  23  -4.097  -1.848   3.694
  141    HB3  ALA  23           3HB      ALA  23  -3.384  -3.302   4.392
  142    H    VAL  24           H        VAL  24  -3.255  -3.325   7.136
  143    HA   VAL  24           HA       VAL  24  -5.985  -3.174   7.604
  144    HB   VAL  24           HB       VAL  24  -3.868  -4.088   9.564
  145   HG11  VAL  24          1HG1      VAL  24  -6.797  -4.784   9.386
  146   HG12  VAL  24          2HG1      VAL  24  -6.048  -3.764  10.613
  147   HG13  VAL  24          3HG1      VAL  24  -5.635  -5.477  10.519
  148   HG21  VAL  24          3HG2      VAL  24  -3.657  -5.212   7.415
  149   HG22  VAL  24          1HG2      VAL  24  -5.367  -5.640   7.459
  150   HG23  VAL  24          2HG2      VAL  24  -4.257  -6.321   8.649
  151    H    GLN  25           H        GLN  25  -3.344  -1.497   9.239
  152    HA   GLN  25           HA       GLN  25  -5.150  -0.343  11.194
  153    HB2  GLN  25           2HB      GLN  25  -2.175  -0.009  10.786
  154    HB3  GLN  25           1HB      GLN  25  -3.085   0.764  12.074
  155    HG2  GLN  25           2HG      GLN  25  -2.109  -1.106  13.065
  156    HG3  GLN  25           1HG      GLN  25  -3.781  -1.580  12.774
  157   HE21  GLN  25          1HE2      GLN  25  -1.228  -1.374  10.366
  158   HE22  GLN  25          2HE2      GLN  25  -1.179  -3.074  10.012
  159    H    ALA  26           H        ALA  26  -4.108   0.427   8.097
  160    HA   ALA  26           HA       ALA  26  -4.194   3.308   8.482
  161    HB1  ALA  26           1HB      ALA  26  -2.529   2.368   6.961
  162    HB2  ALA  26           2HB      ALA  26  -3.636   3.448   6.113
  163    HB3  ALA  26           3HB      ALA  26  -3.817   1.700   5.961
  164    H    VAL  27           H        VAL  27  -6.171   0.730   7.144
  165    HA   VAL  27           HA       VAL  27  -8.113   2.659   6.142
  166    HB   VAL  27           HB       VAL  27  -7.553   0.711   4.738
  167   HG11  VAL  27          1HG1      VAL  27  -8.853  -0.933   6.901
  168   HG12  VAL  27          2HG1      VAL  27  -7.142  -0.933   6.478
  169   HG13  VAL  27          3HG1      VAL  27  -8.334  -1.525   5.323
  170   HG21  VAL  27          3HG2      VAL  27  -9.844   0.058   4.166
  171   HG22  VAL  27          1HG2      VAL  27  -9.707   1.792   4.456
  172   HG23  VAL  27          2HG2      VAL  27 -10.415   0.746   5.686
  173    HA   PRO  28           HA       PRO  28 -10.476   2.370   9.901
  174    HB2  PRO  28           2HB      PRO  28 -12.690   3.684   9.032
  175    HB3  PRO  28           1HB      PRO  28 -11.192   4.509   9.476
  176    HG2  PRO  28           2HG      PRO  28 -12.230   3.789   6.768
  177    HG3  PRO  28           1HG      PRO  28 -11.427   5.277   7.302
  178    HD2  PRO  28           2HD      PRO  28 -10.143   3.309   5.934
  179    HD3  PRO  28           1HD      PRO  28  -9.328   4.360   7.108
  180    H    GLY  29           H        GLY  29 -10.683   0.055   9.703
  181    HA2  GLY  29           2HA      GLY  29 -11.982  -1.831   9.794
  182    HA3  GLY  29           1HA      GLY  29 -13.380  -0.771   9.689
  183    H    GLY  30           H        GLY  30 -10.783  -1.191   7.332
  184    HA2  GLY  30           2HA      GLY  30 -12.864  -1.998   5.405
  185    HA3  GLY  30           1HA      GLY  30 -11.464  -1.022   4.985
  186    H    THR  31           H        THR  31 -11.550  -2.872   3.338
  187    HA   THR  31           HA       THR  31 -10.328  -5.331   4.336
  188    HB   THR  31           HB       THR  31 -11.217  -4.721   1.513
  189    HG1  THR  31           1HG      THR  31 -12.727  -6.095   3.507
  190   HG21  THR  31          3HG2      THR  31 -11.365  -7.170   1.330
  191   HG22  THR  31          1HG2      THR  31 -10.771  -7.324   2.985
  192   HG23  THR  31          2HG2      THR  31  -9.730  -6.646   1.733
  193    H    ALA  32           H        ALA  32  -8.210  -5.683   4.170
  194    HA   ALA  32           HA       ALA  32  -6.552  -3.898   2.561
  195    HB1  ALA  32           1HB      ALA  32  -5.808  -6.051   4.546
  196    HB2  ALA  32           2HB      ALA  32  -5.828  -4.312   4.843
  197    HB3  ALA  32           3HB      ALA  32  -4.665  -5.001   3.710
  198    H    GLY  33           H        GLY  33  -5.588  -4.507   0.695
  199    HA2  GLY  33           2HA      GLY  33  -5.965  -7.317  -0.129
  200    HA3  GLY  33           1HA      GLY  33  -6.224  -5.964  -1.222
  201    H    GLU  34           H        GLU  34  -4.493  -8.095  -1.776
  202    HA   GLU  34           HA       GLU  34  -1.805  -7.674  -1.252
  203    HB2  GLU  34           2HB      GLU  34  -3.276  -8.859  -3.578
  204    HB3  GLU  34           1HB      GLU  34  -1.534  -8.649  -3.664
  205    HG2  GLU  34           2HG      GLU  34  -2.179 -10.901  -2.960
  206    HG3  GLU  34           1HG      GLU  34  -1.222 -10.063  -1.742
  207    H    VAL  35           H        VAL  35  -0.532  -6.042  -1.627
  208    HA   VAL  35           HA       VAL  35  -1.298  -4.002  -3.567
  209    HB   VAL  35           HB       VAL  35   0.280  -2.550  -2.457
  210   HG11  VAL  35          1HG1      VAL  35  -1.394  -4.095  -0.480
  211   HG12  VAL  35          2HG1      VAL  35  -1.905  -2.701  -1.435
  212   HG13  VAL  35          3HG1      VAL  35  -0.678  -2.512  -0.181
  213   HG21  VAL  35          3HG2      VAL  35   1.034  -4.942  -0.777
  214   HG22  VAL  35          1HG2      VAL  35   1.609  -3.292  -0.543
  215   HG23  VAL  35          2HG2      VAL  35   2.041  -4.175  -2.006
  216    H    GLU  36           H        GLU  36   0.272  -3.146  -5.045
  217    HA   GLU  36           HA       GLU  36   2.556  -4.923  -5.547
  218    HB2  GLU  36           2HB      GLU  36   2.267  -4.597  -7.958
  219    HB3  GLU  36           1HB      GLU  36   0.845  -5.345  -7.247
  220    HG2  GLU  36           2HG      GLU  36  -0.324  -3.212  -7.292
  221    HG3  GLU  36           1HG      GLU  36   1.110  -2.427  -7.949
  222    H    THR  37           H        THR  37   4.463  -3.944  -6.141
  223    HA   THR  37           HA       THR  37   4.753  -1.173  -5.486
  224    HB   THR  37           HB       THR  37   7.128  -1.508  -6.180
  225    HG1  THR  37           1HG      THR  37   7.071  -3.066  -7.728
  226   HG21  THR  37          3HG2      THR  37   7.713  -3.062  -4.387
  227   HG22  THR  37          1HG2      THR  37   6.044  -3.633  -4.330
  228   HG23  THR  37          2HG2      THR  37   6.423  -1.972  -3.880
  229    H    GLU  38           H        GLU  38   5.057   0.557  -6.866
  230    HA   GLU  38           HA       GLU  38   4.482   0.114  -9.666
  231    HB2  GLU  38           2HB      GLU  38   5.079   2.653  -8.131
  232    HB3  GLU  38           1HB      GLU  38   4.722   2.605  -9.852
  233    HG2  GLU  38           2HG      GLU  38   2.565   1.347  -9.056
  234    HG3  GLU  38           1HG      GLU  38   2.922   2.144  -7.526
  235    H    THR  39           H        THR  39   6.228  -1.148 -10.241
  236    HA   THR  39           HA       THR  39   8.919  -0.381  -9.726
  237    HB   THR  39           HB       THR  39   8.015  -2.357 -11.818
  238    HG1  THR  39           1HG      THR  39   7.716  -3.829 -10.203
  239   HG21  THR  39          3HG2      THR  39  10.106  -3.483 -11.236
  240   HG22  THR  39          1HG2      THR  39  10.449  -2.249 -10.027
  241   HG23  THR  39          2HG2      THR  39  10.419  -1.822 -11.738
  242    H    GLY  40           H        GLY  40  10.153   0.984 -10.826
  243    HA2  GLY  40           2HA      GLY  40  10.869   1.807 -13.055
  244    HA3  GLY  40           1HA      GLY  40   9.154   1.943 -13.438
  245    H    GLU  41           H        GLU  41   8.544   2.827 -10.702
  246    HA   GLU  41           HA       GLU  41   9.085   5.643 -11.046
  247    HB2  GLU  41           2HB      GLU  41   7.354   3.999  -9.246
  248    HB3  GLU  41           1HB      GLU  41   7.764   5.634  -8.752
  249    HG2  GLU  41           2HG      GLU  41   5.612   5.552  -9.877
  250    HG3  GLU  41           1HG      GLU  41   6.772   6.522 -10.779
  251    H    GLY  42           H        GLY  42  10.197   6.963  -9.575
  252    HA2  GLY  42           2HA      GLY  42  12.319   5.516  -8.158
  253    HA3  GLY  42           1HA      GLY  42  12.358   7.207  -8.638
  254    H    ALA  43           H        ALA  43   9.838   7.968  -7.609
  255    HA   ALA  43           HA       ALA  43  10.596   8.267  -4.830
  256    HB1  ALA  43           1HB      ALA  43   8.797   9.896  -4.698
  257    HB2  ALA  43           2HB      ALA  43   8.236   9.435  -6.307
  258    HB3  ALA  43           3HB      ALA  43   9.809  10.209  -6.107
  259    H    ALA  44           H        ALA  44   7.502   7.443  -6.412
  260    HA   ALA  44           HA       ALA  44   6.525   6.214  -3.999
  261    HB1  ALA  44           1HB      ALA  44   5.323   6.342  -6.764
  262    HB2  ALA  44           2HB      ALA  44   5.022   7.467  -5.439
  263    HB3  ALA  44           3HB      ALA  44   4.502   5.789  -5.305
  264    H    ALA  45           H        ALA  45   7.776   4.451  -3.553
  265    HA   ALA  45           HA       ALA  45   8.305   2.460  -5.580
  266    HB1  ALA  45           1HB      ALA  45   9.996   2.999  -3.886
  267    HB2  ALA  45           2HB      ALA  45   9.544   1.294  -3.843
  268    HB3  ALA  45           3HB      ALA  45   8.914   2.405  -2.626
  269    H    TYR  46           H        TYR  46   6.237   2.794  -2.737
  270    HA   TYR  46           HA       TYR  46   5.037   0.187  -3.416
  271    HB2  TYR  46           2HB      TYR  46   5.087   1.549  -0.713
  272    HB3  TYR  46           1HB      TYR  46   4.366  -0.014  -1.069
  273    HD1  TYR  46           1HD      TYR  46   5.830  -1.959  -1.580
  274    HD2  TYR  46           2HD      TYR  46   7.425   1.780  -0.338
  275    HE1  TYR  46           1HE      TYR  46   7.962  -3.054  -1.029
  276    HE2  TYR  46           2HE      TYR  46   9.558   0.696   0.211
  277    HH   TYR  46           HH       TYR  46  10.366  -1.571   0.818
  278    H    GLY  47           H        GLY  47   2.843   0.067  -3.655
  279    HA2  GLY  47           2HA      GLY  47   1.294   2.494  -2.984
  280    HA3  GLY  47           1HA      GLY  47   0.950   1.513  -4.409
  281    H    VAL  48           H        VAL  48   0.106   2.071  -1.239
  282    HA   VAL  48           HA       VAL  48  -0.709  -0.696  -0.736
  283    HB   VAL  48           HB       VAL  48  -0.782   1.709   1.090
  284   HG11  VAL  48          1HG1      VAL  48  -2.523   0.117   1.675
  285   HG12  VAL  48          2HG1      VAL  48  -1.231   0.074   2.875
  286   HG13  VAL  48          3HG1      VAL  48  -1.352  -1.199   1.660
  287   HG21  VAL  48          3HG2      VAL  48   1.076  -0.667   1.050
  288   HG22  VAL  48          1HG2      VAL  48   1.079   0.631   2.242
  289   HG23  VAL  48          2HG2      VAL  48   1.490   0.977   0.563
  290    H    LEU  49           H        LEU  49  -2.628  -1.258  -1.508
  291    HA   LEU  49           HA       LEU  49  -4.678   0.793  -1.808
  292    HB2  LEU  49           2HB      LEU  49  -5.836  -0.898  -3.221
  293    HB3  LEU  49           1HB      LEU  49  -4.263  -0.415  -3.819
  294    HG   LEU  49           HG       LEU  49  -3.681  -2.657  -2.322
  295   HD11  LEU  49          1HD1      LEU  49  -6.270  -3.118  -3.796
  296   HD12  LEU  49          2HD1      LEU  49  -6.035  -3.192  -2.049
  297   HD13  LEU  49          3HD1      LEU  49  -5.247  -4.371  -3.097
  298   HD21  LEU  49          3HD2      LEU  49  -4.297  -2.498  -5.270
  299   HD22  LEU  49          1HD2      LEU  49  -3.303  -3.718  -4.473
  300   HD23  LEU  49          2HD2      LEU  49  -2.771  -2.036  -4.513
  301    H    VAL  50           H        VAL  50  -6.051   1.040  -0.230
  302    HA   VAL  50           HA       VAL  50  -6.966  -1.351   1.222
  303    HB   VAL  50           HB       VAL  50  -7.659   0.301   3.044
  304   HG11  VAL  50          1HG1      VAL  50  -5.785  -1.213   3.303
  305   HG12  VAL  50          2HG1      VAL  50  -5.403   0.357   4.011
  306   HG13  VAL  50          3HG1      VAL  50  -4.732  -0.088   2.442
  307   HG21  VAL  50          3HG2      VAL  50  -5.746   2.076   1.528
  308   HG22  VAL  50          1HG2      VAL  50  -6.367   2.387   3.150
  309   HG23  VAL  50          2HG2      VAL  50  -7.470   2.367   1.772
  310    H    THR  51           H        THR  51  -9.022  -1.894   1.052
  311    HA   THR  51           HA       THR  51 -10.769  -0.161  -0.518
  312    HB   THR  51           HB       THR  51 -11.285  -2.993   0.424
  313    HG1  THR  51           1HG      THR  51  -9.441  -2.301  -1.211
  314   HG21  THR  51          3HG2      THR  51 -12.545  -1.347  -1.777
  315   HG22  THR  51          1HG2      THR  51 -13.293  -1.747  -0.231
  316   HG23  THR  51          2HG2      THR  51 -12.931  -3.024  -1.391
  317    H    ARG  52           H        ARG  52 -11.794   1.326   0.690
  318    HA   ARG  52           HA       ARG  52 -12.533   0.895   3.418
  319    HB2  ARG  52           2HB      ARG  52 -13.344   3.028   1.433
  320    HB3  ARG  52           1HB      ARG  52 -13.819   3.032   3.124
  321    HG2  ARG  52           2HG      ARG  52 -11.430   3.133   3.757
  322    HG3  ARG  52           1HG      ARG  52 -11.016   3.244   2.042
  323    HD2  ARG  52           2HD      ARG  52 -12.275   5.296   1.834
  324    HD3  ARG  52           1HD      ARG  52 -12.824   5.162   3.501
  325    HE   ARG  52           HE       ARG  52  -9.968   5.489   2.867
  326   HH11  ARG  52          1HH1      ARG  52 -12.872   6.470   4.549
  327   HH12  ARG  52          2HH1      ARG  52 -12.096   7.784   5.389
  328   HH21  ARG  52          1HH2      ARG  52  -8.932   7.230   3.987
  329   HH22  ARG  52          2HH2      ARG  52  -9.875   8.196   5.085
  330    HA   PRO  53           HA       PRO  53 -16.479  -1.122   2.870
  331    HB2  PRO  53           2HB      PRO  53 -17.509   0.563   5.064
  332    HB3  PRO  53           1HB      PRO  53 -17.380  -1.196   4.966
  333    HG2  PRO  53           2HG      PRO  53 -15.760   0.246   6.550
  334    HG3  PRO  53           1HG      PRO  53 -15.197  -1.214   5.716
  335    HD2  PRO  53           2HD      PRO  53 -14.723   1.661   5.041
  336    HD3  PRO  53           1HD      PRO  53 -13.616   0.276   4.934
  337    H    ASP  54           H        ASP  54 -15.973   2.225   2.747
  338    HA   ASP  54           HA       ASP  54 -18.550   3.124   2.018
  339    HB2  ASP  54           2HB      ASP  54 -16.724   4.602   2.808
  340    HB3  ASP  54           1HB      ASP  54 -15.846   4.286   1.315
  341    H    GLY  55           H        GLY  55 -15.985   1.525   0.297
  342    HA2  GLY  55           2HA      GLY  55 -16.707   0.265  -1.674
  343    HA3  GLY  55           1HA      GLY  55 -17.622   1.683  -2.158
  344    H    THR  56           H        THR  56 -15.127   3.233  -1.123
  345    HA   THR  56           HA       THR  56 -13.905   3.334  -3.755
  346    HB   THR  56           HB       THR  56 -14.588   5.442  -2.726
  347    HG1  THR  56           1HG      THR  56 -12.542   6.535  -2.934
  348   HG21  THR  56          3HG2      THR  56 -13.449   6.328  -0.753
  349   HG22  THR  56          1HG2      THR  56 -12.542   4.824  -0.589
  350   HG23  THR  56          2HG2      THR  56 -14.291   4.828  -0.370
  351    H    ARG  57           H        ARG  57 -11.674   3.150  -4.142
  352    HA   ARG  57           HA       ARG  57 -10.201   1.611  -2.119
  353    HB2  ARG  57           2HB      ARG  57 -10.502   0.647  -4.446
  354    HB3  ARG  57           1HB      ARG  57  -9.498   1.963  -5.039
  355    HG2  ARG  57           2HG      ARG  57  -7.715   1.155  -3.441
  356    HG3  ARG  57           1HG      ARG  57  -8.711  -0.281  -3.203
  357    HD2  ARG  57           2HD      ARG  57  -7.265  -0.968  -4.867
  358    HD3  ARG  57           1HD      ARG  57  -8.659  -0.428  -5.798
  359    HE   ARG  57           HE       ARG  57  -7.202   1.790  -5.788
  360   HH11  ARG  57          1HH1      ARG  57  -6.275  -1.538  -6.457
  361   HH12  ARG  57          2HH1      ARG  57  -4.917  -1.075  -7.449
  362   HH21  ARG  57          1HH2      ARG  57  -5.387   2.368  -7.083
  363   HH22  ARG  57          2HH2      ARG  57  -4.432   1.104  -7.805
  364    H    VAL  58           H        VAL  58  -8.738   2.687  -0.984
  365    HA   VAL  58           HA       VAL  58  -7.626   5.159  -2.122
  366    HB   VAL  58           HB       VAL  58  -7.538   4.191   0.746
  367   HG11  VAL  58          1HG1      VAL  58  -6.784   6.861  -0.440
  368   HG12  VAL  58          2HG1      VAL  58  -5.659   5.639   0.154
  369   HG13  VAL  58          3HG1      VAL  58  -6.760   6.440   1.273
  370   HG21  VAL  58          3HG2      VAL  58  -9.272   6.304  -0.527
  371   HG22  VAL  58          1HG2      VAL  58  -9.184   5.946   1.195
  372   HG23  VAL  58          2HG2      VAL  58  -9.811   4.736   0.074
  373    H    GLU  59           H        GLU  59  -5.608   5.129  -2.858
  374    HA   GLU  59           HA       GLU  59  -3.890   2.900  -2.021
  375    HB2  GLU  59           2HB      GLU  59  -2.623   3.343  -4.139
  376    HB3  GLU  59           1HB      GLU  59  -4.264   2.762  -4.369
  377    HG2  GLU  59           2HG      GLU  59  -4.988   5.078  -4.802
  378    HG3  GLU  59           1HG      GLU  59  -3.312   5.601  -4.655
  379    H    VAL  60           H        VAL  60  -2.518   3.457  -0.534
  380    HA   VAL  60           HA       VAL  60  -1.632   6.209  -0.282
  381    HB   VAL  60           HB       VAL  60  -0.762   3.861   1.403
  382   HG11  VAL  60          1HG1      VAL  60  -0.345   5.591   3.095
  383   HG12  VAL  60          2HG1      VAL  60  -0.822   6.828   1.933
  384   HG13  VAL  60          3HG1      VAL  60   0.612   5.845   1.635
  385   HG21  VAL  60          3HG2      VAL  60  -3.194   3.962   1.430
  386   HG22  VAL  60          1HG2      VAL  60  -3.133   5.680   1.828
  387   HG23  VAL  60          2HG2      VAL  60  -2.536   4.485   2.980
  388    H    HIS  61           H        HIS  61   0.061   6.909  -1.387
  389    HA   HIS  61           HA       HIS  61   1.954   5.060  -2.537
  390    HB2  HIS  61           2HB      HIS  61   1.434   7.976  -2.747
  391    HB3  HIS  61           1HB      HIS  61   3.056   7.414  -3.135
  392    HD1  HIS  61           1HD      HIS  61   0.161   8.269  -4.874
  393    HD2  HIS  61           2HD      HIS  61   2.627   4.913  -4.947
  394    HE1  HIS  61           1HE      HIS  61  -0.220   7.185  -7.110
  395    HE2  HIS  61           2HE      HIS  61   1.437   5.280  -7.209
  396    H    LEU  62           H        LEU  62   3.685   4.344  -1.583
  397    HA   LEU  62           HA       LEU  62   4.652   5.770   0.804
  398    HB2  LEU  62           2HB      LEU  62   3.822   3.034   0.350
  399    HB3  LEU  62           1HB      LEU  62   5.456   3.101   0.977
  400    HG   LEU  62           HG       LEU  62   4.793   3.877   3.027
  401   HD11  LEU  62          1HD1      LEU  62   3.734   5.931   2.218
  402   HD12  LEU  62          2HD1      LEU  62   2.739   5.153   3.449
  403   HD13  LEU  62          3HD1      LEU  62   2.303   5.013   1.746
  404   HD21  LEU  62          3HD2      LEU  62   2.737   2.736   3.701
  405   HD22  LEU  62          1HD2      LEU  62   3.749   1.716   2.678
  406   HD23  LEU  62          2HD2      LEU  62   2.321   2.502   2.003
  407    H    ASP  63           H        ASP  63   6.850   5.646   1.293
  408    HA   ASP  63           HA       ASP  63   8.591   5.599  -1.038
  409    HB2  ASP  63           2HB      ASP  63   8.749   7.508   0.471
  410    HB3  ASP  63           1HB      ASP  63   9.011   6.446   1.846
  411    H    ARG  64           H        ARG  64  10.893   4.692  -0.484
  412    HA   ARG  64           HA       ARG  64  10.780   1.934  -0.412
  413    HB2  ARG  64           2HB      ARG  64  13.111   3.672   0.409
  414    HB3  ARG  64           1HB      ARG  64  13.203   1.995  -0.107
  415    HG2  ARG  64           2HG      ARG  64  12.529   2.567  -2.325
  416    HG3  ARG  64           1HG      ARG  64  12.183   4.228  -1.840
  417    HD2  ARG  64           2HD      ARG  64  14.895   2.915  -1.770
  418    HD3  ARG  64           1HD      ARG  64  14.331   4.022  -3.019
  419    HE   ARG  64           HE       ARG  64  14.225   5.072  -0.320
  420   HH11  ARG  64          1HH1      ARG  64  16.162   4.704  -3.214
  421   HH12  ARG  64          2HH1      ARG  64  17.150   6.097  -2.887
  422   HH21  ARG  64          1HH2      ARG  64  15.496   6.896   0.116
  423   HH22  ARG  64          2HH2      ARG  64  16.761   7.361  -0.983
  424    H    ASP  65           H        ASP  65  11.257   4.198   2.243
  425    HA   ASP  65           HA       ASP  65  11.646   2.031   4.153
  426    HB2  ASP  65           2HB      ASP  65  11.737   5.032   4.368
  427    HB3  ASP  65           1HB      ASP  65  11.758   4.003   5.794
  428    H    PHE  66           H        PHE  66   9.040   2.796   2.683
  429    HA   PHE  66           HA       PHE  66   6.822   2.716   3.078
  430    HB2  PHE  66           2HB      PHE  66   7.931   1.439   5.506
  431    HB3  PHE  66           1HB      PHE  66   6.267   2.010   5.623
  432    HD1  PHE  66           1HD      PHE  66   8.538  -0.268   3.838
  433    HD2  PHE  66           2HD      PHE  66   4.516   0.955   4.447
  434    HE1  PHE  66           1HE      PHE  66   7.755  -2.263   2.632
  435    HE2  PHE  66           2HE      PHE  66   3.721  -1.039   3.252
  436    HZ   PHE  66           HZ       PHE  66   5.340  -2.645   2.340
  437    H    ARG  67           H        ARG  67   8.455   5.115   3.678
  438    HA   ARG  67           HA       ARG  67   6.935   6.522   5.682
  439    HB2  ARG  67           2HB      ARG  67   9.363   6.987   5.042
  440    HB3  ARG  67           1HB      ARG  67   8.731   7.734   3.580
  441    HG2  ARG  67           2HG      ARG  67   7.558   9.384   4.854
  442    HG3  ARG  67           1HG      ARG  67   7.979   8.580   6.366
  443    HD2  ARG  67           2HD      ARG  67  10.423   8.950   5.596
  444    HD3  ARG  67           1HD      ARG  67   9.721  10.146   4.504
  445    HE   ARG  67           HE       ARG  67   8.667  11.008   6.715
  446   HH11  ARG  67          1HH1      ARG  67  11.931   9.845   6.220
  447   HH12  ARG  67          2HH1      ARG  67  12.551  10.611   7.657
  448   HH21  ARG  67          1HH2      ARG  67   9.470  12.053   8.551
  449   HH22  ARG  67          2HH2      ARG  67  11.157  11.903   8.973
  450    H    VAL  68           H        VAL  68   5.233   7.916   5.320
  451    HA   VAL  68           HA       VAL  68   3.732   7.381   2.961
  452    HB   VAL  68           HB       VAL  68   2.598   7.722   5.088
  453   HG11  VAL  68          1HG1      VAL  68   3.543  10.576   4.903
  454   HG12  VAL  68          2HG1      VAL  68   4.043   9.381   6.100
  455   HG13  VAL  68          3HG1      VAL  68   2.377   9.957   6.071
  456   HG21  VAL  68          3HG2      VAL  68   0.835   9.256   4.325
  457   HG22  VAL  68          1HG2      VAL  68   1.347   8.141   3.058
  458   HG23  VAL  68          2HG2      VAL  68   1.901   9.816   3.035
  459    H    LEU  69           H        LEU  69   3.754   8.367   1.084
  460    HA   LEU  69           HA       LEU  69   5.121  10.945   0.835
  461    HB2  LEU  69           2HB      LEU  69   4.103   9.105  -1.339
  462    HB3  LEU  69           1HB      LEU  69   5.114  10.520  -1.562
  463    HG   LEU  69           HG       LEU  69   5.923   7.978  -0.149
  464   HD11  LEU  69          1HD1      LEU  69   6.752   9.132  -2.806
  465   HD12  LEU  69          2HD1      LEU  69   5.729   7.715  -2.559
  466   HD13  LEU  69          3HD1      LEU  69   7.420   7.682  -2.056
  467   HD21  LEU  69          3HD2      LEU  69   6.987   9.970   0.816
  468   HD22  LEU  69          1HD2      LEU  69   7.546  10.441  -0.788
  469   HD23  LEU  69          2HD2      LEU  69   8.145   8.957  -0.045
  470    H    ASP  70           H        ASP  70   2.175   9.390  -0.434
  471    HA   ASP  70           HA       ASP  70   0.592  11.691   0.286
  472    HB2  ASP  70           2HB      ASP  70   1.590  12.252  -1.976
  473    HB3  ASP  70           1HB      ASP  70   0.683  10.889  -2.628
  474    H    THR  71           H        THR  71  -1.533  11.180   0.527
  475    HA   THR  71           HA       THR  71  -2.247   8.362   0.078
  476    HB   THR  71           HB       THR  71  -3.562  10.312   1.982
  477    HG1  THR  71           1HG      THR  71  -2.282   9.338   3.592
  478   HG21  THR  71          3HG2      THR  71  -4.456   8.293   3.025
  479   HG22  THR  71          1HG2      THR  71  -3.631   7.295   1.826
  480   HG23  THR  71          2HG2      THR  71  -4.931   8.378   1.328
  481    H    GLU  72           H        GLU  72  -3.500   8.089  -1.680
  482    HA   GLU  72           HA       GLU  72  -5.468  10.174  -2.293
  483    HB2  GLU  72           2HB      GLU  72  -4.833  10.029  -4.692
  484    HB3  GLU  72           1HB      GLU  72  -3.574  10.704  -3.667
  485    HG2  GLU  72           2HG      GLU  72  -2.527   8.425  -3.624
  486    HG3  GLU  72           1HG      GLU  72  -3.694   7.946  -4.854
  487    HA   PRO  73           HA       PRO  73  -7.935   6.551  -3.301
  488    HB2  PRO  73           2HB      PRO  73 -10.183   8.290  -3.653
  489    HB3  PRO  73           1HB      PRO  73  -9.853   7.214  -2.295
  490    HG2  PRO  73           2HG      PRO  73  -9.856   9.980  -2.163
  491    HG3  PRO  73           1HG      PRO  73  -9.059   8.905  -1.003
  492    HD2  PRO  73           2HD      PRO  73  -7.885  10.446  -3.278
  493    HD3  PRO  73           1HD      PRO  73  -7.204  10.095  -1.674
  494    H    ALA  74           H        ALA  74  -8.189   5.735  -5.323
  495    HA   ALA  74           HA       ALA  74  -8.102   7.679  -7.536
  496    HB1  ALA  74           1HB      ALA  74  -6.913   6.016  -8.840
  497    HB2  ALA  74           2HB      ALA  74  -7.026   4.868  -7.505
  498    HB3  ALA  74           3HB      ALA  74  -6.067   6.337  -7.327
  499    H    ASP  75           H        ASP  75  -8.886   6.668  -9.650
  500    HA   ASP  75           HA       ASP  75 -11.349   5.130  -9.144
  501    HB2  ASP  75           2HB      ASP  75 -12.487   6.394 -10.854
  502    HB3  ASP  75           1HB      ASP  75 -11.783   7.535  -9.714
  503    H    GLY  76           H        GLY  76 -12.158   4.430 -11.551
  504    HA2  GLY  76           2HA      GLY  76  -9.814   3.180 -12.841
  505    HA3  GLY  76           1HA      GLY  76 -11.289   2.281 -12.514
  506    H    ASP  77           H        ASP  77  -9.984   5.028 -14.322
  507    HA   ASP  77           HA       ASP  77 -12.277   5.044 -16.107
  508    HB2  ASP  77           2HB      ASP  77 -11.103   7.156 -15.494
  509    HB3  ASP  77           1HB      ASP  77  -9.670   6.568 -16.332
  510    H    GLY  78           H        GLY  78  -8.780   4.495 -16.420
  511    HA2  GLY  78           2HA      GLY  78  -7.842   2.618 -17.516
  512    HA3  GLY  78           1HA      GLY  78  -9.351   2.407 -18.390
  513    H    GLY  79           H        GLY  79  -9.520   5.232 -19.158
  514    HA2  GLY  79           2HA      GLY  79  -7.908   5.049 -21.539
  515    HA3  GLY  79           1HA      GLY  79  -9.027   6.343 -21.127
  516    H    LEU  80           H        LEU  80  -5.754   5.230 -20.971
  517    HA   LEU  80           HA       LEU  80  -4.893   7.376 -19.241
  518    HB2  LEU  80           2HB      LEU  80  -3.294   5.354 -20.812
  519    HB3  LEU  80           1HB      LEU  80  -2.631   6.474 -19.637
  520    HG   LEU  80           HG       LEU  80  -4.608   4.273 -19.025
  521   HD11  LEU  80          1HD1      LEU  80  -2.728   3.206 -17.881
  522   HD12  LEU  80          2HD1      LEU  80  -1.657   4.489 -18.442
  523   HD13  LEU  80          3HD1      LEU  80  -2.410   3.397 -19.604
  524   HD21  LEU  80          3HD2      LEU  80  -3.148   6.195 -17.217
  525   HD22  LEU  80          1HD2      LEU  80  -4.116   4.823 -16.679
  526   HD23  LEU  80          2HD2      LEU  80  -4.883   6.163 -17.532
  527    H    GLU  81           H        GLU  81  -5.373   9.266 -20.313
  528    HA   GLU  81           HA       GLU  81  -3.381  10.177 -22.136
  529    HB2  GLU  81           2HB      GLU  81  -4.902   9.038 -23.733
  530    HB3  GLU  81           1HB      GLU  81  -6.223  10.059 -23.174
  531    HG2  GLU  81           2HG      GLU  81  -5.008  12.039 -23.947
  532    HG3  GLU  81           1HG      GLU  81  -3.703  11.008 -24.525
  Start of MODEL   10
    1    H1   GLY   1           1HT      GLY   1   7.744   4.475  17.899
    2    H2   GLY   1           2HT      GLY   1   8.731   3.112  18.121
    3    H3   GLY   1           3HT      GLY   1   7.314   2.993  17.196
    4    HA2  GLY   1           1HA      GLY   1   8.220   4.473  15.534
    5    HA3  GLY   1           2HA      GLY   1   9.684   4.632  16.496
    6    H    ALA   2           H        ALA   2   7.625   1.987  15.271
    7    HA   ALA   2           HA       ALA   2  10.090   0.547  14.558
    8    HB1  ALA   2           1HB      ALA   2   8.749  -1.479  14.578
    9    HB2  ALA   2           2HB      ALA   2   7.297  -0.535  14.916
   10    HB3  ALA   2           3HB      ALA   2   8.592  -0.620  16.111
   11    H    MET   3           H        MET   3  10.425  -0.186  12.487
   12    HA   MET   3           HA       MET   3   8.799   1.048  10.423
   13    HB2  MET   3           2HB      MET   3  11.307  -0.631  10.276
   14    HB3  MET   3           1HB      MET   3  10.461  -0.032   8.859
   15    HG2  MET   3           2HG      MET   3  12.196   1.478   9.191
   16    HG3  MET   3           1HG      MET   3  10.776   2.288   9.846
   17    HE1  MET   3           3HE      MET   3  13.036  -0.580  11.357
   18    HE2  MET   3           1HE      MET   3  14.131   0.368  12.363
   19    HE3  MET   3           2HE      MET   3  14.176   0.537  10.608
   20    H    ALA   4           H        ALA   4   8.047  -0.263   8.555
   21    HA   ALA   4           HA       ALA   4   6.554  -2.506   9.571
   22    HB1  ALA   4           1HB      ALA   4   5.490  -0.854   8.103
   23    HB2  ALA   4           2HB      ALA   4   5.407  -2.482   7.429
   24    HB3  ALA   4           3HB      ALA   4   6.578  -1.326   6.797
   25    H    PHE   5           H        PHE   5   8.573  -3.744   9.978
   26    HA   PHE   5           HA       PHE   5   9.060  -5.446   7.641
   27    HB2  PHE   5           2HB      PHE   5  11.186  -4.412   9.526
   28    HB3  PHE   5           1HB      PHE   5  11.436  -5.748   8.407
   29    HD1  PHE   5           2HD      PHE   5  10.950  -5.234   5.891
   30    HD2  PHE   5           1HD      PHE   5  11.654  -2.256   8.858
   31    HE1  PHE   5           2HE      PHE   5  11.572  -3.633   4.134
   32    HE2  PHE   5           1HE      PHE   5  12.273  -0.652   7.099
   33    HZ   PHE   5           HZ       PHE   5  12.234  -1.340   4.737
   34    H    ASP   6           H        ASP   6   7.685  -6.984   8.383
   35    HA   ASP   6           HA       ASP   6   8.780  -8.729  10.425
   36    HB2  ASP   6           2HB      ASP   6   7.242  -7.364  11.737
   37    HB3  ASP   6           1HB      ASP   6   5.953  -7.640  10.570
   38    H    GLY   7           H        GLY   7   5.531  -8.633   9.028
   39    HA2  GLY   7           2HA      GLY   7   4.698  -9.641   7.128
   40    HA3  GLY   7           1HA      GLY   7   6.311 -10.218   6.756
   41    H    GLU   8           H        GLU   8   3.480 -11.404   6.933
   42    HA   GLU   8           HA       GLU   8   3.909 -13.665   8.676
   43    HB2  GLU   8           2HB      GLU   8   1.638 -12.786   8.113
   44    HB3  GLU   8           1HB      GLU   8   1.893 -13.286   6.448
   45    HG2  GLU   8           2HG      GLU   8   2.004 -15.600   7.119
   46    HG3  GLU   8           1HG      GLU   8   1.871 -15.138   8.816
   47    H    ASP   9           H        ASP   9   4.713 -15.650   8.069
   48    HA   ASP   9           HA       ASP   9   6.494 -15.504   5.812
   49    HB2  ASP   9           2HB      ASP   9   6.070 -17.577   7.956
   50    HB3  ASP   9           1HB      ASP   9   7.226 -17.789   6.646
   51    H    GLU  10           H        GLU  10   3.344 -16.273   5.908
   52    HA   GLU  10           HA       GLU  10   3.631 -18.417   3.914
   53    HB2  GLU  10           2HB      GLU  10   1.243 -17.744   5.628
   54    HB3  GLU  10           1HB      GLU  10   1.306 -19.030   4.430
   55    HG2  GLU  10           2HG      GLU  10   3.226 -19.994   5.754
   56    HG3  GLU  10           1HG      GLU  10   2.815 -18.832   7.015
   57    H    VAL  11           H        VAL  11   3.367 -15.222   3.889
   58    HA   VAL  11           HA       VAL  11   1.208 -14.983   1.962
   59    HB   VAL  11           HB       VAL  11   1.797 -12.632   1.795
   60   HG11  VAL  11          1HG1      VAL  11   0.377 -13.337   3.649
   61   HG12  VAL  11          2HG1      VAL  11   1.378 -11.957   4.101
   62   HG13  VAL  11          3HG1      VAL  11   1.807 -13.574   4.659
   63   HG21  VAL  11          3HG2      VAL  11   3.624 -11.669   3.129
   64   HG22  VAL  11          1HG2      VAL  11   4.223 -12.797   1.912
   65   HG23  VAL  11          2HG2      VAL  11   4.124 -13.294   3.602
   66    H    THR  12           H        THR  12   1.597 -14.105  -0.221
   67    HA   THR  12           HA       THR  12   3.946 -15.412  -1.351
   68    HB   THR  12           HB       THR  12   2.761 -14.875  -3.562
   69    HG1  THR  12           1HG      THR  12   0.345 -14.794  -3.006
   70   HG21  THR  12          3HG2      THR  12   1.278 -16.813  -3.333
   71   HG22  THR  12          1HG2      THR  12   1.449 -16.735  -1.579
   72   HG23  THR  12          2HG2      THR  12   2.847 -17.112  -2.585
   73    H    GLY  13           H        GLY  13   2.614 -12.233  -0.833
   74    HA2  GLY  13           2HA      GLY  13   4.731 -11.015  -2.455
   75    HA3  GLY  13           1HA      GLY  13   3.409 -10.168  -1.661
   76    HA   PRO  14           HA       PRO  14   7.322 -11.232   1.203
   77    HB2  PRO  14           2HB      PRO  14   9.341  -9.667   0.113
   78    HB3  PRO  14           1HB      PRO  14   9.199 -11.419  -0.056
   79    HG2  PRO  14           2HG      PRO  14   8.401  -9.260  -1.958
   80    HG3  PRO  14           1HG      PRO  14   9.124 -10.845  -2.292
   81    HD2  PRO  14           2HD      PRO  14   6.512 -10.388  -2.688
   82    HD3  PRO  14           1HD      PRO  14   7.102 -11.953  -2.092
   83    H    ASP  15           H        ASP  15   7.318  -8.110  -0.542
   84    HA   ASP  15           HA       ASP  15   7.401  -6.702   2.006
   85    HB2  ASP  15           2HB      ASP  15   7.482  -4.664   0.448
   86    HB3  ASP  15           1HB      ASP  15   8.861  -5.757   0.421
   87    H    ALA  16           H        ALA  16   5.088  -7.935   0.003
   88    HA   ALA  16           HA       ALA  16   3.148  -5.890  -0.071
   89    HB1  ALA  16           1HB      ALA  16   1.598  -7.650  -0.716
   90    HB2  ALA  16           2HB      ALA  16   2.773  -8.873  -0.229
   91    HB3  ALA  16           3HB      ALA  16   3.125  -7.803  -1.585
   92    H    ASP  17           H        ASP  17   3.699  -8.572   2.166
   93    HA   ASP  17           HA       ASP  17   1.341  -8.532   3.596
   94    HB2  ASP  17           2HB      ASP  17   3.010 -10.266   3.911
   95    HB3  ASP  17           1HB      ASP  17   4.134  -9.099   4.597
   96    H    ARG  18           H        ARG  18   4.329  -6.782   4.474
   97    HA   ARG  18           HA       ARG  18   3.079  -5.640   6.759
   98    HB2  ARG  18           2HB      ARG  18   5.179  -4.162   6.792
   99    HB3  ARG  18           1HB      ARG  18   5.351  -5.885   7.068
  100    HG2  ARG  18           2HG      ARG  18   5.667  -4.912   4.291
  101    HG3  ARG  18           1HG      ARG  18   6.945  -4.534   5.446
  102    HD2  ARG  18           2HD      ARG  18   6.800  -7.060   6.037
  103    HD3  ARG  18           1HD      ARG  18   5.992  -7.201   4.477
  104    HE   ARG  18           HE       ARG  18   8.200  -5.843   3.824
  105   HH11  ARG  18          1HH1      ARG  18   7.713  -8.782   5.668
  106   HH12  ARG  18          2HH1      ARG  18   9.305  -9.403   5.347
  107   HH21  ARG  18          1HH2      ARG  18  10.303  -6.675   3.388
  108   HH22  ARG  18          2HH2      ARG  18  10.758  -8.217   4.041
  109    H    ALA  19           H        ALA  19   3.552  -4.517   3.481
  110    HA   ALA  19           HA       ALA  19   2.954  -1.787   4.013
  111    HB1  ALA  19           1HB      ALA  19   4.120  -2.438   1.987
  112    HB2  ALA  19           2HB      ALA  19   2.624  -1.589   1.592
  113    HB3  ALA  19           3HB      ALA  19   2.708  -3.344   1.443
  114    H    ARG  20           H        ARG  20   1.026  -4.588   3.090
  115    HA   ARG  20           HA       ARG  20  -1.410  -3.087   2.913
  116    HB2  ARG  20           2HB      ARG  20  -1.893  -4.887   1.686
  117    HB3  ARG  20           1HB      ARG  20  -0.518  -5.764   2.328
  118    HG2  ARG  20           2HG      ARG  20  -3.022  -5.585   3.942
  119    HG3  ARG  20           1HG      ARG  20  -2.932  -6.703   2.580
  120    HD2  ARG  20           2HD      ARG  20  -0.879  -7.673   3.569
  121    HD3  ARG  20           1HD      ARG  20  -1.079  -6.606   4.959
  122    HE   ARG  20           HE       ARG  20  -3.456  -7.997   4.722
  123   HH11  ARG  20          1HH1      ARG  20  -0.087  -8.781   5.198
  124   HH12  ARG  20          2HH1      ARG  20  -0.399 -10.232   6.088
  125   HH21  ARG  20          1HH2      ARG  20  -3.900  -9.892   5.936
  126   HH22  ARG  20          2HH2      ARG  20  -2.574 -10.866   6.522
  127    H    ALA  21           H        ALA  21   0.337  -4.708   5.435
  128    HA   ALA  21           HA       ALA  21  -1.846  -4.890   7.277
  129    HB1  ALA  21           1HB      ALA  21   0.133  -6.331   7.451
  130    HB2  ALA  21           2HB      ALA  21  -0.157  -5.431   8.939
  131    HB3  ALA  21           3HB      ALA  21   1.121  -4.919   7.836
  132    H    ALA  22           H        ALA  22   0.598  -2.485   6.540
  133    HA   ALA  22           HA       ALA  22   0.074  -0.818   8.789
  134    HB1  ALA  22           1HB      ALA  22   2.186  -0.738   7.548
  135    HB2  ALA  22           2HB      ALA  22   1.414   0.846   7.631
  136    HB3  ALA  22           3HB      ALA  22   1.332  -0.098   6.144
  137    H    ALA  23           H        ALA  23  -1.392  -1.229   5.686
  138    HA   ALA  23           HA       ALA  23  -2.697   1.297   5.535
  139    HB1  ALA  23           1HB      ALA  23  -2.256  -0.062   3.560
  140    HB2  ALA  23           2HB      ALA  23  -3.976   0.301   3.720
  141    HB3  ALA  23           3HB      ALA  23  -3.366  -1.296   4.155
  142    H    VAL  24           H        VAL  24  -3.359  -1.633   7.213
  143    HA   VAL  24           HA       VAL  24  -6.167  -1.507   7.378
  144    HB   VAL  24           HB       VAL  24  -4.241  -2.710   9.382
  145   HG11  VAL  24          1HG1      VAL  24  -6.119  -4.145  10.018
  146   HG12  VAL  24          2HG1      VAL  24  -7.165  -3.271   8.898
  147   HG13  VAL  24          3HG1      VAL  24  -6.482  -2.442  10.296
  148   HG21  VAL  24          3HG2      VAL  24  -5.585  -3.942   6.978
  149   HG22  VAL  24          1HG2      VAL  24  -4.646  -4.818   8.189
  150   HG23  VAL  24          2HG2      VAL  24  -3.862  -3.615   7.168
  151    H    GLN  25           H        GLN  25  -3.681   0.249   9.026
  152    HA   GLN  25           HA       GLN  25  -5.357   1.056  11.224
  153    HB2  GLN  25           2HB      GLN  25  -2.630   1.942  10.296
  154    HB3  GLN  25           1HB      GLN  25  -3.449   2.680  11.661
  155    HG2  GLN  25           2HG      GLN  25  -1.892   1.076  12.483
  156    HG3  GLN  25           1HG      GLN  25  -3.521   0.466  12.764
  157   HE21  GLN  25          1HE2      GLN  25  -0.629   0.143  10.840
  158   HE22  GLN  25          2HE2      GLN  25  -0.957  -1.460  10.266
  159    H    ALA  26           H        ALA  26  -5.041   1.998   8.010
  160    HA   ALA  26           HA       ALA  26  -5.903   4.752   8.564
  161    HB1  ALA  26           1HB      ALA  26  -5.251   5.261   6.276
  162    HB2  ALA  26           2HB      ALA  26  -4.845   3.568   5.999
  163    HB3  ALA  26           3HB      ALA  26  -3.915   4.520   7.156
  164    H    VAL  27           H        VAL  27  -7.290   1.846   8.024
  165    HA   VAL  27           HA       VAL  27  -9.670   3.119   6.930
  166    HB   VAL  27           HB       VAL  27  -8.615   2.208   4.948
  167   HG11  VAL  27          1HG1      VAL  27  -8.672  -0.466   6.335
  168   HG12  VAL  27          2HG1      VAL  27  -7.230   0.486   5.979
  169   HG13  VAL  27          3HG1      VAL  27  -8.198  -0.176   4.662
  170   HG21  VAL  27          3HG2      VAL  27 -11.024   2.144   5.005
  171   HG22  VAL  27          1HG2      VAL  27 -10.994   0.588   5.838
  172   HG23  VAL  27          2HG2      VAL  27 -10.415   0.711   4.177
  173    HA   PRO  28           HA       PRO  28 -11.186   0.721  10.376
  174    HB2  PRO  28           2HB      PRO  28 -13.745   1.644  10.253
  175    HB3  PRO  28           1HB      PRO  28 -12.417   2.555  10.982
  176    HG2  PRO  28           2HG      PRO  28 -13.645   2.833   8.271
  177    HG3  PRO  28           1HG      PRO  28 -13.113   4.096   9.397
  178    HD2  PRO  28           2HD      PRO  28 -11.643   3.320   7.249
  179    HD3  PRO  28           1HD      PRO  28 -10.914   3.918   8.753
  180    H    GLY  29           H        GLY  29 -11.039  -1.334   9.477
  181    HA2  GLY  29           2HA      GLY  29 -11.953  -3.350   8.856
  182    HA3  GLY  29           1HA      GLY  29 -13.532  -2.577   8.919
  183    H    GLY  30           H        GLY  30 -10.737  -1.794   6.877
  184    HA2  GLY  30           2HA      GLY  30 -12.507  -2.039   4.547
  185    HA3  GLY  30           1HA      GLY  30 -10.994  -1.145   4.596
  186    H    THR  31           H        THR  31 -11.587  -2.906   2.535
  187    HA   THR  31           HA       THR  31 -10.236  -5.417   3.079
  188    HB   THR  31           HB       THR  31 -11.310  -4.364   0.453
  189    HG1  THR  31           1HG      THR  31 -13.041  -5.992   1.107
  190   HG21  THR  31          3HG2      THR  31  -9.712  -6.190   0.194
  191   HG22  THR  31          1HG2      THR  31 -11.344  -6.741  -0.185
  192   HG23  THR  31          2HG2      THR  31 -10.609  -7.158   1.363
  193    H    ALA  32           H        ALA  32  -8.091  -5.414   3.128
  194    HA   ALA  32           HA       ALA  32  -6.628  -3.657   1.283
  195    HB1  ALA  32           1HB      ALA  32  -6.091  -3.295   3.621
  196    HB2  ALA  32           2HB      ALA  32  -4.700  -3.985   2.781
  197    HB3  ALA  32           3HB      ALA  32  -5.699  -5.003   3.818
  198    H    GLY  33           H        GLY  33  -5.429  -4.512  -0.313
  199    HA2  GLY  33           2HA      GLY  33  -5.176  -7.453  -0.368
  200    HA3  GLY  33           1HA      GLY  33  -5.180  -6.415  -1.791
  201    H    GLU  34           H        GLU  34  -3.183  -8.336  -1.293
  202    HA   GLU  34           HA       GLU  34  -0.901  -7.209  -0.076
  203    HB2  GLU  34           2HB      GLU  34  -1.269  -9.432  -2.066
  204    HB3  GLU  34           1HB      GLU  34   0.340  -8.908  -1.577
  205    HG2  GLU  34           2HG      GLU  34  -0.226  -9.363   0.761
  206    HG3  GLU  34           1HG      GLU  34  -1.825  -9.902   0.265
  207    H    VAL  35           H        VAL  35   0.772  -6.050  -0.849
  208    HA   VAL  35           HA       VAL  35  -0.019  -4.293  -3.017
  209    HB   VAL  35           HB       VAL  35   1.366  -2.656  -2.098
  210   HG11  VAL  35          1HG1      VAL  35   0.303  -4.319   0.171
  211   HG12  VAL  35          2HG1      VAL  35  -0.538  -3.035  -0.698
  212   HG13  VAL  35          3HG1      VAL  35   0.849  -2.649   0.323
  213   HG21  VAL  35          3HG2      VAL  35   2.780  -4.793  -0.508
  214   HG22  VAL  35          1HG2      VAL  35   3.120  -3.064  -0.448
  215   HG23  VAL  35          2HG2      VAL  35   3.415  -3.971  -1.933
  216    H    GLU  36           H        GLU  36   1.511  -3.532  -4.575
  217    HA   GLU  36           HA       GLU  36   3.496  -5.584  -5.269
  218    HB2  GLU  36           2HB      GLU  36   2.105  -3.496  -6.958
  219    HB3  GLU  36           1HB      GLU  36   3.452  -4.467  -7.536
  220    HG2  GLU  36           2HG      GLU  36   2.110  -6.499  -7.102
  221    HG3  GLU  36           1HG      GLU  36   0.752  -5.462  -6.664
  222    H    THR  37           H        THR  37   5.592  -5.064  -5.567
  223    HA   THR  37           HA       THR  37   6.577  -2.663  -4.394
  224    HB   THR  37           HB       THR  37   8.322  -4.361  -6.114
  225    HG1  THR  37           1HG      THR  37   7.303  -5.260  -3.588
  226   HG21  THR  37          3HG2      THR  37   9.872  -4.110  -4.269
  227   HG22  THR  37          1HG2      THR  37   8.615  -3.375  -3.272
  228   HG23  THR  37          2HG2      THR  37   9.217  -2.529  -4.697
  229    H    GLU  38           H        GLU  38   6.207  -0.794  -5.495
  230    HA   GLU  38           HA       GLU  38   6.110  -0.676  -8.346
  231    HB2  GLU  38           2HB      GLU  38   6.241   1.572  -6.324
  232    HB3  GLU  38           1HB      GLU  38   5.885   1.762  -8.036
  233    HG2  GLU  38           2HG      GLU  38   3.916   0.214  -7.653
  234    HG3  GLU  38           1HG      GLU  38   4.220   0.416  -5.929
  235    H    THR  39           H        THR  39   7.628   0.033  -9.776
  236    HA   THR  39           HA       THR  39  10.273   0.663  -8.660
  237    HB   THR  39           HB       THR  39  10.223  -1.686  -9.436
  238    HG1  THR  39           1HG      THR  39  12.192  -0.598  -9.590
  239   HG21  THR  39          3HG2      THR  39  10.054  -2.177 -11.834
  240   HG22  THR  39          1HG2      THR  39   9.662  -0.487 -12.151
  241   HG23  THR  39          2HG2      THR  39   8.556  -1.485 -11.210
  242    H    GLY  40           H        GLY  40  11.638   1.952 -10.023
  243    HA2  GLY  40           2HA      GLY  40  12.004   3.283 -11.976
  244    HA3  GLY  40           1HA      GLY  40  10.265   3.304 -12.242
  245    H    GLU  41           H        GLU  41  10.055   3.774  -9.207
  246    HA   GLU  41           HA       GLU  41  10.213   6.686  -9.418
  247    HB2  GLU  41           2HB      GLU  41   8.206   5.064  -8.533
  248    HB3  GLU  41           1HB      GLU  41   9.005   5.452  -7.018
  249    HG2  GLU  41           2HG      GLU  41   7.939   7.452  -8.999
  250    HG3  GLU  41           1HG      GLU  41   7.148   6.964  -7.503
  251    H    GLY  42           H        GLY  42  11.109   7.924  -7.632
  252    HA2  GLY  42           2HA      GLY  42  13.529   6.664  -6.623
  253    HA3  GLY  42           1HA      GLY  42  13.123   8.370  -6.529
  254    H    ALA  43           H        ALA  43  10.471   7.824  -5.358
  255    HA   ALA  43           HA       ALA  43  11.404   7.163  -2.642
  256    HB1  ALA  43           1HB      ALA  43  10.744   9.496  -2.879
  257    HB2  ALA  43           2HB      ALA  43   9.639   8.634  -1.807
  258    HB3  ALA  43           3HB      ALA  43   9.156   9.000  -3.464
  259    H    ALA  44           H        ALA  44   8.515   7.060  -4.724
  260    HA   ALA  44           HA       ALA  44   7.081   5.291  -3.031
  261    HB1  ALA  44           1HB      ALA  44   6.676   5.852  -5.968
  262    HB2  ALA  44           2HB      ALA  44   5.965   6.761  -4.633
  263    HB3  ALA  44           3HB      ALA  44   5.518   5.074  -4.888
  264    H    ALA  45           H        ALA  45   7.988   3.404  -2.536
  265    HA   ALA  45           HA       ALA  45   9.048   1.751  -4.729
  266    HB1  ALA  45           1HB      ALA  45   9.641   1.508  -1.785
  267    HB2  ALA  45           2HB      ALA  45  10.646   2.377  -2.945
  268    HB3  ALA  45           3HB      ALA  45  10.423   0.635  -3.102
  269    H    TYR  46           H        TYR  46   6.484   2.044  -2.559
  270    HA   TYR  46           HA       TYR  46   5.645  -0.717  -3.117
  271    HB2  TYR  46           2HB      TYR  46   5.165   0.615  -0.447
  272    HB3  TYR  46           1HB      TYR  46   4.878  -1.065  -0.877
  273    HD1  TYR  46           2HD      TYR  46   7.385   1.409   0.096
  274    HD2  TYR  46           1HD      TYR  46   6.723  -2.665  -0.933
  275    HE1  TYR  46           2HE      TYR  46   9.592   0.831   1.002
  276    HE2  TYR  46           1HE      TYR  46   8.933  -3.255  -0.017
  277    HH   TYR  46           HH       TYR  46  10.794  -1.025   1.847
  278    H    GLY  47           H        GLY  47   3.584  -0.830  -3.851
  279    HA2  GLY  47           2HA      GLY  47   1.902   1.581  -3.527
  280    HA3  GLY  47           1HA      GLY  47   1.845   0.513  -4.929
  281    H    VAL  48           H        VAL  48   0.380   1.280  -2.056
  282    HA   VAL  48           HA       VAL  48  -0.573  -1.421  -1.466
  283    HB   VAL  48           HB       VAL  48  -1.164   1.124   0.049
  284   HG11  VAL  48          1HG1      VAL  48  -1.692  -0.404   1.895
  285   HG12  VAL  48          2HG1      VAL  48  -1.387  -1.774   0.829
  286   HG13  VAL  48          3HG1      VAL  48  -2.722  -0.674   0.490
  287   HG21  VAL  48          3HG2      VAL  48   0.603   0.437   1.619
  288   HG22  VAL  48          1HG2      VAL  48   1.242   0.778   0.010
  289   HG23  VAL  48          2HG2      VAL  48   1.029  -0.892   0.538
  290    H    LEU  49           H        LEU  49  -2.569  -2.113  -2.032
  291    HA   LEU  49           HA       LEU  49  -4.417  -0.113  -3.128
  292    HB2  LEU  49           2HB      LEU  49  -5.590  -2.039  -4.157
  293    HB3  LEU  49           1HB      LEU  49  -3.939  -1.849  -4.701
  294    HG   LEU  49           HG       LEU  49  -3.809  -3.657  -2.558
  295   HD11  LEU  49          1HD1      LEU  49  -5.364  -5.417  -3.259
  296   HD12  LEU  49          2HD1      LEU  49  -6.087  -4.305  -4.423
  297   HD13  LEU  49          3HD1      LEU  49  -6.209  -3.975  -2.695
  298   HD21  LEU  49          3HD2      LEU  49  -3.105  -5.215  -4.285
  299   HD22  LEU  49          1HD2      LEU  49  -2.415  -3.618  -4.576
  300   HD23  LEU  49          2HD2      LEU  49  -3.792  -4.169  -5.530
  301    H    VAL  50           H        VAL  50  -5.854   0.627  -1.764
  302    HA   VAL  50           HA       VAL  50  -6.874  -1.162   0.348
  303    HB   VAL  50           HB       VAL  50  -6.671   1.855   0.406
  304   HG11  VAL  50          1HG1      VAL  50  -8.543   0.977   1.710
  305   HG12  VAL  50          2HG1      VAL  50  -7.290   1.657   2.749
  306   HG13  VAL  50          3HG1      VAL  50  -7.438  -0.092   2.575
  307   HG21  VAL  50          3HG2      VAL  50  -5.020  -0.207   1.861
  308   HG22  VAL  50          1HG2      VAL  50  -4.893   1.543   2.039
  309   HG23  VAL  50          2HG2      VAL  50  -4.474   0.780   0.505
  310    H    THR  51           H        THR  51  -8.914  -1.758   0.077
  311    HA   THR  51           HA       THR  51 -10.716  -0.025  -1.460
  312    HB   THR  51           HB       THR  51 -11.192  -2.874  -0.559
  313    HG1  THR  51           1HG      THR  51  -9.400  -2.223  -2.213
  314   HG21  THR  51          3HG2      THR  51 -12.545  -1.177  -2.665
  315   HG22  THR  51          1HG2      THR  51 -13.224  -1.604  -1.090
  316   HG23  THR  51          2HG2      THR  51 -12.925  -2.858  -2.292
  317    H    ARG  52           H        ARG  52 -11.643   1.427  -0.160
  318    HA   ARG  52           HA       ARG  52 -12.115   0.909   2.627
  319    HB2  ARG  52           2HB      ARG  52 -12.751   3.235   0.820
  320    HB3  ARG  52           1HB      ARG  52 -13.282   3.184   2.495
  321    HG2  ARG  52           2HG      ARG  52 -10.926   2.960   3.197
  322    HG3  ARG  52           1HG      ARG  52 -10.439   3.124   1.508
  323    HD2  ARG  52           2HD      ARG  52 -11.205   5.341   1.389
  324    HD3  ARG  52           1HD      ARG  52 -12.142   5.184   2.875
  325    HE   ARG  52           HE       ARG  52  -9.202   5.051   2.942
  326   HH11  ARG  52          1HH1      ARG  52 -12.197   6.621   3.847
  327   HH12  ARG  52          2HH1      ARG  52 -11.466   7.548   5.129
  328   HH21  ARG  52          1HH2      ARG  52  -8.234   6.299   4.600
  329   HH22  ARG  52          2HH2      ARG  52  -9.221   7.391   5.526
  330    HA   PRO  53           HA       PRO  53 -16.123  -0.870   2.531
  331    HB2  PRO  53           2HB      PRO  53 -17.283   0.439   4.674
  332    HB3  PRO  53           1HB      PRO  53 -16.222  -0.967   4.801
  333    HG2  PRO  53           2HG      PRO  53 -15.579   1.931   5.142
  334    HG3  PRO  53           1HG      PRO  53 -15.003   0.535   6.072
  335    HD2  PRO  53           2HD      PRO  53 -13.463   1.710   4.224
  336    HD3  PRO  53           1HD      PRO  53 -13.438  -0.050   4.466
  337    H    ASP  54           H        ASP  54 -15.711   2.547   2.348
  338    HA   ASP  54           HA       ASP  54 -18.409   3.280   1.850
  339    HB2  ASP  54           2HB      ASP  54 -15.869   4.683   0.990
  340    HB3  ASP  54           1HB      ASP  54 -17.478   5.395   1.049
  341    H    GLY  55           H        GLY  55 -16.087   1.631  -0.018
  342    HA2  GLY  55           2HA      GLY  55 -16.626   0.578  -2.067
  343    HA3  GLY  55           1HA      GLY  55 -17.878   1.783  -2.329
  344    H    THR  56           H        THR  56 -14.583   2.543  -1.416
  345    HA   THR  56           HA       THR  56 -14.087   3.534  -4.134
  346    HB   THR  56           HB       THR  56 -14.728   5.456  -2.761
  347    HG1  THR  56           1HG      THR  56 -13.106   5.775  -4.336
  348   HG21  THR  56          3HG2      THR  56 -12.367   4.768  -1.007
  349   HG22  THR  56          1HG2      THR  56 -14.059   4.533  -0.565
  350   HG23  THR  56          2HG2      THR  56 -13.437   6.161  -0.837
  351    H    ARG  57           H        ARG  57 -11.909   3.552  -4.785
  352    HA   ARG  57           HA       ARG  57 -10.215   1.735  -3.209
  353    HB2  ARG  57           2HB      ARG  57 -10.882   0.896  -5.425
  354    HB3  ARG  57           1HB      ARG  57 -10.179   2.321  -6.177
  355    HG2  ARG  57           2HG      ARG  57  -7.969   1.657  -5.445
  356    HG3  ARG  57           1HG      ARG  57  -8.647   0.269  -4.591
  357    HD2  ARG  57           2HD      ARG  57  -9.428  -0.668  -6.691
  358    HD3  ARG  57           1HD      ARG  57  -8.836   0.745  -7.564
  359    HE   ARG  57           HE       ARG  57  -6.597  -0.117  -6.397
  360   HH11  ARG  57          1HH1      ARG  57  -9.082  -1.881  -8.140
  361   HH12  ARG  57          2HH1      ARG  57  -7.967  -3.063  -8.763
  362   HH21  ARG  57          1HH2      ARG  57  -5.156  -1.694  -7.209
  363   HH22  ARG  57          2HH2      ARG  57  -5.757  -2.969  -8.230
  364    H    VAL  58           H        VAL  58  -8.516   2.571  -2.272
  365    HA   VAL  58           HA       VAL  58  -7.325   5.042  -3.368
  366    HB   VAL  58           HB       VAL  58  -7.411   4.176  -0.465
  367   HG11  VAL  58          1HG1      VAL  58  -6.376   6.703  -1.743
  368   HG12  VAL  58          2HG1      VAL  58  -5.419   5.455  -0.946
  369   HG13  VAL  58          3HG1      VAL  58  -6.541   6.440  -0.007
  370   HG21  VAL  58          3HG2      VAL  58  -8.944   6.049  -0.119
  371   HG22  VAL  58          1HG2      VAL  58  -9.616   4.861  -1.235
  372   HG23  VAL  58          2HG2      VAL  58  -8.944   6.370  -1.853
  373    H    GLU  59           H        GLU  59  -5.145   4.954  -3.795
  374    HA   GLU  59           HA       GLU  59  -3.782   2.521  -2.891
  375    HB2  GLU  59           2HB      GLU  59  -2.177   2.867  -4.734
  376    HB3  GLU  59           1HB      GLU  59  -3.819   2.603  -5.291
  377    HG2  GLU  59           2HG      GLU  59  -4.063   4.995  -5.716
  378    HG3  GLU  59           1HG      GLU  59  -2.418   5.265  -5.135
  379    H    VAL  60           H        VAL  60  -2.248   2.667  -1.471
  380    HA   VAL  60           HA       VAL  60  -1.384   5.320  -0.597
  381    HB   VAL  60           HB       VAL  60  -0.873   2.654   0.734
  382   HG11  VAL  60          1HG1      VAL  60   0.653   4.382   1.443
  383   HG12  VAL  60          2HG1      VAL  60  -0.492   4.023   2.736
  384   HG13  VAL  60          3HG1      VAL  60  -0.695   5.476   1.758
  385   HG21  VAL  60          3HG2      VAL  60  -3.087   4.628   1.266
  386   HG22  VAL  60          1HG2      VAL  60  -2.734   3.195   2.229
  387   HG23  VAL  60          2HG2      VAL  60  -3.270   3.023   0.557
  388    H    HIS  61           H        HIS  61   0.579   6.062  -1.060
  389    HA   HIS  61           HA       HIS  61   2.486   4.224  -2.316
  390    HB2  HIS  61           2HB      HIS  61   2.287   7.230  -2.328
  391    HB3  HIS  61           1HB      HIS  61   3.631   6.348  -3.040
  392    HD1  HIS  61           1HD      HIS  61   0.143   7.416  -3.709
  393    HD2  HIS  61           2HD      HIS  61   2.927   4.771  -5.333
  394    HE1  HIS  61           1HE      HIS  61  -0.745   6.791  -5.972
  395    HE2  HIS  61           2HE      HIS  61   0.831   5.032  -6.827
  396    H    LEU  62           H        LEU  62   4.203   3.557  -1.283
  397    HA   LEU  62           HA       LEU  62   4.941   4.898   1.239
  398    HB2  LEU  62           2HB      LEU  62   4.602   2.092   0.436
  399    HB3  LEU  62           1HB      LEU  62   6.049   2.407   1.372
  400    HG   LEU  62           HG       LEU  62   4.882   2.841   3.295
  401   HD11  LEU  62          1HD1      LEU  62   2.589   3.686   3.397
  402   HD12  LEU  62          2HD1      LEU  62   2.486   3.637   1.638
  403   HD13  LEU  62          3HD1      LEU  62   3.609   4.747   2.423
  404   HD21  LEU  62          3HD2      LEU  62   3.023   1.292   3.496
  405   HD22  LEU  62          1HD2      LEU  62   4.348   0.575   2.576
  406   HD23  LEU  62          2HD2      LEU  62   2.917   1.181   1.738
  407    H    ASP  63           H        ASP  63   7.122   5.135   1.763
  408    HA   ASP  63           HA       ASP  63   8.892   5.329  -0.541
  409    HB2  ASP  63           2HB      ASP  63   8.810   7.266   0.895
  410    HB3  ASP  63           1HB      ASP  63   9.110   6.287   2.323
  411    H    ARG  64           H        ARG  64  11.256   4.773  -0.022
  412    HA   ARG  64           HA       ARG  64  11.708   2.106  -0.090
  413    HB2  ARG  64           2HB      ARG  64  13.707   3.757   1.381
  414    HB3  ARG  64           1HB      ARG  64  13.953   2.593   0.086
  415    HG2  ARG  64           2HG      ARG  64  13.513   4.126  -1.562
  416    HG3  ARG  64           1HG      ARG  64  12.536   5.146  -0.500
  417    HD2  ARG  64           2HD      ARG  64  15.533   4.840  -0.500
  418    HD3  ARG  64           1HD      ARG  64  14.601   6.279  -0.918
  419    HE   ARG  64           HE       ARG  64  14.521   5.147   1.802
  420   HH11  ARG  64          1HH1      ARG  64  14.983   7.876  -0.345
  421   HH12  ARG  64          2HH1      ARG  64  15.251   8.998   0.953
  422   HH21  ARG  64          1HH2      ARG  64  14.853   6.602   3.487
  423   HH22  ARG  64          2HH2      ARG  64  15.183   8.278   3.128
  424    H    ASP  65           H        ASP  65  11.918   4.119   2.840
  425    HA   ASP  65           HA       ASP  65  12.484   1.794   4.492
  426    HB2  ASP  65           2HB      ASP  65  12.127   4.697   5.281
  427    HB3  ASP  65           1HB      ASP  65  12.749   3.415   6.312
  428    H    PHE  66           H        PHE  66   9.810   2.389   3.155
  429    HA   PHE  66           HA       PHE  66   7.625   2.023   3.551
  430    HB2  PHE  66           2HB      PHE  66   8.870   0.787   5.928
  431    HB3  PHE  66           1HB      PHE  66   7.152   1.163   6.057
  432    HD1  PHE  66           2HD      PHE  66   5.716   0.439   4.000
  433    HD2  PHE  66           1HD      PHE  66   9.483  -1.250   5.025
  434    HE1  PHE  66           2HE      PHE  66   5.158  -1.570   2.711
  435    HE2  PHE  66           1HE      PHE  66   8.930  -3.269   3.727
  436    HZ   PHE  66           HZ       PHE  66   6.759  -3.423   2.574
  437    H    ARG  67           H        ARG  67   8.930   4.581   4.184
  438    HA   ARG  67           HA       ARG  67   7.261   5.742   6.232
  439    HB2  ARG  67           2HB      ARG  67   9.553   6.615   5.617
  440    HB3  ARG  67           1HB      ARG  67   8.865   7.172   4.099
  441    HG2  ARG  67           2HG      ARG  67   8.935   9.033   5.562
  442    HG3  ARG  67           1HG      ARG  67   7.243   8.538   5.442
  443    HD2  ARG  67           2HD      ARG  67   7.603   7.208   7.549
  444    HD3  ARG  67           1HD      ARG  67   9.169   8.005   7.693
  445    HE   ARG  67           HE       ARG  67   6.585   9.431   7.723
  446   HH11  ARG  67          1HH1      ARG  67   9.907   9.072   8.780
  447   HH12  ARG  67          2HH1      ARG  67   9.810  10.361   9.942
  448   HH21  ARG  67          1HH2      ARG  67   6.458  11.152   9.214
  449   HH22  ARG  67          2HH2      ARG  67   7.846  11.552  10.182
  450    H    VAL  68           H        VAL  68   5.200   6.362   5.922
  451    HA   VAL  68           HA       VAL  68   3.897   6.036   3.448
  452    HB   VAL  68           HB       VAL  68   2.654   5.846   5.528
  453   HG11  VAL  68          1HG1      VAL  68   3.812   7.505   6.860
  454   HG12  VAL  68          2HG1      VAL  68   2.074   7.815   6.866
  455   HG13  VAL  68          3HG1      VAL  68   3.142   8.799   5.867
  456   HG21  VAL  68          3HG2      VAL  68   1.683   8.131   3.817
  457   HG22  VAL  68          1HG2      VAL  68   0.689   7.220   4.954
  458   HG23  VAL  68          2HG2      VAL  68   1.385   6.414   3.548
  459    H    LEU  69           H        LEU  69   3.846   7.289   1.723
  460    HA   LEU  69           HA       LEU  69   4.979   9.956   1.876
  461    HB2  LEU  69           2HB      LEU  69   4.025   8.332  -0.482
  462    HB3  LEU  69           1HB      LEU  69   4.764   9.919  -0.596
  463    HG   LEU  69           HG       LEU  69   6.111   7.444   0.489
  464   HD11  LEU  69          1HD1      LEU  69   7.437   7.533  -1.552
  465   HD12  LEU  69          2HD1      LEU  69   6.501   8.918  -2.112
  466   HD13  LEU  69          3HD1      LEU  69   5.723   7.346  -1.925
  467   HD21  LEU  69          3HD2      LEU  69   8.130   8.793   0.511
  468   HD22  LEU  69          1HD2      LEU  69   6.895   9.536   1.528
  469   HD23  LEU  69          2HD2      LEU  69   7.229  10.191  -0.075
  470    H    ASP  70           H        ASP  70   1.996   8.507   0.551
  471    HA   ASP  70           HA       ASP  70   0.320  10.542   1.579
  472    HB2  ASP  70           2HB      ASP  70   1.640  11.656  -0.406
  473    HB3  ASP  70           1HB      ASP  70   0.527  10.737  -1.412
  474    H    THR  71           H        THR  71  -1.871  10.449   0.221
  475    HA   THR  71           HA       THR  71  -2.400   7.694  -0.600
  476    HB   THR  71           HB       THR  71  -4.507   7.766   0.843
  477    HG1  THR  71           1HG      THR  71  -3.565  10.171   1.415
  478   HG21  THR  71          3HG2      THR  71  -2.603   6.316   1.365
  479   HG22  THR  71          1HG2      THR  71  -3.358   6.936   2.832
  480   HG23  THR  71          2HG2      THR  71  -1.843   7.634   2.257
  481    H    GLU  72           H        GLU  72  -3.175   8.022  -2.600
  482    HA   GLU  72           HA       GLU  72  -5.296  10.040  -2.912
  483    HB2  GLU  72           2HB      GLU  72  -4.668   9.975  -5.384
  484    HB3  GLU  72           1HB      GLU  72  -3.549  10.785  -4.298
  485    HG2  GLU  72           2HG      GLU  72  -3.099   7.916  -4.943
  486    HG3  GLU  72           1HG      GLU  72  -2.710   9.135  -6.155
  487    HA   PRO  73           HA       PRO  73  -7.885   6.545  -3.866
  488    HB2  PRO  73           2HB      PRO  73 -10.114   7.952  -4.504
  489    HB3  PRO  73           1HB      PRO  73  -9.582   7.705  -2.837
  490    HG2  PRO  73           2HG      PRO  73  -9.259  10.095  -4.603
  491    HG3  PRO  73           1HG      PRO  73  -9.643  10.019  -2.874
  492    HD2  PRO  73           2HD      PRO  73  -7.147  10.565  -3.855
  493    HD3  PRO  73           1HD      PRO  73  -7.441   9.829  -2.269
  494    H    ALA  74           H        ALA  74  -7.164   5.616  -5.715
  495    HA   ALA  74           HA       ALA  74  -7.830   6.962  -8.240
  496    HB1  ALA  74           1HB      ALA  74  -5.531   5.083  -7.724
  497    HB2  ALA  74           2HB      ALA  74  -5.417   6.836  -7.893
  498    HB3  ALA  74           3HB      ALA  74  -5.924   5.848  -9.264
  499    H    ASP  75           H        ASP  75  -9.816   6.019  -8.493
  500    HA   ASP  75           HA       ASP  75 -10.037   3.122  -8.569
  501    HB2  ASP  75           2HB      ASP  75 -11.914   4.377  -7.642
  502    HB3  ASP  75           1HB      ASP  75 -12.058   5.312  -9.126
  503    H    GLY  76           H        GLY  76 -10.051   1.931 -10.387
  504    HA2  GLY  76           2HA      GLY  76  -8.751   2.864 -12.660
  505    HA3  GLY  76           1HA      GLY  76  -9.657   1.365 -12.563
  506    H    ASP  77           H        ASP  77  -9.496   4.450 -13.915
  507    HA   ASP  77           HA       ASP  77 -12.302   4.505 -14.714
  508    HB2  ASP  77           2HB      ASP  77 -11.298   6.645 -14.161
  509    HB3  ASP  77           1HB      ASP  77  -9.978   6.358 -15.288
  510    H    GLY  78           H        GLY  78  -9.091   3.999 -16.057
  511    HA2  GLY  78           2HA      GLY  78  -9.440   2.105 -17.853
  512    HA3  GLY  78           1HA      GLY  78 -10.233   3.434 -18.687
  513    H    GLY  79           H        GLY  79  -9.028   5.112 -19.522
  514    HA2  GLY  79           2HA      GLY  79  -6.370   5.704 -18.977
  515    HA3  GLY  79           1HA      GLY  79  -6.357   4.519 -20.277
  516    H    LEU  80           H        LEU  80  -5.383   6.212 -21.566
  517    HA   LEU  80           HA       LEU  80  -6.997   8.469 -22.327
  518    HB2  LEU  80           2HB      LEU  80  -5.248   9.019 -23.878
  519    HB3  LEU  80           1HB      LEU  80  -4.517   8.567 -22.353
  520    HG   LEU  80           HG       LEU  80  -4.746   6.636 -24.657
  521   HD11  LEU  80          1HD1      LEU  80  -2.392   7.204 -25.151
  522   HD12  LEU  80          2HD1      LEU  80  -2.509   8.551 -24.018
  523   HD13  LEU  80          3HD1      LEU  80  -3.508   8.532 -25.471
  524   HD21  LEU  80          3HD2      LEU  80  -2.923   5.487 -23.519
  525   HD22  LEU  80          1HD2      LEU  80  -4.316   5.658 -22.450
  526   HD23  LEU  80          2HD2      LEU  80  -2.917   6.717 -22.255
  527    H    GLU  81           H        GLU  81  -7.766   8.819 -24.527
  528    HA   GLU  81           HA       GLU  81  -8.167   6.472 -26.181
  529    HB2  GLU  81           2HB      GLU  81  -9.970   6.669 -24.251
  530    HB3  GLU  81           1HB      GLU  81 -10.660   7.891 -25.307
  531    HG2  GLU  81           2HG      GLU  81 -10.087   5.077 -26.195
  532    HG3  GLU  81           1HG      GLU  81 -11.624   5.586 -25.504