*HEADER    TRANSCRIPTION                           05-APR-07   2YTH              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 479-          
*TITLE    2 511) OF HUMAN ZINC FINGER PROTEIN 224                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 224;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2, UNP RESIDUES 479-511;                             
*COMPND   5 SYNONYM: ZINC FINGER PROTEIN 27, ZINC FINGER PROTEIN 233,            
*COMPND   6 ZINC FINGER PROTEIN 255, BONE MARROW ZINC FINGER 2, BMZF-2,          
*COMPND   7 ZINC FINGER PROTEIN KOX22;                                           
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: ZNF224;                                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P061225-42;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    ZF-C2H2, NMR, STRUCTURAL GENOMICS, NPPSFA, NATIONAL PROJECT           
*KEYWDS   2 ON PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES, RIKEN                 
*KEYWDS   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI,                     
*KEYWDS   4 TRANSCRIPTION                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    T.TOMIZAWA, N.TOCHIO, H.ABE, K.SAITO, H.LI, M.SATO,                   
*AUTHOR   2 S.KOSHIBA, N.KOBAYASHI, T.KIGAWA, S.YOKOYAMA, RIKEN                  
*AUTHOR   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)                     
*REVDAT   1   12-MAY-09 2YTH    0                                                

**************************************************************
During the CYANA calculations automatic implicit swapping of restraints 
involving diastereotopic substitutents was applied for prochrial groups 
without stereospecific assignment. Diastereotopic substitents were 
swapped individually in each conformer to calculate the minimal target 
function and restraint violations.
The optimal swapping for a given prochiral group may differ among 
the 20 conformers that represent the solution structure. The swapping 
is therefore performed implicitly in the program and is not reflected 
in the distance restraint file deposited in the PDB.
**************************************************************

15 CYSS SG   201 ZN   ZN   2.19  5.00E+00
18 CYSS SG   201 ZN   ZN   2.19  5.00E+00
31 HIS  NE2  201 ZN   ZN   1.90  5.00E+00
35 HIS  NE2  201 ZN   ZN   1.90  5.00E+00

15 CYSS CB   201 ZN   ZN   3.25  5.00E+00
18 CYSS CB   201 ZN   ZN   3.25  5.00E+00

15 CYSS SG   18  CYSS SG   3.56  5.00E+00
15 CYSS SG   31  HIS  NE2  3.32  5.00E+00
15 CYSS SG   35  HIS  NE2  3.32  5.00E+00
18 CYSS SG   31  HIS  NE2  3.32  5.00E+00
18 CYSS SG   35  HIS  NE2  3.32  5.00E+00
31 HIS  NE2  35  HIS  NE2  3.00  5.00E+00
15 CYSS SG   201 ZN   ZN   2.39  5.00E+00
18 CYSS SG   201 ZN   ZN   2.39  5.00E+00
31 HIS  NE2  201 ZN   ZN   2.10  5.00E+00
35 HIS  NE2  201 ZN   ZN   2.10  5.00E+00

15 CYSS CB   201 ZN   ZN   3.51  5.00E+00
18 CYSS CB   201 ZN   ZN   3.51  5.00E+00

15 CYSS SG   18  CYSS SG   3.96  5.00E+00
15 CYSS SG   31  HIS  NE2  3.72  5.00E+00
15 CYSS SG   35  HIS  NE2  3.72  5.00E+00
18 CYSS SG   31  HIS  NE2  3.72  5.00E+00
18 CYSS SG   35  HIS  NE2  3.72  5.00E+00
31 HIS  NE2  35  HIS  NE2  3.60  5.00E+00
 15 CYSS HB3    18 CYSS HN      4.72 #SUP  0.98  #QF  0.98
 15 CYSS HA     18 CYSS HN      4.81 #SUP  0.97  #QF  0.97
 16 GLU  HN     18 CYSS HN      3.68 #SUP  0.97  #QF  0.97
 17 GLU  HA     18 CYSS HN      3.56 #SUP  0.94  #QF  0.94
 16 GLU  HB3    18 CYSS HN      5.50 #SUP  0.98  #QF  0.98
 20 LYS  HA     21 ARG  HN      2.76 #SUP  0.96  #QF  0.96
 21 ARG  HN     21 ARG  QD      4.47 #SUP  0.99  #QF  0.99
 21 ARG  HN     21 ARG  HG3     3.50 #SUP  0.93  #QF  0.93
 21 ARG  HN     21 ARG  HB2     3.12 #SUP  0.97  #QF  0.27
 20 LYS  HB3    21 ARG  HN      3.60 #SUP  0.94  #QF  0.94
 20 LYS  HG2    21 ARG  HN      4.70 #SUP  0.99  #QF  0.99
 15 CYSS HB3    17 GLU  HN      3.67 #SUP  0.66  #QF  0.66
 17 GLU  HN     18 CYSS HN      3.21 #SUP  0.99  #QF  0.99
 17 GLU  HN     19 GLY  HN      3.35 #SUP  0.83  #QF  0.83
 17 GLU  HN     19 GLY  HA1     4.99 #SUP  0.94  #QF  0.94
 17 GLU  HN     17 GLU  HB3     3.85 #SUP  0.99  #QF  0.99
 17 GLU  HN     17 GLU  HB2     3.85 #SUP  0.99  #QF  0.99
 30 SER  HN     30 SER  QB      3.26 #SUP  0.85  #QF  0.85
 29 HIS  QB     30 SER  HN      3.38 #SUP  0.81  #QF  0.81
 18 CYSS HN     19 GLY  HN      4.20 #SUP  0.99  #QF  0.99
 19 GLY  HN     19 GLY  HA1     2.93 #SUP  0.99  #QF  0.99
 15 CYSS HB3    19 GLY  HN      3.71 #SUP  0.97  #QF  0.97
 14 GLN  HB3    19 GLY  HN      5.49 #SUP  0.96  #QF  0.96
 15 CYSS HB2    19 GLY  HN      4.26 #SUP  0.94  #QF  0.89
 14 GLN  HN     14 GLN  QG      3.47 #SUP  0.90  #QF  0.90
 14 GLN  HN     14 GLN  HB2     3.82 #SUP  0.98  #QF  0.98
 13 PHE  HB3    14 GLN  HN      4.10 #SUP  0.95  #QF  0.95
 14 GLN  HN     28 LEU  QD2     4.00 #SUP  0.84  #QF  0.84
 13 PHE  HB2    14 GLN  HN      4.57 #SUP  0.96  #QF  0.96
 29 HIS  HN     29 HIS  HD2     3.83 #SUP  0.99  #QF  0.99
 25 ASN  HA     29 HIS  HN      4.46 #SUP  0.90  #QF  0.90
 29 HIS  HN     29 HIS  QB      2.91 #SUP  0.85  #QF  0.85
 28 LEU  HB2    29 HIS  HN      3.92 #SUP  0.98  #QF  0.98
 28 LEU  HB3    29 HIS  HN      3.92 #SUP  0.95  #QF  0.95
 38 GLU  HA     39 LYS  HN      3.23 #SUP  0.89  #QF  0.89
 39 LYS  HN     39 LYS  QG      4.49 #SUP  0.98  #QF  0.98
 26 SER  HA     29 HIS  HN      4.12 #SUP  0.86  #QF  0.86
 28 LEU  HG     29 HIS  HN      4.11 #SUP  0.98  #QF  0.98
 14 GLN  HA     20 LYS  HN      4.65 #SUP  0.79  #QF  0.79
 15 CYSS HB3    20 LYS  HN      3.41 #SUP  0.96  #QF  0.96
 15 CYSS HB2    20 LYS  HN      3.89 #SUP  0.98  #QF  0.98
 20 LYS  HN     21 ARG  HG3     5.50 #SUP  0.62  #QF  0.62
 20 LYS  HN     20 LYS  HB2     3.02 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HB3     3.68 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HG2     4.60 #SUP  1.00
 32 GLN  QG     32 GLN  HE21    4.02 #SUP  0.97  #QF  0.97
 28 LEU  QD2    32 GLN  HE21    4.84 #SUP  0.98  #QF  0.33
 32 GLN  QG     32 GLN  HE22    4.02 #SUP  0.99  #QF  0.99
 28 LEU  QD2    32 GLN  HE22    4.84 #SUP  0.85  #QF  0.32
 13 PHE  HN     14 GLN  HN      4.70 #SUP  0.85  #QF  0.85
 13 PHE  HN     13 PHE  QD      3.60 #SUP  0.95  #QF  0.95
 11 LYS  HA     13 PHE  HN      4.35 #SUP  0.93  #QF  0.93
 12 PRO  QD     13 PHE  HN      3.70 #SUP  0.99  #QF  0.99
 13 PHE  HN     13 PHE  HB3     3.69 #SUP  0.99  #QF  0.99
 13 PHE  HN     13 PHE  HB2     3.30 #SUP  0.96  #QF  0.96
 13 PHE  HN     22 PHE  HB2     5.32 #SUP  0.99  #QF  0.99
 12 PRO  HB3    13 PHE  HN      4.60 #SUP  1.00
 13 PHE  HN     14 GLN  QG      5.02 #SUP  1.00
 12 PRO  HG3    13 PHE  HN      4.61 #SUP  0.99  #QF  0.99
 12 PRO  HG2    13 PHE  HN      4.61 #SUP  0.99  #QF  0.23
 11 LYS  HB3    13 PHE  HN      4.63 #SUP  0.88  #QF  0.86
 12 PRO  HB2    13 PHE  HN      4.60 #SUP  1.00
 14 GLN  HB3    14 GLN  HE22    4.31 #SUP  0.98  #QF  0.73
 14 GLN  HB3    14 GLN  HE21    4.31 #SUP  0.99  #QF  0.76
 31 HIS  HA     33 ARG  HN      4.58 #SUP  0.59  #QF  0.59
 33 ARG  HN     34 VAL  HN      3.60 #SUP  0.98  #QF  0.98
 33 ARG  HN     33 ARG  QD      4.53 #SUP  0.99  #QF  0.99
 32 GLN  HB2    33 ARG  HN      4.14 #SUP  0.69  #QF  0.69
 35 HIS  HN     36 THR  HN      3.78 #SUP  0.51  #QF  0.51
 32 GLN  HA     35 HIS  HN      4.31 #SUP  0.95  #QF  0.95
 35 HIS  HN     35 HIS  HB2     3.95 #SUP  0.97  #QF  0.97
 35 HIS  HN     35 HIS  HB3     3.95 #SUP  0.90  #QF  0.90
 34 VAL  HB     35 HIS  HN      4.23 #SUP  0.97  #QF  0.97
 34 VAL  QG2    35 HIS  HN      4.42 #SUP  0.98  #QF  0.98
 34 VAL  QG1    35 HIS  HN      4.42 #SUP  0.97  #QF  0.97
 35 HIS  HB2    36 THR  HN      4.68 #SUP  0.91  #QF  0.91
 35 HIS  HB3    36 THR  HN      4.68 #SUP  0.84  #QF  0.84
 33 ARG  HA     35 HIS  HN      4.70 #SUP  0.90  #QF  0.90
 15 CYSS HN     20 LYS  HN      4.69 #SUP  0.97  #QF  0.97
 15 CYSS HN     22 PHE  QD      4.64 #SUP  0.97  #QF  0.97
 15 CYSS HN     22 PHE  QE      4.30 #SUP  0.97  #QF  0.97
 15 CYSS HN     19 GLY  HN      4.73 #SUP  0.90  #QF  0.90
 14 GLN  HA     15 CYSS HN      2.82 #SUP  0.92  #QF  0.92
 15 CYSS HN     15 CYSS HB3     3.18 #SUP  0.99  #QF  0.99
 15 CYSS HN     15 CYSS HB2     3.27 #SUP  0.99  #QF  0.99
 14 GLN  HB3    15 CYSS HN      3.50 #SUP  0.90  #QF  0.90
 14 GLN  HB2    15 CYSS HN      4.26 #SUP  0.96  #QF  0.96
 15 CYSS HN     28 LEU  QD1     4.14 #SUP  0.99  #QF  0.99
 13 PHE  HN     22 PHE  HN      4.40 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  QD      3.44 #SUP  0.97  #QF  0.97
 21 ARG  HA     22 PHE  HN      2.93 #SUP  0.89  #QF  0.89
 22 PHE  HN     22 PHE  HB3     4.12 #SUP  1.00
 13 PHE  HB3    22 PHE  HN      5.14 #SUP  0.99  #QF  0.99
 13 PHE  HB2    22 PHE  HN      4.15 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  HB2     3.58 #SUP  0.99  #QF  0.99
 21 ARG  HB3    22 PHE  HN      3.62 #SUP  0.93  #QF  0.93
 11 LYS  HB2    22 PHE  HN      4.41 #SUP  0.94  #QF  0.94
 11 LYS  HB3    22 PHE  HN      3.81 #SUP  0.78  #QF  0.69
 11 LYS  QD     22 PHE  HN      4.36 #SUP  0.78  #QF  0.69
 21 ARG  HG2    22 PHE  HN      4.66 #SUP  0.99  #QF  0.99
 13 PHE  QD     22 PHE  HN      4.90 #SUP  0.89  #QF  0.89
 16 GLU  HN     28 LEU  QD1     4.85 #SUP  0.96  #QF  0.96
 15 CYSS HA     16 GLU  HN      3.26 #SUP  0.93  #QF  0.93
 34 VAL  HN     35 HIS  HN      3.45 #SUP  0.99  #QF  0.99
 32 GLN  HA     34 VAL  HN      4.42 #SUP  0.99  #QF  0.99
 31 HIS  HA     34 VAL  HN      4.50 #SUP  0.82  #QF  0.82
 34 VAL  HN     34 VAL  QG1     3.79 #SUP  0.99  #QF  0.99
 28 LEU  HN     29 HIS  HN      3.41 #SUP  0.97  #QF  0.97
 22 PHE  HB3    28 LEU  HN      4.66 #SUP  0.98  #QF  0.98
 27 HIS  HB2    28 LEU  HN      4.26 #SUP  0.96  #QF  0.54
 22 PHE  HB2    28 LEU  HN      4.60 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HB2     3.39 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HG      4.33 #SUP  0.97  #QF  0.97
 28 LEU  HN     28 LEU  HB3     3.39 #SUP  0.99  #QF  0.99
 27 HIS  HN     28 LEU  HN      3.51 #SUP  0.96  #QF  0.96
 26 SER  QB     27 HIS  HN      4.49 #SUP  0.73  #QF  0.73
 24 GLN  HB2    27 HIS  HN      4.21 #SUP  0.81  #QF  0.81
 24 GLN  HB3    27 HIS  HN      4.21 #SUP  0.88  #QF  0.88
 36 THR  HB     37 GLY  HN      4.99 #SUP  0.98  #QF  0.97
 11 LYS  HN     12 PRO  QD      4.76 #SUP  1.00
 11 LYS  HN     11 LYS  QD      5.26 #SUP  1.00  #QF  0.99
 28 LEU  HN     31 HIS  HN      5.00 #SUP  0.87  #QF  0.66
 31 HIS  HN     31 HIS  HD2     5.50 #SUP  0.87  #QF  0.66
 30 SER  QB     31 HIS  HN      3.67 #SUP  0.86  #QF  0.86
 31 HIS  HN     31 HIS  HB3     3.03 #SUP  0.95  #QF  0.95
 31 HIS  HN     31 HIS  HB2     3.26 #SUP  0.98  #QF  0.98
 32 GLN  HN     33 ARG  HN      3.60 #SUP  0.99  #QF  0.99
 31 HIS  HD2    32 GLN  HN      4.35 #SUP  0.96  #QF  0.96
 29 HIS  HA     32 GLN  HN      4.28 #SUP  0.91  #QF  0.91
 31 HIS  HB3    32 GLN  HN      3.58 #SUP  0.96  #QF  0.96
 31 HIS  HB2    32 GLN  HN      4.30 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  QG      3.31 #SUP  0.98  #QF  0.98
 32 GLN  HN     32 GLN  HB2     3.28 #SUP  0.97  #QF  0.97
 28 LEU  QD1    32 GLN  HN      4.76 #SUP  0.96  #QF  0.96
 23 THR  HN     24 GLN  HN      4.41 #SUP  0.88  #QF  0.88
 23 THR  HB     24 GLN  HN      4.34 #SUP  0.91  #QF  0.85
 22 PHE  HB3    24 GLN  HN      3.67 #SUP  0.95  #QF  0.95
 22 PHE  HB2    24 GLN  HN      4.37 #SUP  0.99  #QF  0.99
 23 THR  QG2    24 GLN  HN      4.62 #SUP  0.74  #QF  0.74
 37 GLY  HN     38 GLU  HN      3.69 #SUP  0.76  #QF  0.76
 38 GLU  HN     38 GLU  QG      4.58 #SUP  0.99  #QF  0.99
 29 HIS  HA     29 HIS  HD2     4.14 #SUP  0.97  #QF  0.97
 28 LEU  HG     29 HIS  HD2     4.79 #SUP  0.74  #QF  0.74
 27 HIS  HA     27 HIS  HD2     3.72 #SUP  0.87  #QF  0.87
 18 CYSS HB3    35 HIS  HE1     3.95 #SUP  0.93  #QF  0.93
 31 HIS  HE1    34 VAL  QG2     4.11 #SUP  0.86  #QF  0.86
 31 HIS  HE1    34 VAL  QG1     4.11 #SUP  0.95  #QF  0.95
 14 GLN  HA     22 PHE  QD      4.06 #SUP  0.92  #QF  0.68
 21 ARG  HA     22 PHE  QD      4.67 #SUP  0.92  #QF  0.68
 22 PHE  HA     22 PHE  QD      3.84 #SUP  0.97  #QF  0.97
 22 PHE  QD     27 HIS  HB3     3.90 #SUP  0.76  #QF  0.44
 22 PHE  QD     28 LEU  HA      4.04 #SUP  0.98  #QF  0.98
 13 PHE  HB2    22 PHE  QD      4.32 #SUP  0.71  #QF  0.71
 14 GLN  QG     22 PHE  QD      5.10 #SUP  0.99  #QF  0.53
 20 LYS  HB2    22 PHE  QD      4.42 #SUP  0.65  #QF  0.65
 17 GLU  HN     18 CYSS HA      5.11 #SUP  1.00
 13 PHE  QD     23 THR  HA      4.59 #SUP  0.61  #QF  0.61
 20 LYS  HB3    22 PHE  QE      4.36 #SUP  0.97  #QF  0.97
 15 CYSS HB3    22 PHE  QE      4.57 #SUP  0.93  #QF  0.93
 22 PHE  QE     31 HIS  HB3     4.44 #SUP  0.39  #QF  0.39
 15 CYSS HB2    22 PHE  QE      3.70 #SUP  0.80  #QF  0.80
 20 LYS  HB2    22 PHE  QE      4.04 #SUP  0.99  #QF  0.97
 22 PHE  QE     28 LEU  QD1     3.90 #SUP  0.86  #QF  0.86
 20 LYS  HB3    22 PHE  HZ      4.33 #SUP  0.98  #QF  0.98
 22 PHE  QD     22 PHE  HZ      4.24 #SUP  0.98  #QF  0.98
 22 PHE  HZ     31 HIS  HB3     4.55 #SUP  0.95  #QF  0.95
 20 LYS  HB2    22 PHE  HZ      4.05 #SUP  1.00  #QF  0.98
 20 LYS  HD3    22 PHE  HZ      4.78 #SUP  1.00  #QF  0.98
 14 GLN  HA     14 GLN  QG      3.94 #SUP  1.00  #QF  0.97
 14 GLN  QG     21 ARG  HA      4.05 #SUP  1.00  #QF  0.97
 32 GLN  QG     35 HIS  HD2     4.38 #SUP  0.96  #QF  0.96
 31 HIS  HB3    31 HIS  HD2     3.92 #SUP  0.99  #QF  0.99
 14 GLN  HB3    19 GLY  HA2     4.62 #SUP  0.58  #QF  0.58
 14 GLN  HB3    19 GLY  HA1     3.93 #SUP  0.82  #QF  0.82
 36 THR  HN     36 THR  QG2     4.36 #SUP  0.97  #QF  0.97
 36 THR  HA     36 THR  QG2     3.23 #SUP  0.95  #QF  0.49
 33 ARG  HA     36 THR  QG2     4.41 #SUP  0.98  #QF  0.98
 33 ARG  QD     36 THR  QG2     4.66 #SUP  0.21  #QF  0.21
 42 GLY  HA2    43 PRO  QD      3.69 #SUP  0.94  #QF  0.94
 34 VAL  HN     34 VAL  QG2     3.79 #SUP  1.00
 22 PHE  HB3    27 HIS  HB2     4.06 #SUP  0.99  #QF  0.78
 13 PHE  HB2    22 PHE  HB3     4.49 #SUP  0.99  #QF  0.99
 13 PHE  QD     22 PHE  HB2     4.84 #SUP  1.00  #QF  0.98
 13 PHE  HB3    22 PHE  HB2     3.95 #SUP  0.73  #QF  0.73
 22 PHE  HB2    27 HIS  HB2     4.38 #SUP  0.82  #QF  0.82
 13 PHE  HB2    22 PHE  HB2     3.81 #SUP  1.00
 11 LYS  HB3    22 PHE  HB2     5.50 #SUP  0.86  #QF  0.63
 11 LYS  QD     22 PHE  HB2     5.50 #SUP  0.86  #QF  0.63
 22 PHE  HB2    28 LEU  HB3     4.80 #SUP  0.99  #QF  0.99
 31 HIS  HA     34 VAL  QG1     4.63 #SUP  0.97  #QF  0.97
 34 VAL  HA     34 VAL  QG1     3.60 #SUP  1.00
 33 ARG  QD     34 VAL  HN      5.50 #SUP  1.00
 21 ARG  HA     21 ARG  QD      4.40 #SUP  1.00
 20 LYS  HA     21 ARG  QD      5.50 #SUP  0.91  #QF  0.61
 30 SER  QB     33 ARG  QD      5.50 #SUP  0.91  #QF  0.61
 14 GLN  QG     21 ARG  QD      5.12 #SUP  0.93  #QF  0.93
 33 ARG  HB2    33 ARG  QD      4.05 #SUP  0.99  #QF  0.98
 21 ARG  HB2    21 ARG  QD      3.50 #SUP  1.00
 39 LYS  QG     39 LYS  QE      3.88 #SUP  0.99  #QF  0.44
 11 LYS  HB2    11 LYS  QE      4.55 #SUP  0.96  #QF  0.96
 11 LYS  HG3    11 LYS  QE      3.85 #SUP  0.99  #QF  0.99
 11 LYS  HG2    11 LYS  QE      3.85 #SUP  0.98  #QF  0.98
 22 PHE  QD     28 LEU  HB2     4.94 #SUP  0.96  #QF  0.96
 13 PHE  HB2    28 LEU  HB2     4.81 #SUP  1.00
 22 PHE  HB2    28 LEU  HB2     4.80 #SUP  0.99  #QF  0.99
 22 PHE  QD     28 LEU  HB3     4.94 #SUP  0.98  #QF  0.98
 25 ASN  HA     28 LEU  HB3     4.44 #SUP  0.97  #QF  0.97
 13 PHE  HB2    28 LEU  HB3     4.81 #SUP  0.99  #QF  0.99
 13 PHE  HB2    14 GLN  QG      5.30 #SUP  0.97  #QF  0.30
 12 PRO  QD     23 THR  HA      4.28 #SUP  0.61  #QF  0.61
 11 LYS  QD     23 THR  HA      4.53 #SUP  0.98  #QF  0.31
 34 VAL  HA     34 VAL  QG2     3.60 #SUP  1.00
 13 PHE  QE     25 ASN  HB3     4.84 #SUP  0.91  #QF  0.79
 13 PHE  QE     25 ASN  HB2     4.84 #SUP  0.96  #QF  0.89
 30 SER  HA     30 SER  QB      2.87 #SUP  0.94  #QF  0.94
 30 SER  HA     33 ARG  QD      4.52 #SUP  0.80  #QF  0.80
 26 SER  HA     29 HIS  QB      3.51 #SUP  0.97  #QF  0.97
 29 HIS  HA     32 GLN  QG      4.31 #SUP  0.99  #QF  0.99
 28 LEU  QD1    32 GLN  QG      3.72 #SUP  0.92  #QF  0.92
 31 HIS  HD2    32 GLN  QG      3.99 #SUP  0.88  #QF  0.88
 28 LEU  HG     32 GLN  QG      4.24 #SUP  0.98  #QF  0.98
 31 HIS  HD2    32 GLN  HA      3.98 #SUP  0.97  #QF  0.97
 32 GLN  HA     35 HIS  HD2     3.49 #SUP  0.96  #QF  0.96
 31 HIS  HB3    32 GLN  HA      5.11 #SUP  0.96  #QF  0.62
 32 GLN  HA     32 GLN  QG      3.45 #SUP  0.99  #QF  0.99
 29 HIS  HA     32 GLN  HB2     4.26 #SUP  0.96  #QF  0.96
 28 LEU  HG     29 HIS  HA      4.75 #SUP  0.99  #QF  0.99
 31 HIS  HA     34 VAL  QG2     4.63 #SUP  0.99  #QF  0.99
 16 GLU  HA     18 CYSS HN      4.68 #SUP  0.98  #QF  0.98
 16 GLU  HA     19 GLY  HN      4.97 #SUP  0.90  #QF  0.90
 17 GLU  HA     17 GLU  HG3     4.08 #SUP  1.00
 17 GLU  HA     17 GLU  HG2     4.08 #SUP  1.00
 20 LYS  HA     21 ARG  HA      4.82 #SUP  1.00
 20 LYS  HA     21 ARG  HG3     4.31 #SUP  0.83  #QF  0.83
 20 LYS  HA     20 LYS  HG3     3.85 #SUP  1.00
 20 LYS  HA     20 LYS  HG2     3.85 #SUP  1.00
 15 CYSS HB2    20 LYS  HB2     4.60 #SUP  1.00  #QF  0.84
 20 LYS  HB3    21 ARG  HG3     5.17 #SUP  0.55  #QF  0.55
 15 CYSS HB2    20 LYS  HB3     5.42 #SUP  0.99  #QF  0.94
 33 ARG  HA     36 THR  HA      4.00 #SUP  0.46  #QF  0.46
 33 ARG  HA     33 ARG  QD      4.44 #SUP  1.00
 14 GLN  QG     15 CYSS HN      4.37 #SUP  0.96  #QF  0.96
 14 GLN  QG     19 GLY  HA1     5.15 #SUP  0.97  #QF  0.97
 21 ARG  HB3    21 ARG  QD      3.86 #SUP  1.00
 11 LYS  HB2    21 ARG  HB3     3.48 #SUP  0.83  #QF  0.83
 11 LYS  HB2    12 PRO  QD      4.94 #SUP  1.00
 11 LYS  HB2    21 ARG  QD      4.72 #SUP  0.97  #QF  0.97
 11 LYS  HB2    21 ARG  HG3     4.32 #SUP  0.98  #QF  0.98
 11 LYS  HB3    21 ARG  HA      4.44 #SUP  1.00  #QF  0.41
 28 LEU  HA     31 HIS  HN      4.59 #SUP  0.87  #QF  0.87
 28 LEU  HA     31 HIS  HA      5.07 #SUP  0.87  #QF  0.87
 28 LEU  HA     31 HIS  HB2     4.10 #SUP  0.62  #QF  0.62
 28 LEU  HA     28 LEU  HG      3.97 #SUP  1.00
 18 CYSS HB2    35 HIS  HE1     3.95 #SUP  0.99  #QF  0.99
 10 GLU  HA     10 GLU  QG      4.13 #SUP  0.94  #QF  0.94
 27 HIS  HB3    28 LEU  HN      4.26 #SUP  0.99  #QF  0.99
 22 PHE  HB3    27 HIS  HB3     4.06 #SUP  1.00
 22 PHE  HB2    27 HIS  HB3     4.38 #SUP  0.99  #QF  0.99
 22 PHE  QD     27 HIS  HB2     3.90 #SUP  0.96  #QF  0.96
 38 GLU  HA     38 GLU  QG      4.16 #SUP  1.00
 34 VAL  HN     34 VAL  HB      3.79 #SUP  0.99  #QF  0.99
 13 PHE  QE     25 ASN  HA      4.84 #SUP  0.98  #QF  0.96
 13 PHE  QD     25 ASN  HA      4.31 #SUP  0.92  #QF  0.92
 25 ASN  HA     28 LEU  HB2     4.44 #SUP  1.00  #QF  0.98
 25 ASN  HA     28 LEU  HN      4.27 #SUP  0.95  #QF  0.95
 25 ASN  HA     28 LEU  HG      5.50 #SUP  0.99  #QF  0.99
 33 ARG  HB3    33 ARG  QD      4.05 #SUP  1.00
 15 CYSS HB3    31 HIS  HD2     4.96 #SUP  0.75  #QF  0.75
 15 CYSS HB3    18 CYSS HA      4.53 #SUP  0.82  #QF  0.82
 15 CYSS HB3    20 LYS  HB2     4.27 #SUP  0.98  #QF  0.98
 14 GLN  HB3    15 CYSS HB3     5.12 #SUP  0.98  #QF  0.98
 15 CYSS HB2    22 PHE  QD      4.82 #SUP  0.93  #QF  0.93
 15 CYSS HB2    31 HIS  HD2     3.39 #SUP  0.73  #QF  0.73
 14 GLN  HA     15 CYSS HB2     4.44 #SUP  0.98  #QF  0.98
 14 GLN  HB3    15 CYSS HB2     5.22 #SUP  0.99  #QF  0.99
 16 GLU  HB2    18 CYSS HN      5.50 #SUP  0.95  #QF  0.95
 11 LYS  QD     22 PHE  HA      4.89 #SUP  0.37  #QF  0.37
 20 LYS  HD2    22 PHE  HZ      4.78 #SUP  0.95  #QF  0.95
 11 LYS  HA     11 LYS  QD      4.78 #SUP  1.00  #QF  0.99
 28 LEU  QD1    31 HIS  HB3     4.50 #SUP  0.82  #QF  0.82
 22 PHE  HZ     31 HIS  HB2     4.44 #SUP  0.94  #QF  0.94
 21 ARG  HG3    22 PHE  HN      5.02 #SUP  0.98  #QF  0.98
 21 ARG  HA     21 ARG  HG3     4.02 #SUP  1.00
 14 GLN  QG     21 ARG  HG3     4.41 #SUP  0.96  #QF  0.96
 21 ARG  HN     21 ARG  HG2     4.58 #SUP  1.00
 21 ARG  HA     21 ARG  HG2     3.66 #SUP  0.99  #QF  0.99
 14 GLN  QG     21 ARG  HG2     3.99 #SUP  0.81  #QF  0.81
 11 LYS  HB2    21 ARG  HG2     3.89 #SUP  0.92  #QF  0.92
 32 GLN  HN     32 GLN  HB3     4.00 #SUP  1.00
 29 HIS  HA     32 GLN  HB3     5.10 #SUP  0.99  #QF  0.99
 32 GLN  HB3    33 ARG  HN      4.99 #SUP  1.00  #QF  0.57
 33 ARG  HN     33 ARG  HG3     4.22 #SUP  0.99  #QF  0.99
 33 ARG  HN     33 ARG  HG2     4.22 #SUP  1.00
 11 LYS  HA     12 PRO  HG3     4.86 #SUP  0.98  #QF  0.98
 11 LYS  HA     12 PRO  HG2     4.86 #SUP  0.99  #QF  0.99
 20 LYS  HG3    21 ARG  HN      4.70 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HG3     4.60 #SUP  1.00
 13 PHE  QD     28 LEU  QD2     3.97 #SUP  0.87  #QF  0.87
 25 ASN  HA     28 LEU  QD2     4.47 #SUP  0.96  #QF  0.96
 13 PHE  HB3    28 LEU  QD2     3.39 #SUP  0.98  #QF  0.98
 13 PHE  HB2    28 LEU  QD2     3.88 #SUP  0.98  #QF  0.98
 28 LEU  HN     28 LEU  QD2     4.40 #SUP  0.98  #QF  0.98
 15 CYSS HA     28 LEU  QD2     4.65 #SUP  0.58  #QF  0.58
 12 PRO  QD     13 PHE  QD      3.91 #SUP  0.98  #QF  0.98
 11 LYS  HA     12 PRO  QD      2.74 #SUP  0.87  #QF  0.87
 11 LYS  HB3    12 PRO  QD      4.00 #SUP  0.96  #QF  0.94
 11 LYS  QD     12 PRO  QD      4.52 #SUP  0.96  #QF  0.94
 12 PRO  QD     13 PHE  QE      4.77 #SUP  0.99  #QF  0.99
 42 GLY  HA1    43 PRO  QD      3.69 #SUP  0.89  #QF  0.53
 22 PHE  QD     28 LEU  QD1     3.57 #SUP  0.98  #QF  0.98
 28 LEU  QD1    31 HIS  HD2     3.43 #SUP  0.63  #QF  0.63
 14 GLN  HA     28 LEU  QD1     4.48 #SUP  0.92  #QF  0.92
 15 CYSS HA     28 LEU  QD1     3.39 #SUP  0.93  #QF  0.93
 28 LEU  QD1    29 HIS  HA      4.88 #SUP  0.96  #QF  0.96
 15 CYSS HB3    28 LEU  QD1     4.31 #SUP  1.00
 28 LEU  HA     28 LEU  QD1     3.25 #SUP  0.99  #QF  0.99
 15 CYSS HB2    28 LEU  QD1     3.38 #SUP  0.53  #QF  0.53
 22 PHE  HB2    28 LEU  QD1     4.75 #SUP  0.97  #QF  0.97
 23 THR  HA     23 THR  QG2     3.38 #SUP  0.92  #QF  0.42
 11 LYS  HA     11 LYS  QG      3.71 
 11 LYS  HA     12 PRO  QG      4.23 
 11 LYS  QG     12 PRO  QD      4.09 
 11 LYS  QG     23 THR  HA      4.40 
 12 PRO  QB     13 PHE  HN      3.95 
 12 PRO  QB     13 PHE  QE      4.97 
 12 PRO  QB     13 PHE  HZ      5.34 
 12 PRO  QG     13 PHE  HN      3.85 
 12 PRO  QG     13 PHE  QD      4.29 
 12 PRO  QG     13 PHE  QE      4.53 
 12 PRO  QG     23 THR  HA      5.35 
 13 PHE  HB2    28 LEU  QB      4.16 
 13 PHE  HB3    28 LEU  QB      3.99 
 13 PHE  QD     25 ASN  QB      4.50 
 13 PHE  QD     28 LEU  QB      5.05 
 13 PHE  QE     25 ASN  QB      4.01 
 13 PHE  HZ     25 ASN  QB      4.48 
 14 GLN  HB3    14 GLN  QE2     3.50 
 14 GLN  QE2    19 GLY  HA1     3.97 
 14 GLN  QE2    19 GLY  HA2     4.47 
 14 GLN  QE2    21 ARG  HG3     4.85 
 15 CYSS HA     32 GLN  QE2     4.48 
 16 GLU  HN     16 GLU  QB      3.51 
 16 GLU  HN     16 GLU  QG      4.60 
 16 GLU  HA     16 GLU  QG      3.58 
 16 GLU  QB     18 CYSS HN      4.74 
 17 GLU  HN     17 GLU  QB      3.30 
 17 GLU  QB     18 CYSS HN      3.11 
 17 GLU  QG     18 CYSS HN      4.24 
 18 CYSS QB     35 HIS  HE1     3.11 
 20 LYS  HN     20 LYS  QG      4.01 
 20 LYS  HA     20 LYS  QG      3.35 
 20 LYS  HB3    20 LYS  QE      5.34 
 20 LYS  QG     21 ARG  HN      4.00 
 20 LYS  QG     22 PHE  HZ      4.62 
 20 LYS  QG     31 HIS  HE1     3.59 
 20 LYS  QD     22 PHE  HZ      4.18 
 20 LYS  QD     31 HIS  HE1     4.18 
 20 LYS  QE     22 PHE  HZ      4.94 
 22 PHE  HB2    27 HIS  QB      3.75 
 22 PHE  HB2    28 LEU  QB      4.02 
 22 PHE  HB3    27 HIS  QB      3.47 
 22 PHE  HB3    28 LEU  QB      4.61 
 22 PHE  QD     27 HIS  QB      3.34 
 22 PHE  QD     28 LEU  QB      4.07 
 24 GLN  HN     24 GLN  QB      3.52 
 24 GLN  HN     24 GLN  QG      4.25 
 24 GLN  HN     27 HIS  QB      3.68 
 24 GLN  QB     27 HIS  HN      3.55 
 24 GLN  QB     27 HIS  QB      4.66 
 25 ASN  HA     28 LEU  QB      3.62 
 27 HIS  HN     27 HIS  QB      3.35 
 27 HIS  QB     28 LEU  HN      3.45 
 28 LEU  HN     28 LEU  QB      2.95 
 28 LEU  QB     28 LEU  QD2     3.36 
 28 LEU  QB     29 HIS  HN      3.23 
 28 LEU  HG     32 GLN  QE2     4.61 
 28 LEU  QD1    32 GLN  QE2     4.15 
 28 LEU  QD2    32 GLN  QE2     4.20 
 30 SER  HA     33 ARG  QG      4.35 
 31 HIS  HE1    34 VAL  QQG     3.44 
 32 GLN  HN     33 ARG  QB      5.12 
 32 GLN  HA     35 HIS  QB      5.17 
 32 GLN  QG     32 GLN  QE2     3.30 
 33 ARG  HN     33 ARG  QB      3.03 
 33 ARG  HA     33 ARG  QG      3.49 
 33 ARG  QB     33 ARG  QD      3.20 
 33 ARG  QB     34 VAL  HN      3.85 
 34 VAL  HN     34 VAL  QQG     3.19 
 34 VAL  HA     34 VAL  QQG     3.08 
 34 VAL  QQG    35 HIS  HN      3.78 
 34 VAL  QQG    35 HIS  HE1     4.82 
 35 HIS  HN     35 HIS  QB      3.26 
 35 HIS  QB     35 HIS  HD2     3.36 
 35 HIS  QB     36 THR  HN      4.00 
 38 GLU  HN     38 GLU  QB      3.55 
 38 GLU  QB     39 LYS  HN      4.26 
 39 LYS  HN     39 LYS  QB      3.57 
 39 LYS  HA     40 PRO  QD      3.13 
 39 LYS  QB     40 PRO  QD      4.02 
 42 GLY  QA     43 PRO  QD      3.22 
     14   GLN  PHI  -165.00    -105.00
     14   GLN  PSI   128.00     188.00
     25   ASN  PHI   -91.00     -31.00
     25   ASN  PSI   -69.00      -9.00
     26   SER  PHI   -90.00     -30.00
     26   SER  PSI   -69.00      -9.00
     27   HIS  PHI   -96.00     -36.00
     27   HIS  PSI   -72.00     -12.00
     28   LEU  PHI   -92.00     -32.00
     28   LEU  PSI   -76.00     -16.00
     29   HIS  PHI   -94.00     -34.00
     29   HIS  PSI   -68.00      -8.00
     30   SER  PHI   -98.00     -38.00
     30   SER  PSI   -66.00      -6.00
     31   HIS  PHI   -94.00     -34.00
     31   HIS  PSI   -73.00     -13.00
     32   GLN  PHI   -93.00     -33.00
     32   GLN  PSI   -72.00     -12.00
     33   ARG  PHI   -96.00     -36.00
     33   ARG  PSI   -72.00     -12.00
     34   VAL  PHI  -104.00     -44.00
     34   VAL  PSI   -53.00       7.00
     35   HIS  PHI  -125.00     -65.00
     35   HIS  PSI   -38.00      22.00

     15  CYSS CHI1  150.00     210.00
     18  CYSS CHI1   30.00      90.00
     31  HIS  CHI1  150.00     210.00
     35  HIS  CHI1  -90.00     -30.00


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1  13.825 -12.089  -1.755
    2    HA2  GLY   1           1HA      GLY   1  14.060 -11.149  -3.939
    3    HA3  GLY   1           2HA      GLY   1  14.068 -12.776  -4.602
    4    H    SER   2           H        SER   2  11.811 -13.811  -3.301
    5    HA   SER   2           HA       SER   2   9.768 -13.102  -5.030
    6    HB2  SER   2           1HB      SER   2  10.037 -15.128  -3.364
    7    HB3  SER   2           2HB      SER   2   9.080 -14.104  -2.293
    8    HG   SER   2           HG       SER   2   8.181 -14.400  -4.911
    9    H    SER   3           H        SER   3   7.630 -12.164  -4.457
   10    HA   SER   3           HA       SER   3   7.695  -9.524  -3.884
   11    HB2  SER   3           1HB      SER   3   5.443 -11.394  -3.108
   12    HB3  SER   3           2HB      SER   3   5.304  -9.651  -3.335
   13    HG   SER   3           HG       SER   3   5.654 -11.679  -5.235
   14    H    GLY   4           H        GLY   4   7.783  -8.203  -2.145
   15    HA2  GLY   4           1HA      GLY   4   8.206  -9.507   0.461
   16    HA3  GLY   4           2HA      GLY   4   8.818  -7.924   0.005
   17    H    SER   5           H        SER   5   7.063  -6.275  -0.496
   18    HA   SER   5           HA       SER   5   5.250  -6.239   1.757
   19    HB2  SER   5           1HB      SER   5   6.139  -4.244  -0.292
   20    HB3  SER   5           2HB      SER   5   4.661  -3.939   0.620
   21    HG   SER   5           HG       SER   5   5.795  -3.680   2.410
   22    H    SER   6           H        SER   6   3.674  -7.761   1.315
   23    HA   SER   6           HA       SER   6   2.311  -8.013  -1.136
   24    HB2  SER   6           1HB      SER   6   2.381  -9.707   0.752
   25    HB3  SER   6           2HB      SER   6   1.179  -8.714   1.577
   26    HG   SER   6           HG       SER   6  -0.117  -9.978   0.463
   27    H    GLY   7           H        GLY   7   0.822  -6.768  -2.056
   28    HA2  GLY   7           1HA      GLY   7  -0.471  -4.702  -0.402
   29    HA3  GLY   7           2HA      GLY   7  -0.226  -4.604  -2.140
   30    H    SER   8           H        SER   8  -1.505  -7.345  -0.314
   31    HA   SER   8           HA       SER   8  -4.069  -6.970  -1.719
   32    HB2  SER   8           1HB      SER   8  -2.745  -9.582  -0.948
   33    HB3  SER   8           2HB      SER   8  -4.306  -9.418  -1.752
   34    HG   SER   8           HG       SER   8  -2.012  -9.630  -2.919
   35    H    GLY   9           H        GLY   9  -5.071  -5.870  -0.035
   36    HA2  GLY   9           1HA      GLY   9  -5.550  -7.502   2.383
   37    HA3  GLY   9           2HA      GLY   9  -5.337  -5.759   2.455
   38    H    GLU  10           H        GLU  10  -7.424  -5.794   3.553
   39    HA   GLU  10           HA       GLU  10  -9.708  -6.255   1.770
   40    HB2  GLU  10           1HB      GLU  10  -9.528  -7.233   4.161
   41    HB3  GLU  10           2HB      GLU  10  -9.912  -5.603   4.696
   42    HG2  GLU  10           1HG      GLU  10 -11.925  -5.810   3.086
   43    HG3  GLU  10           2HG      GLU  10 -11.606  -7.541   3.183
   44    H    LYS  11           H        LYS  11  -8.597  -3.853   4.160
   45    HA   LYS  11           HA       LYS  11 -10.430  -1.851   3.534
   46    HB2  LYS  11           1HB      LYS  11  -7.592  -1.579   4.540
   47    HB3  LYS  11           2HB      LYS  11  -8.789  -0.291   4.552
   48    HG2  LYS  11           1HG      LYS  11  -9.173  -2.911   5.976
   49    HG3  LYS  11           2HG      LYS  11  -8.456  -1.485   6.731
   50    HD2  LYS  11           1HD      LYS  11 -10.437  -0.345   6.777
   51    HD3  LYS  11           2HD      LYS  11 -11.066  -1.163   5.345
   52    HE2  LYS  11           1HE      LYS  11 -10.636  -2.682   7.886
   53    HE3  LYS  11           2HE      LYS  11 -12.079  -1.691   7.680
   54    HZ1  LYS  11           3HZ      LYS  11 -11.705  -3.252   5.375
   55    HZ2  LYS  11           1HZ      LYS  11 -12.984  -3.296   6.481
   56    HZ3  LYS  11           2HZ      LYS  11 -11.622  -4.267   6.725
   57    HA   PRO  12           HA       PRO  12  -9.180  -0.436  -0.448
   58    HB2  PRO  12           1HB      PRO  12 -10.303   2.035  -0.376
   59    HB3  PRO  12           2HB      PRO  12 -11.249   0.555  -0.574
   60    HG2  PRO  12           1HG      PRO  12 -10.768   2.178   1.894
   61    HG3  PRO  12           2HG      PRO  12 -12.273   1.440   1.317
   62    HD2  PRO  12           1HD      PRO  12 -10.754   0.322   3.260
   63    HD3  PRO  12           2HD      PRO  12 -11.703  -0.646   2.114
   64    H    PHE  13           H        PHE  13  -8.628   1.632   2.371
   65    HA   PHE  13           HA       PHE  13  -6.603   3.179   1.003
   66    HB2  PHE  13           1HB      PHE  13  -7.201   3.225   3.958
   67    HB3  PHE  13           2HB      PHE  13  -6.477   4.495   2.977
   68    HD1  PHE  13           HD1      PHE  13  -7.842   5.910   1.566
   69    HD2  PHE  13           HD2      PHE  13  -9.584   2.850   3.958
   70    HE1  PHE  13           HE1      PHE  13 -10.062   6.915   1.229
   71    HE2  PHE  13           HE2      PHE  13 -11.807   3.850   3.624
   72    HZ   PHE  13           HZ       PHE  13 -12.049   5.884   2.258
   73    H    GLN  14           H        GLN  14  -4.842   1.967   0.527
   74    HA   GLN  14           HA       GLN  14  -3.470   0.678   2.793
   75    HB2  GLN  14           1HB      GLN  14  -3.582  -0.226  -0.087
   76    HB3  GLN  14           2HB      GLN  14  -2.516  -0.921   1.126
   77    HG2  GLN  14           1HG      GLN  14  -4.411  -1.674   2.417
   78    HG3  GLN  14           2HG      GLN  14  -5.520  -0.891   1.293
   79   HE21  GLN  14          1HE2      GLN  14  -2.731  -3.082   1.070
   80   HE22  GLN  14          2HE2      GLN  14  -3.487  -4.208  -0.000
   81    H    CYS  15           H        CYS  15  -1.339   1.113   3.070
   82    HA   CYS  15           HA       CYS  15  -0.244   3.442   1.976
   83    HB2  CYS  15           1HB      CYS  15   0.375   2.030   4.122
   84    HB3  CYS  15           2HB      CYS  15   1.553   1.302   3.036
   85    H    GLU  16           H        GLU  16   2.148   3.277   1.034
   86    HA   GLU  16           HA       GLU  16   1.980   1.518  -1.325
   87    HB2  GLU  16           1HB      GLU  16   1.855   4.160  -1.484
   88    HB3  GLU  16           2HB      GLU  16   3.604   4.021  -1.371
   89    HG2  GLU  16           1HG      GLU  16   3.122   4.080  -3.661
   90    HG3  GLU  16           2HG      GLU  16   3.467   2.390  -3.297
   91    H    GLU  17           H        GLU  17   3.929   2.661   1.302
   92    HA   GLU  17           HA       GLU  17   6.294   1.270   0.286
   93    HB2  GLU  17           1HB      GLU  17   6.496   3.580   1.231
   94    HB3  GLU  17           2HB      GLU  17   6.018   2.932   2.794
   95    HG2  GLU  17           1HG      GLU  17   8.301   2.965   2.982
   96    HG3  GLU  17           2HG      GLU  17   8.016   1.312   2.438
   97    H    CYS  18           H        CYS  18   3.731   0.932   2.557
   98    HA   CYS  18           HA       CYS  18   4.933  -1.576   3.507
   99    HB2  CYS  18           1HB      CYS  18   4.240  -1.179   5.758
  100    HB3  CYS  18           2HB      CYS  18   5.113   0.256   5.231
  101    H    GLY  19           H        GLY  19   2.483  -0.174   1.865
  102    HA2  GLY  19           1HA      GLY  19   0.273  -0.711   1.434
  103    HA3  GLY  19           2HA      GLY  19   0.936  -2.338   1.402
  104    H    LYS  20           H        LYS  20   0.576  -0.164   4.174
  105    HA   LYS  20           HA       LYS  20  -0.503  -2.205   5.815
  106    HB2  LYS  20           1HB      LYS  20  -0.019   0.719   6.075
  107    HB3  LYS  20           2HB      LYS  20  -1.162  -0.011   7.194
  108    HG2  LYS  20           1HG      LYS  20   1.472  -1.332   6.829
  109    HG3  LYS  20           2HG      LYS  20   1.408   0.173   7.751
  110    HD2  LYS  20           1HD      LYS  20  -0.308  -0.812   9.209
  111    HD3  LYS  20           2HD      LYS  20  -0.205  -2.321   8.298
  112    HE2  LYS  20           1HE      LYS  20   1.207  -2.805  10.030
  113    HE3  LYS  20           2HE      LYS  20   2.354  -2.105   8.889
  114    HZ1  LYS  20           3HZ      LYS  20   1.614  -1.191  11.475
  115    HZ2  LYS  20           1HZ      LYS  20   1.357   0.019  10.321
  116    HZ3  LYS  20           2HZ      LYS  20   2.887  -0.681  10.484
  117    H    ARG  21           H        ARG  21  -2.610  -1.386   7.164
  118    HA   ARG  21           HA       ARG  21  -4.709  -0.815   5.181
  119    HB2  ARG  21           1HB      ARG  21  -4.778  -2.907   7.363
  120    HB3  ARG  21           2HB      ARG  21  -6.168  -2.431   6.396
  121    HG2  ARG  21           1HG      ARG  21  -5.397  -3.481   4.516
  122    HG3  ARG  21           2HG      ARG  21  -3.705  -3.340   4.999
  123    HD2  ARG  21           1HD      ARG  21  -4.164  -5.610   5.251
  124    HD3  ARG  21           2HD      ARG  21  -4.318  -4.968   6.886
  125    HE   ARG  21           HE       ARG  21  -6.846  -4.850   5.860
  126   HH11  ARG  21          1HH1      ARG  21  -4.472  -7.360   6.289
  127   HH12  ARG  21          2HH1      ARG  21  -5.647  -8.618   6.486
  128   HH21  ARG  21          1HH2      ARG  21  -8.402  -6.498   6.117
  129   HH22  ARG  21          2HH2      ARG  21  -7.882  -8.127   6.387
  130    H    PHE  22           H        PHE  22  -6.333   0.524   5.828
  131    HA   PHE  22           HA       PHE  22  -6.619   1.238   8.627
  132    HB2  PHE  22           1HB      PHE  22  -6.031   3.388   6.586
  133    HB3  PHE  22           2HB      PHE  22  -6.246   3.596   8.321
  134    HD1  PHE  22           HD1      PHE  22  -4.502   2.914   9.882
  135    HD2  PHE  22           HD2      PHE  22  -3.962   2.598   5.672
  136    HE1  PHE  22           HE1      PHE  22  -2.078   2.652  10.216
  137    HE2  PHE  22           HE2      PHE  22  -1.538   2.334   5.999
  138    HZ   PHE  22           HZ       PHE  22  -0.593   2.360   8.273
  139    H    THR  23           H        THR  23  -8.545   2.446   9.068
  140    HA   THR  23           HA       THR  23 -10.715   1.718   7.349
  141    HB   THR  23           HB       THR  23 -12.161   2.787   8.999
  142    HG1  THR  23           HG1      THR  23 -11.304   4.469   9.962
  143   HG21  THR  23          3HG2      THR  23 -10.124   0.806   9.696
  144   HG22  THR  23          1HG2      THR  23 -11.869   0.772   9.949
  145   HG23  THR  23          2HG2      THR  23 -10.828   1.620  11.093
  146    H    GLN  24           H        GLN  24  -9.582   4.885   8.549
  147    HA   GLN  24           HA       GLN  24 -10.943   6.166   6.294
  148    HB2  GLN  24           1HB      GLN  24  -9.862   7.208   8.904
  149    HB3  GLN  24           2HB      GLN  24 -10.325   8.288   7.596
  150    HG2  GLN  24           1HG      GLN  24 -12.565   7.776   7.784
  151    HG3  GLN  24           2HG      GLN  24 -12.252   6.233   8.577
  152   HE21  GLN  24          1HE2      GLN  24 -12.944   9.525   8.993
  153   HE22  GLN  24          2HE2      GLN  24 -12.841   9.578  10.716
  154    H    ASN  25           H        ASN  25  -9.769   8.110   5.359
  155    HA   ASN  25           HA       ASN  25  -7.230   7.213   4.361
  156    HB2  ASN  25           1HB      ASN  25  -7.347   9.532   3.189
  157    HB3  ASN  25           2HB      ASN  25  -8.499   8.284   2.722
  158   HD21  ASN  25          1HD2      ASN  25  -8.057  11.371   4.144
  159   HD22  ASN  25          2HD2      ASN  25  -9.727  11.747   4.381
  160    H    SER  26           H        SER  26  -8.329  10.016   6.257
  161    HA   SER  26           HA       SER  26  -6.100  11.467   6.618
  162    HB2  SER  26           1HB      SER  26  -8.153  12.048   7.758
  163    HB3  SER  26           2HB      SER  26  -8.038  10.617   8.782
  164    HG   SER  26           HG       SER  26  -7.294  12.494   9.854
  165    H    HIS  27           H        HIS  27  -6.808   8.443   8.333
  166    HA   HIS  27           HA       HIS  27  -4.526   8.393   9.956
  167    HB2  HIS  27           1HB      HIS  27  -6.246   6.173   8.850
  168    HB3  HIS  27           2HB      HIS  27  -4.927   5.883   9.979
  169    HD1  HIS  27           HD1      HIS  27  -6.575   5.027  11.780
  170    HD2  HIS  27           HD2      HIS  27  -7.226   8.959  10.607
  171    HE1  HIS  27           HE1      HIS  27  -8.149   5.987  13.490
  172    H    LEU  28           H        LEU  28  -5.067   7.211   6.672
  173    HA   LEU  28           HA       LEU  28  -2.529   5.956   6.406
  174    HB2  LEU  28           1HB      LEU  28  -4.244   5.224   4.963
  175    HB3  LEU  28           2HB      LEU  28  -4.607   6.867   4.438
  176    HG   LEU  28           HG       LEU  28  -2.334   6.882   3.331
  177   HD11  LEU  28          1HD1      LEU  28  -1.836   4.661   4.764
  178   HD12  LEU  28          2HD1      LEU  28  -1.006   5.064   3.261
  179   HD13  LEU  28          3HD1      LEU  28  -2.363   3.937   3.244
  180   HD21  LEU  28          3HD2      LEU  28  -4.291   4.817   2.331
  181   HD22  LEU  28          1HD2      LEU  28  -3.124   5.727   1.372
  182   HD23  LEU  28          2HD2      LEU  28  -4.479   6.560   2.134
  183    H    HIS  29           H        HIS  29  -3.775   8.893   4.803
  184    HA   HIS  29           HA       HIS  29  -1.522   9.863   3.666
  185    HB2  HIS  29           1HB      HIS  29  -3.847  11.217   4.961
  186    HB3  HIS  29           2HB      HIS  29  -2.481  12.204   4.448
  187    HD1  HIS  29           HD1      HIS  29  -2.863  13.161   2.215
  188    HD2  HIS  29           HD2      HIS  29  -4.593   9.402   2.584
  189    HE1  HIS  29           HE1      HIS  29  -3.948  12.700  -0.006
  190    H    SER  30           H        SER  30  -2.487  10.515   7.033
  191    HA   SER  30           HA       SER  30  -0.097  11.906   7.682
  192    HB2  SER  30           1HB      SER  30  -2.272  10.664   9.366
  193    HB3  SER  30           2HB      SER  30  -0.885  11.491  10.076
  194    HG   SER  30           HG       SER  30  -1.510  13.371   8.997
  195    H    HIS  31           H        HIS  31  -1.159   8.562   8.065
  196    HA   HIS  31           HA       HIS  31   0.877   7.592   9.679
  197    HB2  HIS  31           1HB      HIS  31  -0.778   6.026   9.341
  198    HB3  HIS  31           2HB      HIS  31  -0.911   6.380   7.621
  199    HD1  HIS  31           HD1      HIS  31   1.137   4.400  10.071
  200    HD2  HIS  31           HD2      HIS  31   0.689   4.839   5.964
  201    HE1  HIS  31           HE1      HIS  31   2.444   2.512   9.046
  202    H    GLN  32           H        GLN  32   0.978   8.611   6.389
  203    HA   GLN  32           HA       GLN  32   3.183   7.155   5.457
  204    HB2  GLN  32           1HB      GLN  32   2.346   9.964   4.716
  205    HB3  GLN  32           2HB      GLN  32   3.428   8.936   3.786
  206    HG2  GLN  32           1HG      GLN  32   1.497   7.289   3.654
  207    HG3  GLN  32           2HG      GLN  32   0.485   8.605   4.248
  208   HE21  GLN  32          1HE2      GLN  32   0.206   7.307   1.750
  209   HE22  GLN  32          2HE2      GLN  32   0.488   8.479   0.512
  210    H    ARG  33           H        ARG  33   3.005   9.500   7.878
  211    HA   ARG  33           HA       ARG  33   5.439  10.854   7.614
  212    HB2  ARG  33           1HB      ARG  33   3.682  10.185   9.952
  213    HB3  ARG  33           2HB      ARG  33   5.237  10.963  10.212
  214    HG2  ARG  33           1HG      ARG  33   4.580  12.850   8.883
  215    HG3  ARG  33           2HG      ARG  33   3.074  12.051   8.426
  216    HD2  ARG  33           1HD      ARG  33   2.604  11.956  10.953
  217    HD3  ARG  33           2HD      ARG  33   3.886  13.159  11.092
  218    HE   ARG  33           HE       ARG  33   1.224  13.606  10.206
  219   HH11  ARG  33          1HH1      ARG  33   4.519  14.612   9.706
  220   HH12  ARG  33          2HH1      ARG  33   4.088  16.195   9.149
  221   HH21  ARG  33          1HH2      ARG  33   0.644  15.687   9.474
  222   HH22  ARG  33          2HH2      ARG  33   1.884  16.805   9.018
  223    H    VAL  34           H        VAL  34   4.691   7.666   8.834
  224    HA   VAL  34           HA       VAL  34   7.101   7.155  10.199
  225    HB   VAL  34           HB       VAL  34   6.510   4.852  10.168
  226   HG11  VAL  34          1HG1      VAL  34   4.902   5.374  11.608
  227   HG12  VAL  34          2HG1      VAL  34   4.564   6.882  10.757
  228   HG13  VAL  34          3HG1      VAL  34   3.763   5.391  10.262
  229   HG21  VAL  34          3HG2      VAL  34   4.878   3.881   8.680
  230   HG22  VAL  34          1HG2      VAL  34   4.536   5.458   7.970
  231   HG23  VAL  34          2HG2      VAL  34   6.112   4.704   7.726
  232    H    HIS  35           H        HIS  35   6.462   7.526   6.893
  233    HA   HIS  35           HA       HIS  35   8.948   6.117   6.177
  234    HB2  HIS  35           1HB      HIS  35   6.733   6.917   4.285
  235    HB3  HIS  35           2HB      HIS  35   8.088   5.841   3.956
  236    HD1  HIS  35           HD1      HIS  35   8.047   3.584   5.572
  237    HD2  HIS  35           HD2      HIS  35   4.468   5.597   4.936
  238    HE1  HIS  35           HE1      HIS  35   6.236   1.934   6.145
  239    H    THR  36           H        THR  36   8.436   8.930   7.210
  240    HA   THR  36           HA       THR  36   8.709  10.924   5.383
  241    HB   THR  36           HB       THR  36  10.456  11.881   7.150
  242    HG1  THR  36           HG1      THR  36   9.930  10.872   9.216
  243   HG21  THR  36          3HG2      THR  36   8.695  13.015   8.021
  244   HG22  THR  36          1HG2      THR  36   7.761  11.551   8.323
  245   HG23  THR  36          2HG2      THR  36   7.827  12.235   6.699
  246    H    GLY  37           H        GLY  37  10.620  12.137   4.642
  247    HA2  GLY  37           1HA      GLY  37  13.050  12.089   4.276
  248    HA3  GLY  37           2HA      GLY  37  12.908  10.346   4.100
  249    H    GLU  38           H        GLU  38  11.531   9.589   2.263
  250    HA   GLU  38           HA       GLU  38  12.471  10.614  -0.155
  251    HB2  GLU  38           1HB      GLU  38  11.389   8.307   0.439
  252    HB3  GLU  38           2HB      GLU  38   9.889   9.100  -0.023
  253    HG2  GLU  38           1HG      GLU  38  11.166   9.725  -2.182
  254    HG3  GLU  38           2HG      GLU  38  12.265   8.433  -1.703
  255    H    LYS  39           H        LYS  39  12.080  12.646  -0.783
  256    HA   LYS  39           HA       LYS  39   9.279  13.563  -0.801
  257    HB2  LYS  39           1HB      LYS  39  10.715  14.820   0.787
  258    HB3  LYS  39           2HB      LYS  39  11.761  15.273  -0.552
  259    HG2  LYS  39           1HG      LYS  39  10.396  17.131  -0.221
  260    HG3  LYS  39           2HG      LYS  39   9.678  16.304  -1.605
  261    HD2  LYS  39           1HD      LYS  39   7.828  16.789  -0.295
  262    HD3  LYS  39           2HD      LYS  39   8.205  15.132   0.180
  263    HE2  LYS  39           1HE      LYS  39   9.182  15.824   2.204
  264    HE3  LYS  39           2HE      LYS  39   9.294  17.501   1.672
  265    HZ1  LYS  39           3HZ      LYS  39   7.277  16.372   3.164
  266    HZ2  LYS  39           1HZ      LYS  39   6.602  16.597   1.629
  267    HZ3  LYS  39           2HZ      LYS  39   7.276  17.909   2.457
  268    HA   PRO  40           HA       PRO  40  10.795  13.292  -5.178
  269    HB2  PRO  40           1HB      PRO  40   8.520  12.163  -6.138
  270    HB3  PRO  40           2HB      PRO  40   9.845  11.218  -5.449
  271    HG2  PRO  40           1HG      PRO  40   7.276  12.083  -4.180
  272    HG3  PRO  40           2HG      PRO  40   8.094  10.513  -4.090
  273    HD2  PRO  40           1HD      PRO  40   8.248  12.351  -2.108
  274    HD3  PRO  40           2HD      PRO  40   9.578  11.237  -2.482
  275    H    SER  41           H        SER  41  10.728  15.421  -5.729
  276    HA   SER  41           HA       SER  41   8.380  17.025  -5.546
  277    HB2  SER  41           1HB      SER  41   9.690  18.768  -6.552
  278    HB3  SER  41           2HB      SER  41  10.751  17.885  -5.455
  279    HG   SER  41           HG       SER  41  11.164  16.621  -7.569
  280    H    GLY  42           H        GLY  42   9.307  14.653  -7.715
  281    HA2  GLY  42           1HA      GLY  42   7.508  15.766  -9.779
  282    HA3  GLY  42           2HA      GLY  42   8.951  14.848 -10.183
  283    HA   PRO  43           HA       PRO  43   5.110  12.100  -9.780
  284    HB2  PRO  43           1HB      PRO  43   4.835  11.484 -12.410
  285    HB3  PRO  43           2HB      PRO  43   4.032  12.868 -11.658
  286    HG2  PRO  43           1HG      PRO  43   6.541  12.791 -13.290
  287    HG3  PRO  43           2HG      PRO  43   5.200  13.949 -13.354
  288    HD2  PRO  43           1HD      PRO  43   7.527  14.484 -12.077
  289    HD3  PRO  43           2HD      PRO  43   5.966  15.130 -11.529
  290    H    SER  44           H        SER  44   5.005   9.791 -10.410
  291    HA   SER  44           HA       SER  44   7.714   8.680 -10.731
  292    HB2  SER  44           1HB      SER  44   7.001   6.776  -9.427
  293    HB3  SER  44           2HB      SER  44   6.576   8.240  -8.542
  294    HG   SER  44           HG       SER  44   4.461   7.968  -9.109
  295    H    SER  45           H        SER  45   8.006   6.831 -12.025
  296    HA   SER  45           HA       SER  45   6.150   6.687 -14.254
  297    HB2  SER  45           1HB      SER  45   8.941   5.710 -13.755
  298    HB3  SER  45           2HB      SER  45   7.995   5.012 -15.069
  299    HG   SER  45           HG       SER  45   9.371   7.201 -15.173
  300    H    GLY  46           H        GLY  46   7.822   4.252 -12.241
  301    HA2  GLY  46           1HA      GLY  46   5.381   2.597 -12.434
  302    HA3  GLY  46           2HA      GLY  46   6.988   1.906 -12.601
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1   3.742 -14.423 -15.372
    2    HA2  GLY   1           1HA      GLY   1   4.086 -12.198 -14.736
    3    HA3  GLY   1           2HA      GLY   1   3.203 -11.677 -16.164
    4    H    SER   2           H        SER   2   2.651 -13.395 -13.091
    5    HA   SER   2           HA       SER   2  -0.124 -12.809 -13.012
    6    HB2  SER   2           1HB      SER   2   1.712 -13.534 -10.716
    7    HB3  SER   2           2HB      SER   2  -0.048 -13.652 -10.723
    8    HG   SER   2           HG       SER   2   1.365 -15.601 -11.247
    9    H    SER   3           H        SER   3   2.584 -11.507 -11.089
   10    HA   SER   3           HA       SER   3   2.790  -9.583  -9.879
   11    HB2  SER   3           1HB      SER   3   2.812  -8.788 -12.296
   12    HB3  SER   3           2HB      SER   3   1.126  -8.326 -12.064
   13    HG   SER   3           HG       SER   3   1.901  -6.558 -11.255
   14    H    GLY   4           H        GLY   4   0.718 -11.182  -8.957
   15    HA2  GLY   4           1HA      GLY   4  -0.617 -10.297  -7.041
   16    HA3  GLY   4           2HA      GLY   4  -1.321  -9.180  -8.201
   17    H    SER   5           H        SER   5  -3.266  -9.722  -8.902
   18    HA   SER   5           HA       SER   5  -5.073 -10.943  -9.552
   19    HB2  SER   5           1HB      SER   5  -3.185 -13.298  -9.755
   20    HB3  SER   5           2HB      SER   5  -4.744 -13.110 -10.558
   21    HG   SER   5           HG       SER   5  -2.285 -12.151 -11.268
   22    H    SER   6           H        SER   6  -4.658 -10.587  -6.840
   23    HA   SER   6           HA       SER   6  -6.315 -12.623  -5.753
   24    HB2  SER   6           1HB      SER   6  -4.217 -13.879  -5.675
   25    HB3  SER   6           2HB      SER   6  -3.438 -12.556  -4.808
   26    HG   SER   6           HG       SER   6  -5.224 -14.473  -3.902
   27    H    GLY   7           H        GLY   7  -7.067 -12.125  -3.640
   28    HA2  GLY   7           1HA      GLY   7  -7.439  -9.431  -3.094
   29    HA3  GLY   7           2HA      GLY   7  -7.668 -10.722  -1.924
   30    H    SER   8           H        SER   8  -5.824  -8.024  -2.777
   31    HA   SER   8           HA       SER   8  -3.836  -8.687  -0.704
   32    HB2  SER   8           1HB      SER   8  -3.513  -7.375  -3.373
   33    HB3  SER   8           2HB      SER   8  -2.451  -6.886  -2.053
   34    HG   SER   8           HG       SER   8  -2.408  -9.452  -1.935
   35    H    GLY   9           H        GLY   9  -4.949  -7.714   0.979
   36    HA2  GLY   9           1HA      GLY   9  -4.942  -5.777   2.358
   37    HA3  GLY   9           2HA      GLY   9  -4.913  -4.781   0.911
   38    H    GLU  10           H        GLU  10  -6.898  -6.540   3.150
   39    HA   GLU  10           HA       GLU  10  -9.354  -6.580   1.920
   40    HB2  GLU  10           1HB      GLU  10  -8.699  -5.992   4.809
   41    HB3  GLU  10           2HB      GLU  10 -10.322  -6.323   4.221
   42    HG2  GLU  10           1HG      GLU  10  -9.289  -8.501   3.296
   43    HG3  GLU  10           2HG      GLU  10  -7.980  -8.164   4.427
   44    H    LYS  11           H        LYS  11  -8.084  -3.928   3.937
   45    HA   LYS  11           HA       LYS  11 -10.228  -2.165   3.264
   46    HB2  LYS  11           1HB      LYS  11  -7.545  -1.627   4.549
   47    HB3  LYS  11           2HB      LYS  11  -8.841  -0.446   4.415
   48    HG2  LYS  11           1HG      LYS  11 -10.284  -2.046   5.713
   49    HG3  LYS  11           2HG      LYS  11  -8.823  -2.990   6.014
   50    HD2  LYS  11           1HD      LYS  11  -7.801  -0.875   6.946
   51    HD3  LYS  11           2HD      LYS  11  -9.415  -0.164   6.872
   52    HE2  LYS  11           1HE      LYS  11  -8.854  -1.080   9.101
   53    HE3  LYS  11           2HE      LYS  11 -10.271  -1.839   8.377
   54    HZ1  LYS  11           3HZ      LYS  11  -9.188  -3.804   8.089
   55    HZ2  LYS  11           1HZ      LYS  11  -8.372  -3.256   9.466
   56    HZ3  LYS  11           2HZ      LYS  11  -7.661  -3.092   7.941
   57    HA   PRO  12           HA       PRO  12  -8.754  -0.597  -0.579
   58    HB2  PRO  12           1HB      PRO  12 -10.070   1.777  -0.599
   59    HB3  PRO  12           2HB      PRO  12 -10.876   0.229  -0.882
   60    HG2  PRO  12           1HG      PRO  12 -10.738   1.864   1.623
   61    HG3  PRO  12           2HG      PRO  12 -12.125   1.015   0.916
   62    HD2  PRO  12           1HD      PRO  12 -10.696   0.002   2.980
   63    HD3  PRO  12           2HD      PRO  12 -11.464  -1.028   1.755
   64    H    PHE  13           H        PHE  13  -8.636   1.514   2.265
   65    HA   PHE  13           HA       PHE  13  -6.606   3.202   1.081
   66    HB2  PHE  13           1HB      PHE  13  -7.475   3.230   3.966
   67    HB3  PHE  13           2HB      PHE  13  -6.791   4.549   3.021
   68    HD1  PHE  13           HD1      PHE  13  -8.204   5.337   0.985
   69    HD2  PHE  13           HD2      PHE  13  -9.757   3.108   4.262
   70    HE1  PHE  13           HE1      PHE  13 -10.471   6.126   0.443
   71    HE2  PHE  13           HE2      PHE  13 -12.026   3.893   3.725
   72    HZ   PHE  13           HZ       PHE  13 -12.385   5.403   1.813
   73    H    GLN  14           H        GLN  14  -4.739   2.081   0.787
   74    HA   GLN  14           HA       GLN  14  -3.469   1.000   3.213
   75    HB2  GLN  14           1HB      GLN  14  -3.289  -0.108   0.407
   76    HB3  GLN  14           2HB      GLN  14  -2.349  -0.681   1.777
   77    HG2  GLN  14           1HG      GLN  14  -4.704  -1.018   2.864
   78    HG3  GLN  14           2HG      GLN  14  -5.244  -1.025   1.187
   79   HE21  GLN  14          1HE2      GLN  14  -3.222  -2.303  -0.084
   80   HE22  GLN  14          2HE2      GLN  14  -3.091  -3.929   0.483
   81    H    CYS  15           H        CYS  15  -1.077   0.946   3.087
   82    HA   CYS  15           HA       CYS  15  -0.092   3.485   2.203
   83    HB2  CYS  15           1HB      CYS  15   0.602   1.965   4.260
   84    HB3  CYS  15           2HB      CYS  15   1.753   1.315   3.098
   85    H    GLU  16           H        GLU  16   2.292   3.324   1.193
   86    HA   GLU  16           HA       GLU  16   2.009   1.708  -1.255
   87    HB2  GLU  16           1HB      GLU  16   1.974   4.358  -1.252
   88    HB3  GLU  16           2HB      GLU  16   3.719   4.152  -1.197
   89    HG2  GLU  16           1HG      GLU  16   3.583   2.754  -3.226
   90    HG3  GLU  16           2HG      GLU  16   1.853   3.080  -3.299
   91    H    GLU  17           H        GLU  17   4.021   2.551   1.416
   92    HA   GLU  17           HA       GLU  17   6.292   1.096   0.251
   93    HB2  GLU  17           1HB      GLU  17   6.730   3.372   1.133
   94    HB3  GLU  17           2HB      GLU  17   6.210   2.833   2.724
   95    HG2  GLU  17           1HG      GLU  17   8.465   2.631   2.944
   96    HG3  GLU  17           2HG      GLU  17   8.064   1.014   2.366
   97    H    CYS  18           H        CYS  18   3.808   0.893   2.606
   98    HA   CYS  18           HA       CYS  18   4.946  -1.642   3.567
   99    HB2  CYS  18           1HB      CYS  18   4.396  -1.191   5.813
  100    HB3  CYS  18           2HB      CYS  18   5.137   0.297   5.233
  101    H    GLY  19           H        GLY  19   2.547  -0.250   1.884
  102    HA2  GLY  19           1HA      GLY  19   0.286  -0.696   1.549
  103    HA3  GLY  19           2HA      GLY  19   0.930  -2.328   1.438
  104    H    LYS  20           H        LYS  20   0.238  -0.037   4.084
  105    HA   LYS  20           HA       LYS  20  -0.640  -2.178   5.795
  106    HB2  LYS  20           1HB      LYS  20  -0.242   0.759   6.059
  107    HB3  LYS  20           2HB      LYS  20  -1.366  -0.006   7.175
  108    HG2  LYS  20           1HG      LYS  20   1.305  -1.251   6.815
  109    HG3  LYS  20           2HG      LYS  20   1.198   0.253   7.734
  110    HD2  LYS  20           1HD      LYS  20  -0.167  -0.702   9.367
  111    HD3  LYS  20           2HD      LYS  20  -0.636  -2.046   8.322
  112    HE2  LYS  20           1HE      LYS  20   2.203  -1.663   9.218
  113    HE3  LYS  20           2HE      LYS  20   1.028  -2.512  10.220
  114    HZ1  LYS  20           3HZ      LYS  20   0.669  -4.080   8.431
  115    HZ2  LYS  20           1HZ      LYS  20   2.312  -4.029   8.831
  116    HZ3  LYS  20           2HZ      LYS  20   1.757  -3.250   7.437
  117    H    ARG  21           H        ARG  21  -2.774  -1.441   7.135
  118    HA   ARG  21           HA       ARG  21  -4.883  -0.997   5.125
  119    HB2  ARG  21           1HB      ARG  21  -4.870  -2.940   7.439
  120    HB3  ARG  21           2HB      ARG  21  -6.303  -2.543   6.499
  121    HG2  ARG  21           1HG      ARG  21  -5.578  -3.682   4.650
  122    HG3  ARG  21           2HG      ARG  21  -3.874  -3.499   5.071
  123    HD2  ARG  21           1HD      ARG  21  -4.461  -5.792   5.382
  124    HD3  ARG  21           2HD      ARG  21  -4.256  -5.066   6.976
  125    HE   ARG  21           HE       ARG  21  -6.971  -5.082   5.997
  126   HH11  ARG  21          1HH1      ARG  21  -4.531  -6.791   7.798
  127   HH12  ARG  21          2HH1      ARG  21  -5.670  -7.740   8.693
  128   HH21  ARG  21          1HH2      ARG  21  -8.482  -6.326   7.169
  129   HH22  ARG  21          2HH2      ARG  21  -7.918  -7.475   8.334
  130    H    PHE  22           H        PHE  22  -5.924   0.832   5.512
  131    HA   PHE  22           HA       PHE  22  -6.447   1.592   8.307
  132    HB2  PHE  22           1HB      PHE  22  -5.865   3.576   6.107
  133    HB3  PHE  22           2HB      PHE  22  -6.007   3.895   7.833
  134    HD1  PHE  22           HD1      PHE  22  -4.227   3.174   9.374
  135    HD2  PHE  22           HD2      PHE  22  -3.836   2.789   5.154
  136    HE1  PHE  22           HE1      PHE  22  -1.797   2.882   9.629
  137    HE2  PHE  22           HE2      PHE  22  -1.406   2.496   5.402
  138    HZ   PHE  22           HZ       PHE  22  -0.384   2.541   7.642
  139    H    THR  23           H        THR  23  -8.458   2.376   8.757
  140    HA   THR  23           HA       THR  23 -10.513   1.869   6.811
  141    HB   THR  23           HB       THR  23 -12.063   2.648   8.632
  142    HG1  THR  23           HG1      THR  23 -10.721   2.631  10.753
  143   HG21  THR  23          3HG2      THR  23 -11.368   0.272   8.332
  144   HG22  THR  23          1HG2      THR  23 -11.776   0.686   9.996
  145   HG23  THR  23          2HG2      THR  23 -10.086   0.543   9.512
  146    H    GLN  24           H        GLN  24  -9.219   4.729   8.461
  147    HA   GLN  24           HA       GLN  24 -10.844   6.439   6.716
  148    HB2  GLN  24           1HB      GLN  24 -10.624   6.649   9.342
  149    HB3  GLN  24           2HB      GLN  24  -9.163   7.536   8.926
  150    HG2  GLN  24           1HG      GLN  24 -10.690   9.231   9.052
  151    HG3  GLN  24           2HG      GLN  24 -10.752   8.848   7.332
  152   HE21  GLN  24          1HE2      GLN  24 -12.528   7.664   6.532
  153   HE22  GLN  24          2HE2      GLN  24 -14.029   7.619   7.385
  154    H    ASN  25           H        ASN  25  -9.952   7.846   5.280
  155    HA   ASN  25           HA       ASN  25  -7.456   7.301   4.175
  156    HB2  ASN  25           1HB      ASN  25  -7.756   9.338   2.866
  157    HB3  ASN  25           2HB      ASN  25  -9.278   8.457   2.972
  158   HD21  ASN  25          1HD2      ASN  25 -11.004   9.384   3.941
  159   HD22  ASN  25          2HD2      ASN  25 -11.011  10.996   4.565
  160    H    SER  26           H        SER  26  -8.422   9.801   6.485
  161    HA   SER  26           HA       SER  26  -6.101  11.295   6.593
  162    HB2  SER  26           1HB      SER  26  -8.057  12.024   7.788
  163    HB3  SER  26           2HB      SER  26  -8.037  10.583   8.804
  164    HG   SER  26           HG       SER  26  -6.513  12.891   8.960
  165    H    HIS  27           H        HIS  27  -6.933   8.484   8.620
  166    HA   HIS  27           HA       HIS  27  -4.682   8.278  10.152
  167    HB2  HIS  27           1HB      HIS  27  -6.570   6.269   9.017
  168    HB3  HIS  27           2HB      HIS  27  -5.094   5.676   9.774
  169    HD1  HIS  27           HD1      HIS  27  -5.490   5.059  12.122
  170    HD2  HIS  27           HD2      HIS  27  -7.830   8.295  10.976
  171    HE1  HIS  27           HE1      HIS  27  -6.825   5.679  14.161
  172    H    LEU  28           H        LEU  28  -5.084   7.245   6.802
  173    HA   LEU  28           HA       LEU  28  -2.478   6.065   6.625
  174    HB2  LEU  28           1HB      LEU  28  -4.050   5.162   5.155
  175    HB3  LEU  28           2HB      LEU  28  -4.624   6.749   4.650
  176    HG   LEU  28           HG       LEU  28  -2.334   7.036   3.553
  177   HD11  LEU  28          1HD1      LEU  28  -1.701   4.474   2.887
  178   HD12  LEU  28          2HD1      LEU  28  -2.134   4.306   4.588
  179   HD13  LEU  28          3HD1      LEU  28  -0.869   5.437   4.108
  180   HD21  LEU  28          3HD2      LEU  28  -3.508   6.660   1.709
  181   HD22  LEU  28          1HD2      LEU  28  -4.740   5.857   2.683
  182   HD23  LEU  28          2HD2      LEU  28  -3.425   4.917   1.975
  183    H    HIS  29           H        HIS  29  -3.905   8.921   5.025
  184    HA   HIS  29           HA       HIS  29  -1.768  10.022   3.816
  185    HB2  HIS  29           1HB      HIS  29  -3.831  11.491   5.469
  186    HB3  HIS  29           2HB      HIS  29  -2.735  12.269   4.330
  187    HD1  HIS  29           HD1      HIS  29  -5.949  12.095   4.183
  188    HD2  HIS  29           HD2      HIS  29  -3.208   9.928   1.935
  189    HE1  HIS  29           HE1      HIS  29  -7.180  11.409   2.100
  190    H    SER  30           H        SER  30  -2.485  10.296   7.278
  191    HA   SER  30           HA       SER  30  -0.130  11.848   7.819
  192    HB2  SER  30           1HB      SER  30  -2.137  12.093   9.209
  193    HB3  SER  30           2HB      SER  30  -2.007  10.407   9.711
  194    HG   SER  30           HG       SER  30  -0.858  11.233  11.271
  195    H    HIS  31           H        HIS  31  -1.112   8.478   8.307
  196    HA   HIS  31           HA       HIS  31   1.069   7.535   9.714
  197    HB2  HIS  31           1HB      HIS  31  -0.624   5.970   9.480
  198    HB3  HIS  31           2HB      HIS  31  -0.815   6.281   7.757
  199    HD1  HIS  31           HD1      HIS  31   1.205   4.293  10.191
  200    HD2  HIS  31           HD2      HIS  31   0.882   4.813   6.081
  201    HE1  HIS  31           HE1      HIS  31   2.536   2.420   9.170
  202    H    GLN  32           H        GLN  32   0.797   8.313   6.318
  203    HA   GLN  32           HA       GLN  32   2.950   6.988   5.232
  204    HB2  GLN  32           1HB      GLN  32   1.662   9.622   4.646
  205    HB3  GLN  32           2HB      GLN  32   3.144   9.191   3.805
  206    HG2  GLN  32           1HG      GLN  32   2.127   7.250   2.860
  207    HG3  GLN  32           2HG      GLN  32   0.684   7.464   3.849
  208   HE21  GLN  32          1HE2      GLN  32   0.393   7.194   1.186
  209   HE22  GLN  32          2HE2      GLN  32  -0.066   8.697   0.468
  210    H    ARG  33           H        ARG  33   2.946   9.608   7.483
  211    HA   ARG  33           HA       ARG  33   5.461  10.724   7.043
  212    HB2  ARG  33           1HB      ARG  33   3.845  10.381   9.567
  213    HB3  ARG  33           2HB      ARG  33   5.367  11.261   9.529
  214    HG2  ARG  33           1HG      ARG  33   4.198  12.571   7.580
  215    HG3  ARG  33           2HG      ARG  33   2.730  11.979   8.359
  216    HD2  ARG  33           1HD      ARG  33   4.911  13.392   9.872
  217    HD3  ARG  33           2HD      ARG  33   3.583  14.255   9.098
  218    HE   ARG  33           HE       ARG  33   2.270  12.468  10.592
  219   HH11  ARG  33          1HH1      ARG  33   4.906  14.614  11.346
  220   HH12  ARG  33          2HH1      ARG  33   4.455  14.794  13.009
  221   HH21  ARG  33          1HH2      ARG  33   1.666  12.697  12.780
  222   HH22  ARG  33          2HH2      ARG  33   2.613  13.702  13.824
  223    H    VAL  34           H        VAL  34   4.537   7.735   8.586
  224    HA   VAL  34           HA       VAL  34   6.839   7.166  10.047
  225    HB   VAL  34           HB       VAL  34   6.180   4.889  10.048
  226   HG11  VAL  34          1HG1      VAL  34   3.437   5.615   9.786
  227   HG12  VAL  34          2HG1      VAL  34   4.384   5.382  11.257
  228   HG13  VAL  34          3HG1      VAL  34   4.316   6.970  10.493
  229   HG21  VAL  34          3HG2      VAL  34   4.516   5.487   7.602
  230   HG22  VAL  34          1HG2      VAL  34   6.022   4.569   7.634
  231   HG23  VAL  34          2HG2      VAL  34   4.589   3.941   8.448
  232    H    HIS  35           H        HIS  35   6.489   7.513   6.708
  233    HA   HIS  35           HA       HIS  35   9.013   6.068   6.233
  234    HB2  HIS  35           1HB      HIS  35   6.938   6.669   4.127
  235    HB3  HIS  35           2HB      HIS  35   8.310   5.571   4.011
  236    HD1  HIS  35           HD1      HIS  35   8.125   3.457   5.787
  237    HD2  HIS  35           HD2      HIS  35   4.618   5.421   4.736
  238    HE1  HIS  35           HE1      HIS  35   6.265   1.866   6.362
  239    H    THR  36           H        THR  36   7.405   9.063   6.192
  240    HA   THR  36           HA       THR  36   8.337  10.626   4.252
  241    HB   THR  36           HB       THR  36   7.150  11.472   6.264
  242    HG1  THR  36           HG1      THR  36   7.784  13.280   5.375
  243   HG21  THR  36          3HG2      THR  36   9.178  10.362   7.698
  244   HG22  THR  36          1HG2      THR  36   8.071  11.586   8.319
  245   HG23  THR  36          2HG2      THR  36   9.651  12.061   7.694
  246    H    GLY  37           H        GLY  37  10.214  10.973   3.268
  247    HA2  GLY  37           1HA      GLY  37  12.471  10.971   2.838
  248    HA3  GLY  37           2HA      GLY  37  12.614  11.662   4.447
  249    H    GLU  38           H        GLU  38  12.810   8.757   2.538
  250    HA   GLU  38           HA       GLU  38  13.541   7.138   4.842
  251    HB2  GLU  38           1HB      GLU  38  13.445   6.386   1.915
  252    HB3  GLU  38           2HB      GLU  38  13.626   5.278   3.267
  253    HG2  GLU  38           1HG      GLU  38  11.422   5.598   3.977
  254    HG3  GLU  38           2HG      GLU  38  11.232   7.059   3.010
  255    H    LYS  39           H        LYS  39  15.556   7.014   5.545
  256    HA   LYS  39           HA       LYS  39  17.828   7.077   5.645
  257    HB2  LYS  39           1HB      LYS  39  17.476   5.272   3.887
  258    HB3  LYS  39           2HB      LYS  39  17.811   6.510   2.682
  259    HG2  LYS  39           1HG      LYS  39  19.838   5.377   3.005
  260    HG3  LYS  39           2HG      LYS  39  20.004   6.896   3.890
  261    HD2  LYS  39           1HD      LYS  39  20.851   5.246   5.336
  262    HD3  LYS  39           2HD      LYS  39  19.230   5.599   5.941
  263    HE2  LYS  39           1HE      LYS  39  18.409   3.633   4.626
  264    HE3  LYS  39           2HE      LYS  39  20.091   3.244   4.268
  265    HZ1  LYS  39           3HZ      LYS  39  20.470   3.135   6.701
  266    HZ2  LYS  39           1HZ      LYS  39  19.400   1.956   6.130
  267    HZ3  LYS  39           2HZ      LYS  39  18.806   3.316   6.941
  268    HA   PRO  40           HA       PRO  40  17.653  11.314   3.542
  269    HB2  PRO  40           1HB      PRO  40  17.361  12.793   5.800
  270    HB3  PRO  40           2HB      PRO  40  15.989  12.172   4.874
  271    HG2  PRO  40           1HG      PRO  40  17.241  11.082   7.365
  272    HG3  PRO  40           2HG      PRO  40  15.524  11.249   6.957
  273    HD2  PRO  40           1HD      PRO  40  16.849   8.896   6.752
  274    HD3  PRO  40           2HD      PRO  40  15.517   9.339   5.666
  275    H    SER  41           H        SER  41  19.888  10.737   3.165
  276    HA   SER  41           HA       SER  41  21.786  11.261   5.305
  277    HB2  SER  41           1HB      SER  41  22.097   9.343   3.729
  278    HB3  SER  41           2HB      SER  41  22.340  10.507   2.427
  279    HG   SER  41           HG       SER  41  24.272  10.960   3.175
  280    H    GLY  42           H        GLY  42  20.253  13.495   4.528
  281    HA2  GLY  42           1HA      GLY  42  21.528  15.683   4.604
  282    HA3  GLY  42           2HA      GLY  42  22.239  15.141   3.091
  283    HA   PRO  43           HA       PRO  43  17.556  16.095   2.242
  284    HB2  PRO  43           1HB      PRO  43  16.300  17.566   4.147
  285    HB3  PRO  43           2HB      PRO  43  16.302  15.799   4.144
  286    HG2  PRO  43           1HG      PRO  43  18.004  17.693   5.719
  287    HG3  PRO  43           2HG      PRO  43  17.204  16.202   6.250
  288    HD2  PRO  43           1HD      PRO  43  19.840  16.302   5.639
  289    HD3  PRO  43           2HD      PRO  43  18.850  14.854   5.365
  290    H    SER  44           H        SER  44  20.085  18.015   3.222
  291    HA   SER  44           HA       SER  44  20.779  20.136   2.766
  292    HB2  SER  44           1HB      SER  44  20.410  20.899   0.565
  293    HB3  SER  44           2HB      SER  44  20.273  19.145   0.444
  294    HG   SER  44           HG       SER  44  18.394  19.552  -0.395
  295    H    SER  45           H        SER  45  18.771  19.990   4.695
  296    HA   SER  45           HA       SER  45  16.880  22.128   4.106
  297    HB2  SER  45           1HB      SER  45  17.192  20.148   6.341
  298    HB3  SER  45           2HB      SER  45  16.200  21.587   6.571
  299    HG   SER  45           HG       SER  45  15.231  19.518   5.670
  300    H    GLY  46           H        GLY  46  16.763  24.069   5.261
  301    HA2  GLY  46           1HA      GLY  46  19.330  25.050   6.168
  302    HA3  GLY  46           2HA      GLY  46  17.861  25.993   5.970
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1  -7.960 -12.844  16.782
    2    HA2  GLY   1           1HA      GLY   1  -5.982 -14.325  17.660
    3    HA3  GLY   1           2HA      GLY   1  -6.924 -14.237  19.142
    4    H    SER   2           H        SER   2  -7.273 -15.060  15.697
    5    HA   SER   2           HA       SER   2  -8.522 -17.562  16.365
    6    HB2  SER   2           1HB      SER   2 -10.410 -15.916  16.545
    7    HB3  SER   2           2HB      SER   2 -10.175 -15.538  14.838
    8    HG   SER   2           HG       SER   2 -11.756 -17.303  15.620
    9    H    SER   3           H        SER   3  -7.623 -18.931  14.990
   10    HA   SER   3           HA       SER   3  -6.472 -18.033  12.511
   11    HB2  SER   3           1HB      SER   3  -5.372 -19.755  13.910
   12    HB3  SER   3           2HB      SER   3  -6.727 -20.844  13.611
   13    HG   SER   3           HG       SER   3  -4.574 -20.389  12.086
   14    H    GLY   4           H        GLY   4  -8.082 -17.417  11.115
   15    HA2  GLY   4           1HA      GLY   4  -9.877 -19.587  10.220
   16    HA3  GLY   4           2HA      GLY   4 -10.441 -17.932  10.389
   17    H    SER   5           H        SER   5 -11.054 -18.355   8.095
   18    HA   SER   5           HA       SER   5  -8.935 -17.354   6.361
   19    HB2  SER   5           1HB      SER   5  -9.129 -19.046   4.718
   20    HB3  SER   5           2HB      SER   5  -9.025 -19.915   6.249
   21    HG   SER   5           HG       SER   5 -11.179 -20.337   6.161
   22    H    SER   6           H        SER   6 -10.020 -17.147   4.011
   23    HA   SER   6           HA       SER   6 -11.372 -15.697   2.856
   24    HB2  SER   6           1HB      SER   6 -13.584 -16.515   2.582
   25    HB3  SER   6           2HB      SER   6 -12.608 -17.932   2.967
   26    HG   SER   6           HG       SER   6 -13.297 -17.522   5.213
   27    H    GLY   7           H        GLY   7 -10.494 -14.501   5.201
   28    HA2  GLY   7           1HA      GLY   7 -12.537 -13.444   6.828
   29    HA3  GLY   7           2HA      GLY   7 -10.940 -12.743   6.607
   30    H    SER   8           H        SER   8 -13.997 -11.900   6.522
   31    HA   SER   8           HA       SER   8 -13.863 -10.346   4.038
   32    HB2  SER   8           1HB      SER   8 -16.271  -9.901   4.436
   33    HB3  SER   8           2HB      SER   8 -15.915 -11.626   4.347
   34    HG   SER   8           HG       SER   8 -16.571 -11.835   6.329
   35    H    GLY   9           H        GLY   9 -13.609  -8.190   4.031
   36    HA2  GLY   9           1HA      GLY   9 -14.325  -6.116   5.346
   37    HA3  GLY   9           2HA      GLY   9 -13.420  -6.860   6.655
   38    H    GLU  10           H        GLU  10 -12.888  -6.176   3.192
   39    HA   GLU  10           HA       GLU  10 -10.098  -5.603   3.712
   40    HB2  GLU  10           1HB      GLU  10 -10.723  -6.832   1.689
   41    HB3  GLU  10           2HB      GLU  10 -11.702  -5.474   1.152
   42    HG2  GLU  10           1HG      GLU  10  -9.565  -4.106   1.207
   43    HG3  GLU  10           2HG      GLU  10  -8.716  -5.642   1.371
   44    H    LYS  11           H        LYS  11  -9.068  -3.617   3.236
   45    HA   LYS  11           HA       LYS  11 -10.873  -1.288   3.327
   46    HB2  LYS  11           1HB      LYS  11  -8.123  -1.618   4.540
   47    HB3  LYS  11           2HB      LYS  11  -9.032  -0.113   4.522
   48    HG2  LYS  11           1HG      LYS  11 -10.853  -1.358   5.765
   49    HG3  LYS  11           2HG      LYS  11  -9.673  -2.651   5.992
   50    HD2  LYS  11           1HD      LYS  11  -8.165  -0.682   6.862
   51    HD3  LYS  11           2HD      LYS  11  -9.721   0.106   7.131
   52    HE2  LYS  11           1HE      LYS  11 -10.440  -1.857   8.452
   53    HE3  LYS  11           2HE      LYS  11  -8.837  -2.558   8.238
   54    HZ1  LYS  11           3HZ      LYS  11  -8.799   0.129   9.267
   55    HZ2  LYS  11           1HZ      LYS  11  -7.980  -1.248   9.809
   56    HZ3  LYS  11           2HZ      LYS  11  -9.577  -0.970  10.290
   57    HA   PRO  12           HA       PRO  12  -9.074  -0.101  -0.530
   58    HB2  PRO  12           1HB      PRO  12  -9.940   2.472  -0.558
   59    HB3  PRO  12           2HB      PRO  12 -11.004   1.096  -0.877
   60    HG2  PRO  12           1HG      PRO  12 -10.640   2.664   1.647
   61    HG3  PRO  12           2HG      PRO  12 -12.138   2.084   0.897
   62    HD2  PRO  12           1HD      PRO  12 -10.969   0.818   2.986
   63    HD3  PRO  12           2HD      PRO  12 -11.877  -0.049   1.731
   64    H    PHE  13           H        PHE  13  -8.722   2.084   2.256
   65    HA   PHE  13           HA       PHE  13  -6.450   3.437   1.193
   66    HB2  PHE  13           1HB      PHE  13  -7.258   3.273   4.099
   67    HB3  PHE  13           2HB      PHE  13  -6.310   4.535   3.319
   68    HD1  PHE  13           HD1      PHE  13  -7.554   5.724   1.303
   69    HD2  PHE  13           HD2      PHE  13  -9.474   3.687   4.510
   70    HE1  PHE  13           HE1      PHE  13  -9.609   7.012   0.886
   71    HE2  PHE  13           HE2      PHE  13 -11.532   4.971   4.098
   72    HZ   PHE  13           HZ       PHE  13 -11.602   6.635   2.284
   73    H    GLN  14           H        GLN  14  -4.535   2.518   0.906
   74    HA   GLN  14           HA       GLN  14  -3.374   0.946   3.072
   75    HB2  GLN  14           1HB      GLN  14  -3.443  -0.043   0.216
   76    HB3  GLN  14           2HB      GLN  14  -2.650  -0.836   1.571
   77    HG2  GLN  14           1HG      GLN  14  -5.076  -0.752   2.594
   78    HG3  GLN  14           2HG      GLN  14  -5.534  -0.659   0.895
   79   HE21  GLN  14          1HE2      GLN  14  -2.987  -2.422   2.621
   80   HE22  GLN  14          2HE2      GLN  14  -3.437  -3.986   2.041
   81    H    CYS  15           H        CYS  15  -1.210   1.222   3.300
   82    HA   CYS  15           HA       CYS  15   0.043   3.430   2.143
   83    HB2  CYS  15           1HB      CYS  15   0.622   2.079   4.295
   84    HB3  CYS  15           2HB      CYS  15   1.624   1.114   3.216
   85    H    GLU  16           H        GLU  16   2.284   3.202   1.036
   86    HA   GLU  16           HA       GLU  16   1.972   1.347  -1.232
   87    HB2  GLU  16           1HB      GLU  16   1.883   3.985  -1.481
   88    HB3  GLU  16           2HB      GLU  16   3.632   3.816  -1.462
   89    HG2  GLU  16           1HG      GLU  16   3.395   2.154  -3.324
   90    HG3  GLU  16           2HG      GLU  16   1.694   2.608  -3.414
   91    H    GLU  17           H        GLU  17   4.052   2.504   1.271
   92    HA   GLU  17           HA       GLU  17   6.349   1.059   0.172
   93    HB2  GLU  17           1HB      GLU  17   6.186   2.840   2.610
   94    HB3  GLU  17           2HB      GLU  17   7.653   2.157   1.923
   95    HG2  GLU  17           1HG      GLU  17   5.915   3.859   0.210
   96    HG3  GLU  17           2HG      GLU  17   6.948   4.622   1.417
   97    H    CYS  18           H        CYS  18   3.883   0.807   2.548
   98    HA   CYS  18           HA       CYS  18   5.101  -1.683   3.524
   99    HB2  CYS  18           1HB      CYS  18   4.644  -1.208   5.775
  100    HB3  CYS  18           2HB      CYS  18   5.291   0.306   5.151
  101    H    GLY  19           H        GLY  19   2.671  -0.423   1.837
  102    HA2  GLY  19           1HA      GLY  19   0.408  -0.902   1.559
  103    HA3  GLY  19           2HA      GLY  19   1.068  -2.530   1.523
  104    H    LYS  20           H        LYS  20   0.123  -0.057   3.911
  105    HA   LYS  20           HA       LYS  20  -0.653  -2.148   5.780
  106    HB2  LYS  20           1HB      LYS  20  -0.202   0.788   5.931
  107    HB3  LYS  20           2HB      LYS  20  -1.335   0.087   7.079
  108    HG2  LYS  20           1HG      LYS  20   1.311  -1.220   6.759
  109    HG3  LYS  20           2HG      LYS  20   1.235   0.319   7.621
  110    HD2  LYS  20           1HD      LYS  20  -0.706  -1.834   8.325
  111    HD3  LYS  20           2HD      LYS  20   0.958  -1.958   8.902
  112    HE2  LYS  20           1HE      LYS  20   0.791   0.133  10.044
  113    HE3  LYS  20           2HE      LYS  20  -0.771   0.477   9.301
  114    HZ1  LYS  20           3HZ      LYS  20  -0.863  -1.998  10.666
  115    HZ2  LYS  20           1HZ      LYS  20  -1.788  -0.605  10.925
  116    HZ3  LYS  20           2HZ      LYS  20  -0.303  -0.792  11.713
  117    H    ARG  21           H        ARG  21  -2.765  -1.242   7.107
  118    HA   ARG  21           HA       ARG  21  -4.873  -0.755   5.116
  119    HB2  ARG  21           1HB      ARG  21  -4.761  -2.927   7.196
  120    HB3  ARG  21           2HB      ARG  21  -6.292  -2.359   6.543
  121    HG2  ARG  21           1HG      ARG  21  -5.922  -3.281   4.491
  122    HG3  ARG  21           2HG      ARG  21  -4.167  -3.162   4.632
  123    HD2  ARG  21           1HD      ARG  21  -4.435  -5.419   4.879
  124    HD3  ARG  21           2HD      ARG  21  -4.541  -4.911   6.564
  125    HE   ARG  21           HE       ARG  21  -6.774  -5.480   6.574
  126   HH11  ARG  21          1HH1      ARG  21  -5.537  -5.570   3.321
  127   HH12  ARG  21          2HH1      ARG  21  -6.938  -6.355   2.671
  128   HH21  ARG  21          1HH2      ARG  21  -8.624  -6.513   5.730
  129   HH22  ARG  21          2HH2      ARG  21  -8.693  -6.890   4.041
  130    H    PHE  22           H        PHE  22  -6.398   0.679   5.713
  131    HA   PHE  22           HA       PHE  22  -6.752   1.355   8.522
  132    HB2  PHE  22           1HB      PHE  22  -6.096   3.496   6.491
  133    HB3  PHE  22           2HB      PHE  22  -6.364   3.717   8.217
  134    HD1  PHE  22           HD2      PHE  22  -4.033   2.492   5.668
  135    HD2  PHE  22           HD1      PHE  22  -4.651   3.219   9.817
  136    HE1  PHE  22           HE2      PHE  22  -1.623   2.208   6.074
  137    HE2  PHE  22           HE1      PHE  22  -2.242   2.937  10.228
  138    HZ   PHE  22           HZ       PHE  22  -0.724   2.430   8.356
  139    H    THR  23           H        THR  23  -8.725   2.352   8.986
  140    HA   THR  23           HA       THR  23 -10.826   1.775   7.136
  141    HB   THR  23           HB       THR  23 -10.989   3.321   9.730
  142    HG1  THR  23           HG1      THR  23 -10.165   1.216  10.059
  143   HG21  THR  23          3HG2      THR  23 -13.138   1.794   8.261
  144   HG22  THR  23          1HG2      THR  23 -12.929   3.542   8.169
  145   HG23  THR  23          2HG2      THR  23 -13.329   2.782   9.709
  146    H    GLN  24           H        GLN  24  -9.496   4.784   8.492
  147    HA   GLN  24           HA       GLN  24 -10.961   6.290   6.439
  148    HB2  GLN  24           1HB      GLN  24  -9.746   7.117   9.071
  149    HB3  GLN  24           2HB      GLN  24 -10.297   8.284   7.876
  150    HG2  GLN  24           1HG      GLN  24 -12.168   6.152   8.768
  151    HG3  GLN  24           2HG      GLN  24 -11.848   7.515   9.839
  152   HE21  GLN  24          1HE2      GLN  24 -13.702   8.622   9.724
  153   HE22  GLN  24          2HE2      GLN  24 -14.387   9.255   8.270
  154    H    ASN  25           H        ASN  25  -9.877   7.955   5.261
  155    HA   ASN  25           HA       ASN  25  -7.347   7.180   4.275
  156    HB2  ASN  25           1HB      ASN  25  -7.438   9.312   3.001
  157    HB3  ASN  25           2HB      ASN  25  -8.917   8.366   2.856
  158   HD21  ASN  25          1HD2      ASN  25  -7.694  11.380   3.385
  159   HD22  ASN  25          2HD2      ASN  25  -9.071  12.119   4.123
  160    H    SER  26           H        SER  26  -8.369   9.679   6.547
  161    HA   SER  26           HA       SER  26  -6.117  11.195   6.824
  162    HB2  SER  26           1HB      SER  26  -8.186  11.612   8.081
  163    HB3  SER  26           2HB      SER  26  -7.877  10.189   9.075
  164    HG   SER  26           HG       SER  26  -5.721  11.468   9.365
  165    H    HIS  27           H        HIS  27  -6.777   8.132   8.513
  166    HA   HIS  27           HA       HIS  27  -4.467   7.936  10.011
  167    HB2  HIS  27           1HB      HIS  27  -6.581   6.356   9.767
  168    HB3  HIS  27           2HB      HIS  27  -5.507   5.466   8.692
  169    HD1  HIS  27           HD1      HIS  27  -6.534   4.334  11.418
  170    HD2  HIS  27           HD2      HIS  27  -2.858   6.176  10.822
  171    HE1  HIS  27           HE1      HIS  27  -5.050   3.484  13.261
  172    H    LEU  28           H        LEU  28  -4.982   7.082   6.624
  173    HA   LEU  28           HA       LEU  28  -2.403   5.940   6.237
  174    HB2  LEU  28           1HB      LEU  28  -4.032   5.257   4.711
  175    HB3  LEU  28           2HB      LEU  28  -4.570   6.908   4.408
  176    HG   LEU  28           HG       LEU  28  -2.286   7.254   3.303
  177   HD11  LEU  28          1HD1      LEU  28  -2.348   4.262   3.059
  178   HD12  LEU  28          2HD1      LEU  28  -1.393   5.091   4.288
  179   HD13  LEU  28          3HD1      LEU  28  -1.071   5.379   2.578
  180   HD21  LEU  28          3HD2      LEU  28  -3.146   5.861   1.248
  181   HD22  LEU  28          1HD2      LEU  28  -4.023   7.284   1.810
  182   HD23  LEU  28          2HD2      LEU  28  -4.582   5.672   2.256
  183    H    HIS  29           H        HIS  29  -3.727   8.905   4.762
  184    HA   HIS  29           HA       HIS  29  -1.530  10.071   3.770
  185    HB2  HIS  29           1HB      HIS  29  -3.901  11.222   5.170
  186    HB3  HIS  29           2HB      HIS  29  -2.572  12.302   4.760
  187    HD1  HIS  29           HD1      HIS  29  -5.368  12.567   3.450
  188    HD2  HIS  29           HD2      HIS  29  -2.171  10.490   1.798
  189    HE1  HIS  29           HE1      HIS  29  -5.819  12.496   0.977
  190    H    SER  30           H        SER  30  -2.500  10.393   7.183
  191    HA   SER  30           HA       SER  30  -0.150  11.806   7.938
  192    HB2  SER  30           1HB      SER  30  -2.022  12.137   9.338
  193    HB3  SER  30           2HB      SER  30  -2.322  10.406   9.489
  194    HG   SER  30           HG       SER  30   0.139  11.353  10.379
  195    H    HIS  31           H        HIS  31  -1.128   8.415   8.083
  196    HA   HIS  31           HA       HIS  31   0.957   7.390   9.602
  197    HB2  HIS  31           1HB      HIS  31  -0.720   5.847   9.171
  198    HB3  HIS  31           2HB      HIS  31  -0.798   6.254   7.460
  199    HD1  HIS  31           HD1      HIS  31   0.905   4.021   9.879
  200    HD2  HIS  31           HD2      HIS  31   1.166   4.987   5.847
  201    HE1  HIS  31           HE1      HIS  31   2.344   2.233   8.852
  202    H    GLN  32           H        GLN  32   0.901   8.421   6.273
  203    HA   GLN  32           HA       GLN  32   3.164   7.139   5.286
  204    HB2  GLN  32           1HB      GLN  32   2.139   9.909   4.641
  205    HB3  GLN  32           2HB      GLN  32   3.311   9.017   3.680
  206    HG2  GLN  32           1HG      GLN  32   1.723   7.427   3.014
  207    HG3  GLN  32           2HG      GLN  32   0.581   7.926   4.261
  208   HE21  GLN  32          1HE2      GLN  32  -0.129   7.687   1.596
  209   HE22  GLN  32          2HE2      GLN  32  -0.493   9.255   0.967
  210    H    ARG  33           H        ARG  33   2.878   9.773   7.516
  211    HA   ARG  33           HA       ARG  33   5.288  11.077   7.287
  212    HB2  ARG  33           1HB      ARG  33   3.511  10.453   9.609
  213    HB3  ARG  33           2HB      ARG  33   5.080  11.187   9.913
  214    HG2  ARG  33           1HG      ARG  33   4.516  13.155   8.840
  215    HG3  ARG  33           2HG      ARG  33   3.226  12.394   7.907
  216    HD2  ARG  33           1HD      ARG  33   2.062  13.620   9.495
  217    HD3  ARG  33           2HD      ARG  33   2.110  12.006  10.202
  218    HE   ARG  33           HE       ARG  33   4.326  13.496  11.097
  219   HH11  ARG  33          1HH1      ARG  33   0.869  13.300  11.466
  220   HH12  ARG  33          2HH1      ARG  33   0.873  13.946  13.074
  221   HH21  ARG  33          1HH2      ARG  33   4.344  14.348  13.213
  222   HH22  ARG  33          2HH2      ARG  33   2.850  14.542  14.066
  223    H    VAL  34           H        VAL  34   4.614   7.992   8.863
  224    HA   VAL  34           HA       VAL  34   7.046   7.572  10.141
  225    HB   VAL  34           HB       VAL  34   6.561   5.182  10.036
  226   HG11  VAL  34          1HG1      VAL  34   4.529   5.198  11.250
  227   HG12  VAL  34          2HG1      VAL  34   5.306   6.749  11.571
  228   HG13  VAL  34          3HG1      VAL  34   3.965   6.653  10.429
  229   HG21  VAL  34          3HG2      VAL  34   4.160   4.856   8.797
  230   HG22  VAL  34          1HG2      VAL  34   4.950   6.020   7.733
  231   HG23  VAL  34          2HG2      VAL  34   5.722   4.472   8.076
  232    H    HIS  35           H        HIS  35   6.181   7.237   6.769
  233    HA   HIS  35           HA       HIS  35   8.774   6.051   6.132
  234    HB2  HIS  35           1HB      HIS  35   6.420   6.677   4.337
  235    HB3  HIS  35           2HB      HIS  35   7.876   5.813   3.854
  236    HD1  HIS  35           HD1      HIS  35   8.275   3.620   5.665
  237    HD2  HIS  35           HD2      HIS  35   4.427   4.934   4.812
  238    HE1  HIS  35           HE1      HIS  35   6.764   1.691   6.233
  239    H    THR  36           H        THR  36   7.947   9.000   6.874
  240    HA   THR  36           HA       THR  36   8.288  10.851   4.989
  241    HB   THR  36           HB       THR  36  10.039  11.937   6.686
  242    HG1  THR  36           HG1      THR  36  10.180  10.905   8.547
  243   HG21  THR  36          3HG2      THR  36   8.245  13.180   7.130
  244   HG22  THR  36          1HG2      THR  36   7.540  11.879   8.088
  245   HG23  THR  36          2HG2      THR  36   7.240  11.957   6.352
  246    H    GLY  37           H        GLY  37  11.197   9.536   6.593
  247    HA2  GLY  37           1HA      GLY  37  13.148  10.517   4.992
  248    HA3  GLY  37           2HA      GLY  37  13.228   8.905   5.686
  249    H    GLU  38           H        GLU  38  12.216   7.146   4.430
  250    HA   GLU  38           HA       GLU  38  13.240   6.696   2.012
  251    HB2  GLU  38           1HB      GLU  38  10.587   5.869   3.136
  252    HB3  GLU  38           2HB      GLU  38  11.034   5.390   1.504
  253    HG2  GLU  38           1HG      GLU  38  12.670   4.809   3.961
  254    HG3  GLU  38           2HG      GLU  38  11.534   3.684   3.219
  255    H    LYS  39           H        LYS  39  13.048   7.359  -0.043
  256    HA   LYS  39           HA       LYS  39  11.028   9.413  -0.615
  257    HB2  LYS  39           1HB      LYS  39  12.481  10.223  -2.333
  258    HB3  LYS  39           2HB      LYS  39  13.456   9.979  -0.890
  259    HG2  LYS  39           1HG      LYS  39  14.105   7.740  -1.860
  260    HG3  LYS  39           2HG      LYS  39  13.351   8.277  -3.363
  261    HD2  LYS  39           1HD      LYS  39  15.431   9.942  -1.984
  262    HD3  LYS  39           2HD      LYS  39  15.885   8.628  -3.071
  263    HE2  LYS  39           1HE      LYS  39  13.958  10.781  -3.894
  264    HE3  LYS  39           2HE      LYS  39  15.702  10.981  -4.059
  265    HZ1  LYS  39           3HZ      LYS  39  14.183   9.943  -5.958
  266    HZ2  LYS  39           1HZ      LYS  39  14.573   8.521  -5.128
  267    HZ3  LYS  39           2HZ      LYS  39  15.803   9.506  -5.744
  268    HA   PRO  40           HA       PRO  40   8.870   6.749  -3.371
  269    HB2  PRO  40           1HB      PRO  40   7.762   8.602  -5.017
  270    HB3  PRO  40           2HB      PRO  40   7.202   8.329  -3.363
  271    HG2  PRO  40           1HG      PRO  40   9.028  10.453  -4.418
  272    HG3  PRO  40           2HG      PRO  40   7.699  10.598  -3.253
  273    HD2  PRO  40           1HD      PRO  40  10.296  10.490  -2.494
  274    HD3  PRO  40           2HD      PRO  40   8.983   9.825  -1.501
  275    H    SER  41           H        SER  41   9.929   5.520  -4.795
  276    HA   SER  41           HA       SER  41  12.021   6.302  -6.444
  277    HB2  SER  41           1HB      SER  41  10.084   3.996  -6.730
  278    HB3  SER  41           2HB      SER  41  11.535   4.183  -7.713
  279    HG   SER  41           HG       SER  41  12.715   3.554  -6.084
  280    H    GLY  42           H        GLY  42  12.195   7.095  -8.480
  281    HA2  GLY  42           1HA      GLY  42  11.334   7.445 -10.702
  282    HA3  GLY  42           2HA      GLY  42   9.714   7.481 -10.021
  283    HA   PRO  43           HA       PRO  43  11.289  11.838 -10.717
  284    HB2  PRO  43           1HB      PRO  43   9.243  12.620 -12.320
  285    HB3  PRO  43           2HB      PRO  43  10.713  11.860 -12.941
  286    HG2  PRO  43           1HG      PRO  43   8.035  10.638 -12.395
  287    HG3  PRO  43           2HG      PRO  43   9.115  10.395 -13.781
  288    HD2  PRO  43           1HD      PRO  43   8.951   8.629 -11.735
  289    HD3  PRO  43           2HD      PRO  43  10.454   8.908 -12.638
  290    H    SER  44           H        SER  44  10.249  13.819 -10.033
  291    HA   SER  44           HA       SER  44   8.911  13.705  -7.657
  292    HB2  SER  44           1HB      SER  44   8.700  15.891  -9.743
  293    HB3  SER  44           2HB      SER  44   8.255  16.062  -8.045
  294    HG   SER  44           HG       SER  44  10.507  16.675  -8.872
  295    H    SER  45           H        SER  45   6.691  14.422  -7.106
  296    HA   SER  45           HA       SER  45   4.757  12.723  -8.074
  297    HB2  SER  45           1HB      SER  45   4.342  15.456  -6.837
  298    HB3  SER  45           2HB      SER  45   3.104  14.209  -6.987
  299    HG   SER  45           HG       SER  45   5.217  14.407  -5.222
  300    H    GLY  46           H        GLY  46   5.074  16.189  -8.874
  301    HA2  GLY  46           1HA      GLY  46   4.509  15.812 -11.620
  302    HA3  GLY  46           2HA      GLY  46   3.043  16.299 -10.782
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -12.230 -28.019  -3.409
    2    HA2  GLY   1           1HA      GLY   1 -14.292 -26.209  -2.326
    3    HA3  GLY   1           2HA      GLY   1 -12.945 -26.859  -1.403
    4    H    SER   2           H        SER   2 -13.290 -24.244  -1.189
    5    HA   SER   2           HA       SER   2 -10.858 -23.154  -2.104
    6    HB2  SER   2           1HB      SER   2 -12.020 -23.051  -4.267
    7    HB3  SER   2           2HB      SER   2 -13.328 -22.130  -3.526
    8    HG   SER   2           HG       SER   2 -12.168 -20.401  -3.738
    9    H    SER   3           H        SER   3 -10.402 -21.145  -1.171
   10    HA   SER   3           HA       SER   3 -12.437 -20.180   0.732
   11    HB2  SER   3           1HB      SER   3  -9.433 -20.132   1.103
   12    HB3  SER   3           2HB      SER   3 -10.644 -19.620   2.279
   13    HG   SER   3           HG       SER   3 -10.320 -22.251   1.257
   14    H    GLY   4           H        GLY   4 -12.333 -19.173  -1.852
   15    HA2  GLY   4           1HA      GLY   4 -10.974 -16.575  -1.550
   16    HA3  GLY   4           2HA      GLY   4 -11.469 -17.285  -3.080
   17    H    SER   5           H        SER   5 -13.021 -16.422   0.016
   18    HA   SER   5           HA       SER   5 -15.484 -15.753  -1.295
   19    HB2  SER   5           1HB      SER   5 -15.016 -16.601   1.171
   20    HB3  SER   5           2HB      SER   5 -14.905 -14.873   1.503
   21    HG   SER   5           HG       SER   5 -17.101 -16.361   0.551
   22    H    SER   6           H        SER   6 -13.061 -13.859   0.508
   23    HA   SER   6           HA       SER   6 -14.231 -11.355  -0.228
   24    HB2  SER   6           1HB      SER   6 -12.983 -11.560   1.857
   25    HB3  SER   6           2HB      SER   6 -11.524 -11.998   0.968
   26    HG   SER   6           HG       SER   6 -11.525  -9.790   1.528
   27    H    GLY   7           H        GLY   7 -11.138 -12.916  -1.095
   28    HA2  GLY   7           1HA      GLY   7 -10.057 -12.941  -3.147
   29    HA3  GLY   7           2HA      GLY   7 -11.376 -11.993  -3.818
   30    H    SER   8           H        SER   8 -11.274  -9.751  -3.783
   31    HA   SER   8           HA       SER   8  -8.763  -8.589  -4.064
   32    HB2  SER   8           1HB      SER   8 -11.456  -7.339  -3.498
   33    HB3  SER   8           2HB      SER   8 -10.011  -6.395  -3.861
   34    HG   SER   8           HG       SER   8 -10.632  -6.697  -5.851
   35    H    GLY   9           H        GLY   9  -8.253  -6.453  -2.729
   36    HA2  GLY   9           1HA      GLY   9  -7.211  -7.224  -0.285
   37    HA3  GLY   9           2HA      GLY   9  -7.502  -5.556  -0.753
   38    H    GLU  10           H        GLU  10  -7.810  -5.553   1.698
   39    HA   GLU  10           HA       GLU  10 -10.577  -6.285   2.379
   40    HB2  GLU  10           1HB      GLU  10  -8.166  -5.807   4.132
   41    HB3  GLU  10           2HB      GLU  10  -9.796  -6.008   4.758
   42    HG2  GLU  10           1HG      GLU  10  -8.060  -8.017   3.378
   43    HG3  GLU  10           2HG      GLU  10  -8.812  -8.110   4.970
   44    H    LYS  11           H        LYS  11  -8.170  -3.702   2.745
   45    HA   LYS  11           HA       LYS  11 -10.384  -1.807   3.181
   46    HB2  LYS  11           1HB      LYS  11  -7.493  -1.585   4.038
   47    HB3  LYS  11           2HB      LYS  11  -8.720  -0.351   4.289
   48    HG2  LYS  11           1HG      LYS  11  -9.980  -2.324   5.492
   49    HG3  LYS  11           2HG      LYS  11  -8.342  -2.961   5.657
   50    HD2  LYS  11           1HD      LYS  11  -7.795  -0.558   6.511
   51    HD3  LYS  11           2HD      LYS  11  -9.534  -0.465   6.796
   52    HE2  LYS  11           1HE      LYS  11  -7.855  -2.740   7.817
   53    HE3  LYS  11           2HE      LYS  11  -8.078  -1.250   8.734
   54    HZ1  LYS  11           3HZ      LYS  11 -10.379  -2.816   7.734
   55    HZ2  LYS  11           1HZ      LYS  11 -10.352  -1.648   8.958
   56    HZ3  LYS  11           2HZ      LYS  11  -9.649  -3.163   9.220
   57    HA   PRO  12           HA       PRO  12  -9.383   0.113  -0.651
   58    HB2  PRO  12           1HB      PRO  12 -10.390   2.588  -0.176
   59    HB3  PRO  12           2HB      PRO  12 -11.411   1.177  -0.478
   60    HG2  PRO  12           1HG      PRO  12 -10.667   2.454   2.125
   61    HG3  PRO  12           2HG      PRO  12 -12.243   1.845   1.588
   62    HD2  PRO  12           1HD      PRO  12 -10.623   0.439   3.241
   63    HD3  PRO  12           2HD      PRO  12 -11.701  -0.344   2.067
   64    H    PHE  13           H        PHE  13  -8.660   2.006   2.277
   65    HA   PHE  13           HA       PHE  13  -6.520   3.413   0.905
   66    HB2  PHE  13           1HB      PHE  13  -7.137   3.646   3.839
   67    HB3  PHE  13           2HB      PHE  13  -6.434   4.849   2.762
   68    HD1  PHE  13           HD1      PHE  13  -7.887   5.956   1.056
   69    HD2  PHE  13           HD2      PHE  13  -9.461   3.498   4.154
   70    HE1  PHE  13           HE1      PHE  13 -10.113   6.945   0.706
   71    HE2  PHE  13           HE2      PHE  13 -11.689   4.483   3.808
   72    HZ   PHE  13           HZ       PHE  13 -12.017   6.208   2.082
   73    H    GLN  14           H        GLN  14  -4.638   2.404   0.677
   74    HA   GLN  14           HA       GLN  14  -3.473   1.074   3.015
   75    HB2  GLN  14           1HB      GLN  14  -3.546  -0.083   0.224
   76    HB3  GLN  14           2HB      GLN  14  -2.615  -0.742   1.562
   77    HG2  GLN  14           1HG      GLN  14  -4.798  -0.978   2.802
   78    HG3  GLN  14           2HG      GLN  14  -5.600  -0.605   1.278
   79   HE21  GLN  14          1HE2      GLN  14  -2.942  -2.683   2.390
   80   HE22  GLN  14          2HE2      GLN  14  -3.469  -4.096   1.548
   81    H    CYS  15           H        CYS  15  -1.277   1.292   3.229
   82    HA   CYS  15           HA       CYS  15  -0.037   3.494   2.024
   83    HB2  CYS  15           1HB      CYS  15   0.510   2.137   4.224
   84    HB3  CYS  15           2HB      CYS  15   1.616   1.276   3.158
   85    H    GLU  16           H        GLU  16   2.265   3.193   1.001
   86    HA   GLU  16           HA       GLU  16   1.982   1.279  -1.222
   87    HB2  GLU  16           1HB      GLU  16   1.915   3.913  -1.553
   88    HB3  GLU  16           2HB      GLU  16   3.662   3.726  -1.505
   89    HG2  GLU  16           1HG      GLU  16   3.687   2.384  -3.421
   90    HG3  GLU  16           2HG      GLU  16   1.954   2.076  -3.331
   91    H    GLU  17           H        GLU  17   4.033   2.546   1.263
   92    HA   GLU  17           HA       GLU  17   6.361   1.097   0.261
   93    HB2  GLU  17           1HB      GLU  17   6.288   2.618   2.847
   94    HB3  GLU  17           2HB      GLU  17   7.654   2.311   1.783
   95    HG2  GLU  17           1HG      GLU  17   7.300   4.487   1.281
   96    HG3  GLU  17           2HG      GLU  17   6.203   3.758   0.109
   97    H    CYS  18           H        CYS  18   3.839   0.821   2.597
   98    HA   CYS  18           HA       CYS  18   5.024  -1.697   3.540
   99    HB2  CYS  18           1HB      CYS  18   4.345  -1.263   5.809
  100    HB3  CYS  18           2HB      CYS  18   5.311   0.101   5.254
  101    H    GLY  19           H        GLY  19   2.590  -0.331   1.896
  102    HA2  GLY  19           1HA      GLY  19   0.321  -0.787   1.613
  103    HA3  GLY  19           2HA      GLY  19   0.981  -2.409   1.463
  104    H    LYS  20           H        LYS  20  -0.110  -0.082   3.922
  105    HA   LYS  20           HA       LYS  20  -0.887  -2.328   5.639
  106    HB2  LYS  20           1HB      LYS  20  -0.157   0.506   6.103
  107    HB3  LYS  20           2HB      LYS  20  -1.397  -0.159   7.158
  108    HG2  LYS  20           1HG      LYS  20   0.338  -2.119   7.412
  109    HG3  LYS  20           2HG      LYS  20   1.481  -0.863   6.929
  110    HD2  LYS  20           1HD      LYS  20   1.493  -0.623   9.219
  111    HD3  LYS  20           2HD      LYS  20   0.250   0.543   8.761
  112    HE2  LYS  20           1HE      LYS  20  -0.647  -0.669  10.573
  113    HE3  LYS  20           2HE      LYS  20  -1.433  -1.314   9.132
  114    HZ1  LYS  20           3HZ      LYS  20   0.032  -3.196   9.172
  115    HZ2  LYS  20           1HZ      LYS  20  -0.695  -3.046  10.693
  116    HZ3  LYS  20           2HZ      LYS  20   0.908  -2.557  10.470
  117    H    ARG  21           H        ARG  21  -2.910  -1.415   7.100
  118    HA   ARG  21           HA       ARG  21  -5.007  -0.665   5.173
  119    HB2  ARG  21           1HB      ARG  21  -5.253  -2.684   7.410
  120    HB3  ARG  21           2HB      ARG  21  -6.547  -2.185   6.329
  121    HG2  ARG  21           1HG      ARG  21  -5.739  -3.392   4.573
  122    HG3  ARG  21           2HG      ARG  21  -4.066  -3.280   5.123
  123    HD2  ARG  21           1HD      ARG  21  -4.293  -5.034   6.599
  124    HD3  ARG  21           2HD      ARG  21  -6.036  -4.813   6.754
  125    HE   ARG  21           HE       ARG  21  -5.578  -5.576   4.139
  126   HH11  ARG  21          1HH1      ARG  21  -5.071  -6.905   7.316
  127   HH12  ARG  21          2HH1      ARG  21  -5.231  -8.550   6.796
  128   HH21  ARG  21          1HH2      ARG  21  -5.791  -7.737   3.442
  129   HH22  ARG  21          2HH2      ARG  21  -5.639  -9.022   4.592
  130    H    PHE  22           H        PHE  22  -6.420   0.870   5.812
  131    HA   PHE  22           HA       PHE  22  -6.556   1.617   8.632
  132    HB2  PHE  22           1HB      PHE  22  -6.003   3.654   6.467
  133    HB3  PHE  22           2HB      PHE  22  -6.144   3.961   8.195
  134    HD1  PHE  22           HD2      PHE  22  -4.026   2.584   5.545
  135    HD2  PHE  22           HD1      PHE  22  -4.341   3.453   9.700
  136    HE1  PHE  22           HE2      PHE  22  -1.602   2.248   5.796
  137    HE2  PHE  22           HE1      PHE  22  -1.917   3.119   9.957
  138    HZ   PHE  22           HZ       PHE  22  -0.544   2.514   8.004
  139    H    THR  23           H        THR  23  -8.644   1.536   9.103
  140    HA   THR  23           HA       THR  23 -10.809   1.289   7.551
  141    HB   THR  23           HB       THR  23 -12.085   2.687   9.319
  142    HG1  THR  23           HG1      THR  23  -9.738   3.534   9.897
  143   HG21  THR  23          3HG2      THR  23 -12.257   0.817  10.631
  144   HG22  THR  23          1HG2      THR  23 -10.519   0.523  10.632
  145   HG23  THR  23          2HG2      THR  23 -11.482   0.110   9.214
  146    H    GLN  24           H        GLN  24  -9.196   4.348   8.254
  147    HA   GLN  24           HA       GLN  24 -10.826   5.600   6.144
  148    HB2  GLN  24           1HB      GLN  24  -9.985   6.677   8.817
  149    HB3  GLN  24           2HB      GLN  24 -10.318   7.769   7.479
  150    HG2  GLN  24           1HG      GLN  24 -12.334   5.698   8.187
  151    HG3  GLN  24           2HG      GLN  24 -12.181   7.132   9.200
  152   HE21  GLN  24          1HE2      GLN  24 -13.200   8.917   8.592
  153   HE22  GLN  24          2HE2      GLN  24 -13.932   9.180   7.049
  154    H    ASN  25           H        ASN  25  -9.741   7.548   5.177
  155    HA   ASN  25           HA       ASN  25  -7.099   6.811   4.343
  156    HB2  ASN  25           1HB      ASN  25  -7.321   9.098   3.108
  157    HB3  ASN  25           2HB      ASN  25  -8.332   7.747   2.606
  158   HD21  ASN  25          1HD2      ASN  25  -8.244  10.905   3.894
  159   HD22  ASN  25          2HD2      ASN  25  -9.949  11.136   4.052
  160    H    SER  26           H        SER  26  -8.486   9.540   6.148
  161    HA   SER  26           HA       SER  26  -6.459  11.217   6.567
  162    HB2  SER  26           1HB      SER  26  -8.564  11.505   7.731
  163    HB3  SER  26           2HB      SER  26  -8.251  10.085   8.728
  164    HG   SER  26           HG       SER  26  -7.610  11.727   9.985
  165    H    HIS  27           H        HIS  27  -6.798   8.148   8.331
  166    HA   HIS  27           HA       HIS  27  -4.523   8.327   9.913
  167    HB2  HIS  27           1HB      HIS  27  -6.452   6.517   9.751
  168    HB3  HIS  27           2HB      HIS  27  -5.266   5.677   8.756
  169    HD1  HIS  27           HD1      HIS  27  -6.393   5.253  11.892
  170    HD2  HIS  27           HD2      HIS  27  -2.585   6.182  10.513
  171    HE1  HIS  27           HE1      HIS  27  -4.822   4.536  13.720
  172    H    LEU  28           H        LEU  28  -4.873   7.036   6.628
  173    HA   LEU  28           HA       LEU  28  -2.217   6.162   6.323
  174    HB2  LEU  28           1HB      LEU  28  -3.785   5.339   4.787
  175    HB3  LEU  28           2HB      LEU  28  -4.366   6.954   4.387
  176    HG   LEU  28           HG       LEU  28  -2.147   7.373   3.286
  177   HD11  LEU  28          1HD1      LEU  28  -0.720   5.534   2.759
  178   HD12  LEU  28          2HD1      LEU  28  -1.828   4.387   3.511
  179   HD13  LEU  28          3HD1      LEU  28  -0.956   5.552   4.507
  180   HD21  LEU  28          3HD2      LEU  28  -3.847   5.120   2.221
  181   HD22  LEU  28          1HD2      LEU  28  -2.705   6.076   1.275
  182   HD23  LEU  28          2HD2      LEU  28  -4.125   6.846   1.984
  183    H    HIS  29           H        HIS  29  -3.786   9.187   5.288
  184    HA   HIS  29           HA       HIS  29  -1.767  10.483   4.029
  185    HB2  HIS  29           1HB      HIS  29  -3.703  11.633   6.046
  186    HB3  HIS  29           2HB      HIS  29  -2.692  12.611   4.987
  187    HD1  HIS  29           HD1      HIS  29  -5.768  12.775   4.858
  188    HD2  HIS  29           HD2      HIS  29  -3.448  10.328   2.430
  189    HE1  HIS  29           HE1      HIS  29  -7.167  12.332   2.815
  190    H    SER  30           H        SER  30  -2.293  10.667   7.555
  191    HA   SER  30           HA       SER  30   0.200  11.956   8.036
  192    HB2  SER  30           1HB      SER  30  -1.950  11.950   9.494
  193    HB3  SER  30           2HB      SER  30  -1.319  10.435  10.140
  194    HG   SER  30           HG       SER  30   0.426  12.603  10.017
  195    H    HIS  31           H        HIS  31  -0.958   8.631   8.515
  196    HA   HIS  31           HA       HIS  31   1.224   7.475   9.695
  197    HB2  HIS  31           1HB      HIS  31  -0.518   5.989   9.440
  198    HB3  HIS  31           2HB      HIS  31  -0.834   6.478   7.778
  199    HD1  HIS  31           HD1      HIS  31   1.244   4.151   9.825
  200    HD2  HIS  31           HD2      HIS  31   0.670   5.130   5.828
  201    HE1  HIS  31           HE1      HIS  31   2.394   2.337   8.516
  202    H    GLN  32           H        GLN  32   0.855   8.457   6.354
  203    HA   GLN  32           HA       GLN  32   2.957   7.098   5.166
  204    HB2  GLN  32           1HB      GLN  32   1.649   9.738   4.637
  205    HB3  GLN  32           2HB      GLN  32   3.086   9.290   3.728
  206    HG2  GLN  32           1HG      GLN  32   1.784   7.089   3.269
  207    HG3  GLN  32           2HG      GLN  32   0.375   8.051   3.712
  208   HE21  GLN  32          1HE2      GLN  32  -0.565   8.154   1.736
  209   HE22  GLN  32          2HE2      GLN  32   0.134   8.956   0.375
  210    H    ARG  33           H        ARG  33   2.995   9.975   7.177
  211    HA   ARG  33           HA       ARG  33   5.623  10.813   6.675
  212    HB2  ARG  33           1HB      ARG  33   3.787  11.137   9.037
  213    HB3  ARG  33           2HB      ARG  33   5.417  11.796   9.045
  214    HG2  ARG  33           1HG      ARG  33   4.857  13.074   6.996
  215    HG3  ARG  33           2HG      ARG  33   3.197  12.489   7.136
  216    HD2  ARG  33           1HD      ARG  33   3.192  14.619   8.133
  217    HD3  ARG  33           2HD      ARG  33   3.207  13.475   9.476
  218    HE   ARG  33           HE       ARG  33   5.828  14.335   8.693
  219   HH11  ARG  33          1HH1      ARG  33   3.029  15.119  10.608
  220   HH12  ARG  33          2HH1      ARG  33   3.909  16.106  11.727
  221   HH21  ARG  33          1HH2      ARG  33   6.998  15.632  10.160
  222   HH22  ARG  33          2HH2      ARG  33   6.167  16.398  11.471
  223    H    VAL  34           H        VAL  34   4.493   8.013   8.179
  224    HA   VAL  34           HA       VAL  34   6.521   7.615  10.123
  225    HB   VAL  34           HB       VAL  34   4.259   6.384   9.861
  226   HG11  VAL  34          1HG1      VAL  34   4.863   5.639   7.512
  227   HG12  VAL  34          2HG1      VAL  34   5.944   4.468   8.271
  228   HG13  VAL  34          3HG1      VAL  34   4.210   4.402   8.587
  229   HG21  VAL  34          3HG2      VAL  34   6.768   5.645  11.034
  230   HG22  VAL  34          1HG2      VAL  34   5.132   5.367  11.632
  231   HG23  VAL  34          2HG2      VAL  34   5.886   4.197  10.548
  232    H    HIS  35           H        HIS  35   6.580   7.541   6.745
  233    HA   HIS  35           HA       HIS  35   9.033   5.909   6.750
  234    HB2  HIS  35           1HB      HIS  35   7.253   6.477   4.375
  235    HB3  HIS  35           2HB      HIS  35   8.594   5.338   4.452
  236    HD1  HIS  35           HD1      HIS  35   8.177   3.293   6.234
  237    HD2  HIS  35           HD2      HIS  35   4.837   5.359   4.880
  238    HE1  HIS  35           HE1      HIS  35   6.217   1.793   6.717
  239    H    THR  36           H        THR  36   8.309   8.947   7.044
  240    HA   THR  36           HA       THR  36   9.122  10.579   5.102
  241    HB   THR  36           HB       THR  36  10.610  11.728   6.997
  242    HG1  THR  36           HG1      THR  36  10.360   9.752   8.314
  243   HG21  THR  36          3HG2      THR  36   7.622  11.529   6.775
  244   HG22  THR  36          1HG2      THR  36   8.685  12.839   6.263
  245   HG23  THR  36          2HG2      THR  36   8.382  12.569   7.979
  246    H    GLY  37           H        GLY  37  10.719  10.605   3.669
  247    HA2  GLY  37           1HA      GLY  37  13.430  10.569   4.224
  248    HA3  GLY  37           2HA      GLY  37  12.989   8.902   3.885
  249    H    GLU  38           H        GLU  38  11.568   8.704   1.822
  250    HA   GLU  38           HA       GLU  38  13.143   9.523  -0.359
  251    HB2  GLU  38           1HB      GLU  38  11.413   7.563  -0.100
  252    HB3  GLU  38           2HB      GLU  38  10.275   8.751  -0.721
  253    HG2  GLU  38           1HG      GLU  38  11.077   7.443  -2.545
  254    HG3  GLU  38           2HG      GLU  38  11.752   9.065  -2.686
  255    H    LYS  39           H        LYS  39  13.196  11.357  -1.471
  256    HA   LYS  39           HA       LYS  39  10.911  13.204  -1.235
  257    HB2  LYS  39           1HB      LYS  39  12.536  15.048  -1.516
  258    HB3  LYS  39           2HB      LYS  39  12.838  14.098  -0.067
  259    HG2  LYS  39           1HG      LYS  39  14.961  14.265  -0.842
  260    HG3  LYS  39           2HG      LYS  39  14.469  12.802  -1.699
  261    HD2  LYS  39           1HD      LYS  39  14.317  13.877  -3.723
  262    HD3  LYS  39           2HD      LYS  39  13.983  15.446  -2.986
  263    HE2  LYS  39           1HE      LYS  39  16.153  15.653  -3.834
  264    HE3  LYS  39           2HE      LYS  39  16.385  15.343  -2.114
  265    HZ1  LYS  39           3HZ      LYS  39  16.476  12.876  -2.969
  266    HZ2  LYS  39           1HZ      LYS  39  17.850  13.863  -2.988
  267    HZ3  LYS  39           2HZ      LYS  39  16.963  13.622  -4.407
  268    HA   PRO  40           HA       PRO  40  10.522  12.964  -5.615
  269    HB2  PRO  40           1HB      PRO  40   9.186  15.287  -6.046
  270    HB3  PRO  40           2HB      PRO  40   8.428  13.863  -5.326
  271    HG2  PRO  40           1HG      PRO  40   9.519  16.308  -3.988
  272    HG3  PRO  40           2HG      PRO  40   8.015  15.429  -3.657
  273    HD2  PRO  40           1HD      PRO  40  10.241  15.127  -2.146
  274    HD3  PRO  40           2HD      PRO  40   9.088  13.806  -2.421
  275    H    SER  41           H        SER  41  11.519  13.694  -7.458
  276    HA   SER  41           HA       SER  41  13.837  15.318  -7.137
  277    HB2  SER  41           1HB      SER  41  13.758  13.451  -8.742
  278    HB3  SER  41           2HB      SER  41  12.528  14.305  -9.675
  279    HG   SER  41           HG       SER  41  14.743  14.542 -10.438
  280    H    GLY  42           H        GLY  42  13.178  17.363  -6.471
  281    HA2  GLY  42           1HA      GLY  42  13.074  19.591  -7.427
  282    HA3  GLY  42           2HA      GLY  42  11.919  18.973  -8.599
  283    HA   PRO  43           HA       PRO  43   9.528  19.252  -4.402
  284    HB2  PRO  43           1HB      PRO  43  10.812  20.481  -2.350
  285    HB3  PRO  43           2HB      PRO  43  10.906  18.739  -2.636
  286    HG2  PRO  43           1HG      PRO  43  12.860  20.886  -3.367
  287    HG3  PRO  43           2HG      PRO  43  13.167  19.279  -2.682
  288    HD2  PRO  43           1HD      PRO  43  13.482  19.826  -5.316
  289    HD3  PRO  43           2HD      PRO  43  12.967  18.232  -4.726
  290    H    SER  44           H        SER  44   8.160  20.926  -3.781
  291    HA   SER  44           HA       SER  44   8.987  23.682  -4.095
  292    HB2  SER  44           1HB      SER  44   7.021  22.369  -5.968
  293    HB3  SER  44           2HB      SER  44   7.018  24.109  -5.681
  294    HG   SER  44           HG       SER  44   8.451  24.082  -7.231
  295    H    SER  45           H        SER  45   7.068  25.176  -3.665
  296    HA   SER  45           HA       SER  45   5.063  23.950  -1.920
  297    HB2  SER  45           1HB      SER  45   6.691  24.553  -0.306
  298    HB3  SER  45           2HB      SER  45   7.032  26.087  -1.107
  299    HG   SER  45           HG       SER  45   5.213  25.543   0.789
  300    H    GLY  46           H        GLY  46   3.200  25.258  -1.554
  301    HA2  GLY  46           1HA      GLY  46   1.743  27.035  -1.965
  302    HA3  GLY  46           2HA      GLY  46   2.975  27.781  -2.972
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1  -6.938 -20.955  -7.814
    2    HA2  GLY   1           1HA      GLY   1  -5.424 -18.432  -7.967
    3    HA3  GLY   1           2HA      GLY   1  -7.041 -18.527  -8.649
    4    H    SER   2           H        SER   2  -5.600 -19.697  -5.607
    5    HA   SER   2           HA       SER   2  -7.937 -18.923  -4.128
    6    HB2  SER   2           1HB      SER   2  -6.587 -19.703  -2.150
    7    HB3  SER   2           2HB      SER   2  -6.783 -20.910  -3.420
    8    HG   SER   2           HG       SER   2  -4.701 -20.615  -4.034
    9    H    SER   3           H        SER   3  -8.213 -17.217  -2.770
   10    HA   SER   3           HA       SER   3  -6.818 -14.844  -3.241
   11    HB2  SER   3           1HB      SER   3  -9.034 -14.681  -2.388
   12    HB3  SER   3           2HB      SER   3  -8.647 -15.684  -0.990
   13    HG   SER   3           HG       SER   3  -8.736 -13.282  -0.726
   14    H    GLY   4           H        GLY   4  -6.804 -16.773  -0.232
   15    HA2  GLY   4           1HA      GLY   4  -5.139 -17.139   1.310
   16    HA3  GLY   4           2HA      GLY   4  -3.989 -16.679   0.064
   17    H    SER   5           H        SER   5  -5.334 -15.835   3.012
   18    HA   SER   5           HA       SER   5  -3.760 -13.464   3.198
   19    HB2  SER   5           1HB      SER   5  -5.576 -12.434   1.994
   20    HB3  SER   5           2HB      SER   5  -6.768 -13.178   3.060
   21    HG   SER   5           HG       SER   5  -4.824 -11.613   4.276
   22    H    SER   6           H        SER   6  -3.538 -12.731   5.321
   23    HA   SER   6           HA       SER   6  -4.427 -14.648   7.330
   24    HB2  SER   6           1HB      SER   6  -2.010 -13.834   7.101
   25    HB3  SER   6           2HB      SER   6  -2.574 -12.311   7.788
   26    HG   SER   6           HG       SER   6  -3.217 -13.436   9.636
   27    H    GLY   7           H        GLY   7  -6.643 -13.980   7.377
   28    HA2  GLY   7           1HA      GLY   7  -7.981 -12.919   9.147
   29    HA3  GLY   7           2HA      GLY   7  -7.030 -11.465   8.881
   30    H    SER   8           H        SER   8  -9.877 -11.642   8.815
   31    HA   SER   8           HA       SER   8 -10.460 -11.251   5.959
   32    HB2  SER   8           1HB      SER   8 -12.420 -11.602   8.240
   33    HB3  SER   8           2HB      SER   8 -12.801 -11.574   6.518
   34    HG   SER   8           HG       SER   8 -12.679 -13.705   7.235
   35    H    GLY   9           H        GLY   9  -9.691  -9.153   5.721
   36    HA2  GLY   9           1HA      GLY   9 -11.480  -7.067   6.220
   37    HA3  GLY   9           2HA      GLY   9 -10.263  -7.023   7.487
   38    H    GLU  10           H        GLU  10 -10.991  -6.311   4.213
   39    HA   GLU  10           HA       GLU  10  -8.228  -5.370   3.799
   40    HB2  GLU  10           1HB      GLU  10 -10.195  -6.643   1.958
   41    HB3  GLU  10           2HB      GLU  10  -9.117  -5.425   1.292
   42    HG2  GLU  10           1HG      GLU  10  -7.189  -6.686   1.927
   43    HG3  GLU  10           2HG      GLU  10  -8.179  -7.840   2.819
   44    H    LYS  11           H        LYS  11  -8.199  -3.260   4.249
   45    HA   LYS  11           HA       LYS  11 -10.486  -1.570   3.740
   46    HB2  LYS  11           1HB      LYS  11  -7.856  -1.270   5.096
   47    HB3  LYS  11           2HB      LYS  11  -8.613   0.191   4.476
   48    HG2  LYS  11           1HG      LYS  11  -9.494   0.184   6.564
   49    HG3  LYS  11           2HG      LYS  11 -10.713  -0.798   5.749
   50    HD2  LYS  11           1HD      LYS  11  -8.350  -2.178   6.915
   51    HD3  LYS  11           2HD      LYS  11  -9.586  -1.569   8.019
   52    HE2  LYS  11           1HE      LYS  11 -11.237  -2.767   6.411
   53    HE3  LYS  11           2HE      LYS  11  -9.809  -3.657   5.886
   54    HZ1  LYS  11           3HZ      LYS  11  -9.967  -3.562   8.720
   55    HZ2  LYS  11           1HZ      LYS  11  -9.894  -4.908   7.698
   56    HZ3  LYS  11           2HZ      LYS  11 -11.388  -4.208   8.070
   57    HA   PRO  12           HA       PRO  12  -9.347  -0.058  -0.222
   58    HB2  PRO  12           1HB      PRO  12 -10.320   2.474  -0.099
   59    HB3  PRO  12           2HB      PRO  12 -11.359   1.051  -0.238
   60    HG2  PRO  12           1HG      PRO  12 -10.648   2.647   2.193
   61    HG3  PRO  12           2HG      PRO  12 -12.224   1.996   1.703
   62    HD2  PRO  12           1HD      PRO  12 -10.666   0.794   3.564
   63    HD3  PRO  12           2HD      PRO  12 -11.732  -0.119   2.476
   64    H    PHE  13           H        PHE  13  -8.555   2.032   2.531
   65    HA   PHE  13           HA       PHE  13  -6.499   3.421   1.045
   66    HB2  PHE  13           1HB      PHE  13  -7.007   3.558   4.018
   67    HB3  PHE  13           2HB      PHE  13  -6.192   4.748   3.008
   68    HD1  PHE  13           HD1      PHE  13  -7.603   5.867   1.167
   69    HD2  PHE  13           HD2      PHE  13  -9.261   3.779   4.484
   70    HE1  PHE  13           HE1      PHE  13  -9.733   7.055   0.845
   71    HE2  PHE  13           HE2      PHE  13 -11.394   4.963   4.167
   72    HZ   PHE  13           HZ       PHE  13 -11.633   6.603   2.346
   73    H    GLN  14           H        GLN  14  -4.768   2.204   0.555
   74    HA   GLN  14           HA       GLN  14  -3.445   0.779   2.769
   75    HB2  GLN  14           1HB      GLN  14  -3.663   0.006  -0.139
   76    HB3  GLN  14           2HB      GLN  14  -2.512  -0.734   0.966
   77    HG2  GLN  14           1HG      GLN  14  -4.513  -1.308   2.421
   78    HG3  GLN  14           2HG      GLN  14  -5.506  -0.869   1.032
   79   HE21  GLN  14          1HE2      GLN  14  -2.775  -2.921   1.957
   80   HE22  GLN  14          2HE2      GLN  14  -3.170  -4.226   0.896
   81    H    CYS  15           H        CYS  15  -1.229   0.964   2.952
   82    HA   CYS  15           HA       CYS  15  -0.068   3.349   1.945
   83    HB2  CYS  15           1HB      CYS  15   0.448   2.008   4.127
   84    HB3  CYS  15           2HB      CYS  15   1.564   1.113   3.102
   85    H    GLU  16           H        GLU  16   2.196   3.269   0.924
   86    HA   GLU  16           HA       GLU  16   2.122   1.367  -1.325
   87    HB2  GLU  16           1HB      GLU  16   2.736   4.273  -1.171
   88    HB3  GLU  16           2HB      GLU  16   3.661   3.313  -2.317
   89    HG2  GLU  16           1HG      GLU  16   0.679   3.672  -2.221
   90    HG3  GLU  16           2HG      GLU  16   1.794   4.245  -3.460
   91    H    GLU  17           H        GLU  17   3.983   2.659   1.272
   92    HA   GLU  17           HA       GLU  17   6.451   1.443   0.286
   93    HB2  GLU  17           1HB      GLU  17   5.886   3.177   2.695
   94    HB3  GLU  17           2HB      GLU  17   7.464   2.500   2.320
   95    HG2  GLU  17           1HG      GLU  17   5.907   4.446   0.634
   96    HG3  GLU  17           2HG      GLU  17   7.341   4.798   1.596
   97    H    CYS  18           H        CYS  18   3.920   0.946   2.600
   98    HA   CYS  18           HA       CYS  18   5.217  -1.556   3.428
   99    HB2  CYS  18           1HB      CYS  18   4.602  -1.239   5.722
  100    HB3  CYS  18           2HB      CYS  18   5.457   0.209   5.201
  101    H    GLY  19           H        GLY  19   2.680  -0.176   1.924
  102    HA2  GLY  19           1HA      GLY  19   0.431  -0.713   1.656
  103    HA3  GLY  19           2HA      GLY  19   1.144  -2.301   1.416
  104    H    LYS  20           H        LYS  20  -0.147  -0.131   3.900
  105    HA   LYS  20           HA       LYS  20  -0.753  -2.482   5.560
  106    HB2  LYS  20           1HB      LYS  20  -0.113   0.352   6.156
  107    HB3  LYS  20           2HB      LYS  20  -1.300  -0.419   7.200
  108    HG2  LYS  20           1HG      LYS  20   0.494  -2.314   7.344
  109    HG3  LYS  20           2HG      LYS  20   1.594  -1.026   6.847
  110    HD2  LYS  20           1HD      LYS  20   0.832   0.340   8.740
  111    HD3  LYS  20           2HD      LYS  20  -0.244  -0.966   9.241
  112    HE2  LYS  20           1HE      LYS  20   1.694  -1.139  10.589
  113    HE3  LYS  20           2HE      LYS  20   1.800  -2.433   9.397
  114    HZ1  LYS  20           3HZ      LYS  20   3.897  -1.554   9.309
  115    HZ2  LYS  20           1HZ      LYS  20   3.385   0.030   9.611
  116    HZ3  LYS  20           2HZ      LYS  20   3.149  -0.658   8.084
  117    H    ARG  21           H        ARG  21  -2.784  -1.753   7.079
  118    HA   ARG  21           HA       ARG  21  -4.939  -1.064   5.190
  119    HB2  ARG  21           1HB      ARG  21  -4.873  -3.081   7.428
  120    HB3  ARG  21           2HB      ARG  21  -6.381  -2.496   6.740
  121    HG2  ARG  21           1HG      ARG  21  -6.064  -3.588   4.757
  122    HG3  ARG  21           2HG      ARG  21  -4.306  -3.570   4.903
  123    HD2  ARG  21           1HD      ARG  21  -6.184  -5.258   6.553
  124    HD3  ARG  21           2HD      ARG  21  -5.247  -5.827   5.172
  125    HE   ARG  21           HE       ARG  21  -3.595  -4.633   7.167
  126   HH11  ARG  21          1HH1      ARG  21  -5.302  -7.545   6.315
  127   HH12  ARG  21          2HH1      ARG  21  -4.261  -8.580   7.236
  128   HH21  ARG  21          1HH2      ARG  21  -2.218  -5.984   8.383
  129   HH22  ARG  21          2HH2      ARG  21  -2.508  -7.691   8.412
  130    H    PHE  22           H        PHE  22  -6.424   0.430   5.794
  131    HA   PHE  22           HA       PHE  22  -6.604   1.308   8.551
  132    HB2  PHE  22           1HB      PHE  22  -5.887   3.315   6.410
  133    HB3  PHE  22           2HB      PHE  22  -6.040   3.606   8.140
  134    HD1  PHE  22           HD2      PHE  22  -3.942   2.180   5.502
  135    HD2  PHE  22           HD1      PHE  22  -4.286   2.993   9.666
  136    HE1  PHE  22           HE2      PHE  22  -1.539   1.736   5.785
  137    HE2  PHE  22           HE1      PHE  22  -1.883   2.551   9.955
  138    HZ   PHE  22           HZ       PHE  22  -0.506   1.920   8.013
  139    H    THR  23           H        THR  23  -8.563   2.183   9.046
  140    HA   THR  23           HA       THR  23 -10.548   2.187   6.889
  141    HB   THR  23           HB       THR  23 -11.274   2.433   9.786
  142    HG1  THR  23           HG1      THR  23 -10.007   0.646   9.905
  143   HG21  THR  23          3HG2      THR  23 -12.555   1.383   7.284
  144   HG22  THR  23          1HG2      THR  23 -13.152   2.602   8.409
  145   HG23  THR  23          2HG2      THR  23 -13.144   0.901   8.875
  146    H    GLN  24           H        GLN  24  -8.732   4.396   7.165
  147    HA   GLN  24           HA       GLN  24 -10.635   6.532   7.159
  148    HB2  GLN  24           1HB      GLN  24  -8.836   6.139   9.496
  149    HB3  GLN  24           2HB      GLN  24  -9.061   7.782   8.912
  150    HG2  GLN  24           1HG      GLN  24 -11.608   7.080   9.012
  151    HG3  GLN  24           2HG      GLN  24 -10.990   5.944  10.210
  152   HE21  GLN  24          1HE2      GLN  24 -11.789   9.195   9.516
  153   HE22  GLN  24          2HE2      GLN  24 -11.403   9.860  11.063
  154    H    ASN  25           H        ASN  25 -10.013   7.417   5.297
  155    HA   ASN  25           HA       ASN  25  -7.644   7.299   3.991
  156    HB2  ASN  25           1HB      ASN  25  -8.393   9.016   2.627
  157    HB3  ASN  25           2HB      ASN  25  -9.899   8.482   3.368
  158   HD21  ASN  25          1HD2      ASN  25  -7.808  11.071   2.834
  159   HD22  ASN  25          2HD2      ASN  25  -8.582  12.230   3.855
  160    H    SER  26           H        SER  26  -8.509   9.645   6.496
  161    HA   SER  26           HA       SER  26  -6.219  11.244   6.352
  162    HB2  SER  26           1HB      SER  26  -8.185  10.642   8.542
  163    HB3  SER  26           2HB      SER  26  -6.773  11.647   8.865
  164    HG   SER  26           HG       SER  26  -9.057  12.363   7.739
  165    H    HIS  27           H        HIS  27  -6.899   8.447   8.445
  166    HA   HIS  27           HA       HIS  27  -4.581   8.338   9.903
  167    HB2  HIS  27           1HB      HIS  27  -6.331   6.149   8.805
  168    HB3  HIS  27           2HB      HIS  27  -4.924   5.782   9.798
  169    HD1  HIS  27           HD1      HIS  27  -5.938   5.069  11.957
  170    HD2  HIS  27           HD2      HIS  27  -7.614   8.590  10.522
  171    HE1  HIS  27           HE1      HIS  27  -7.474   5.874  13.778
  172    H    LEU  28           H        LEU  28  -5.109   7.202   6.602
  173    HA   LEU  28           HA       LEU  28  -2.589   5.960   6.279
  174    HB2  LEU  28           1HB      LEU  28  -4.189   5.309   4.732
  175    HB3  LEU  28           2HB      LEU  28  -4.697   6.966   4.413
  176    HG   LEU  28           HG       LEU  28  -2.538   7.326   3.217
  177   HD11  LEU  28          1HD1      LEU  28  -1.073   5.730   4.076
  178   HD12  LEU  28          2HD1      LEU  28  -1.442   5.138   2.457
  179   HD13  LEU  28          3HD1      LEU  28  -2.228   4.415   3.860
  180   HD21  LEU  28          3HD2      LEU  28  -4.194   5.054   2.128
  181   HD22  LEU  28          1HD2      LEU  28  -3.219   6.198   1.205
  182   HD23  LEU  28          2HD2      LEU  28  -4.656   6.755   2.063
  183    H    HIS  29           H        HIS  29  -3.775   9.089   5.034
  184    HA   HIS  29           HA       HIS  29  -1.442  10.048   3.948
  185    HB2  HIS  29           1HB      HIS  29  -3.797  11.381   5.225
  186    HB3  HIS  29           2HB      HIS  29  -2.404  12.359   4.770
  187    HD1  HIS  29           HD1      HIS  29  -2.040  12.811   2.290
  188    HD2  HIS  29           HD2      HIS  29  -5.208  10.232   3.048
  189    HE1  HIS  29           HE1      HIS  29  -3.259  12.581   0.102
  190    H    SER  30           H        SER  30  -2.545  10.451   7.307
  191    HA   SER  30           HA       SER  30  -0.176  11.805   8.136
  192    HB2  SER  30           1HB      SER  30  -1.070  11.600  10.388
  193    HB3  SER  30           2HB      SER  30  -2.369  12.053   9.284
  194    HG   SER  30           HG       SER  30  -2.252   9.405   9.365
  195    H    HIS  31           H        HIS  31  -0.959   8.534   7.604
  196    HA   HIS  31           HA       HIS  31   1.007   7.470   9.445
  197    HB2  HIS  31           1HB      HIS  31  -0.699   5.942   9.260
  198    HB3  HIS  31           2HB      HIS  31  -1.005   6.326   7.569
  199    HD1  HIS  31           HD1      HIS  31   0.893   4.034   9.763
  200    HD2  HIS  31           HD2      HIS  31   0.710   4.989   5.724
  201    HE1  HIS  31           HE1      HIS  31   2.117   2.184   8.579
  202    H    GLN  32           H        GLN  32   0.852   8.494   6.159
  203    HA   GLN  32           HA       GLN  32   2.943   6.972   5.060
  204    HB2  GLN  32           1HB      GLN  32   1.723   9.627   4.376
  205    HB3  GLN  32           2HB      GLN  32   3.140   9.052   3.509
  206    HG2  GLN  32           1HG      GLN  32   1.961   7.112   2.745
  207    HG3  GLN  32           2HG      GLN  32   0.568   7.512   3.748
  208   HE21  GLN  32          1HE2      GLN  32  -0.411   7.227   1.537
  209   HE22  GLN  32          2HE2      GLN  32  -0.544   8.643   0.556
  210    H    ARG  33           H        ARG  33   2.937   9.747   7.144
  211    HA   ARG  33           HA       ARG  33   5.569  10.651   6.649
  212    HB2  ARG  33           1HB      ARG  33   3.817  10.916   9.097
  213    HB3  ARG  33           2HB      ARG  33   5.346  11.758   8.879
  214    HG2  ARG  33           1HG      ARG  33   4.314  12.698   6.737
  215    HG3  ARG  33           2HG      ARG  33   2.775  12.129   7.387
  216    HD2  ARG  33           1HD      ARG  33   3.309  13.431   9.477
  217    HD3  ARG  33           2HD      ARG  33   4.661  14.141   8.595
  218    HE   ARG  33           HE       ARG  33   2.520  14.592   6.983
  219   HH11  ARG  33          1HH1      ARG  33   3.236  15.268  10.322
  220   HH12  ARG  33          2HH1      ARG  33   2.258  16.698  10.378
  221   HH21  ARG  33          1HH2      ARG  33   1.229  16.472   7.044
  222   HH22  ARG  33          2HH2      ARG  33   1.116  17.381   8.513
  223    H    VAL  34           H        VAL  34   4.334   7.937   8.334
  224    HA   VAL  34           HA       VAL  34   6.261   7.493  10.289
  225    HB   VAL  34           HB       VAL  34   4.092   6.161   9.721
  226   HG11  VAL  34          1HG1      VAL  34   4.988   5.483   7.470
  227   HG12  VAL  34          2HG1      VAL  34   6.107   4.416   8.321
  228   HG13  VAL  34          3HG1      VAL  34   4.366   4.166   8.463
  229   HG21  VAL  34          3HG2      VAL  34   4.933   5.392  11.662
  230   HG22  VAL  34          1HG2      VAL  34   5.483   4.037  10.676
  231   HG23  VAL  34          2HG2      VAL  34   6.587   5.360  11.052
  232    H    HIS  35           H        HIS  35   6.509   7.296   6.863
  233    HA   HIS  35           HA       HIS  35   9.091   5.902   7.076
  234    HB2  HIS  35           1HB      HIS  35   7.654   6.411   4.487
  235    HB3  HIS  35           2HB      HIS  35   8.838   5.164   4.866
  236    HD1  HIS  35           HD1      HIS  35   7.937   3.218   6.509
  237    HD2  HIS  35           HD2      HIS  35   5.056   5.629   4.736
  238    HE1  HIS  35           HE1      HIS  35   5.773   1.958   6.737
  239    H    THR  36           H        THR  36   8.376   8.826   7.518
  240    HA   THR  36           HA       THR  36   9.373  10.415   5.452
  241    HB   THR  36           HB       THR  36   8.185  11.399   7.329
  242    HG1  THR  36           HG1      THR  36  10.177  12.447   6.177
  243   HG21  THR  36          3HG2      THR  36   8.663  10.964   9.464
  244   HG22  THR  36          1HG2      THR  36  10.340  11.462   9.251
  245   HG23  THR  36          2HG2      THR  36   9.861   9.804   8.892
  246    H    GLY  37           H        GLY  37  11.405  11.387   5.106
  247    HA2  GLY  37           1HA      GLY  37  13.695  10.515   6.647
  248    HA3  GLY  37           2HA      GLY  37  13.622   9.855   5.020
  249    H    GLU  38           H        GLU  38  12.696  11.951   3.548
  250    HA   GLU  38           HA       GLU  38  15.033  13.629   3.444
  251    HB2  GLU  38           1HB      GLU  38  13.650  12.666   1.468
  252    HB3  GLU  38           2HB      GLU  38  12.579  14.030   1.760
  253    HG2  GLU  38           1HG      GLU  38  14.768  15.428   1.617
  254    HG3  GLU  38           2HG      GLU  38  15.393  14.009   0.778
  255    H    LYS  39           H        LYS  39  15.228  15.723   4.021
  256    HA   LYS  39           HA       LYS  39  13.027  16.889   5.544
  257    HB2  LYS  39           1HB      LYS  39  14.685  18.457   6.394
  258    HB3  LYS  39           2HB      LYS  39  15.261  16.805   6.575
  259    HG2  LYS  39           1HG      LYS  39  17.147  17.773   5.767
  260    HG3  LYS  39           2HG      LYS  39  16.386  17.319   4.241
  261    HD2  LYS  39           1HD      LYS  39  15.302  19.676   4.379
  262    HD3  LYS  39           2HD      LYS  39  16.604  20.016   5.522
  263    HE2  LYS  39           1HE      LYS  39  17.204  18.795   2.856
  264    HE3  LYS  39           2HE      LYS  39  16.947  20.533   3.002
  265    HZ1  LYS  39           3HZ      LYS  39  18.871  20.817   4.127
  266    HZ2  LYS  39           1HZ      LYS  39  19.317  19.421   3.282
  267    HZ3  LYS  39           2HZ      LYS  39  18.802  19.308   4.889
  268    HA   PRO  40           HA       PRO  40  11.883  19.806   2.465
  269    HB2  PRO  40           1HB      PRO  40  11.024  21.855   4.025
  270    HB3  PRO  40           2HB      PRO  40  10.115  20.352   3.827
  271    HG2  PRO  40           1HG      PRO  40  11.925  21.190   6.059
  272    HG3  PRO  40           2HG      PRO  40  10.349  20.382   6.141
  273    HD2  PRO  40           1HD      PRO  40  12.687  19.044   6.410
  274    HD3  PRO  40           2HD      PRO  40  11.246  18.310   5.678
  275    H    SER  41           H        SER  41  13.178  20.999   1.230
  276    HA   SER  41           HA       SER  41  15.558  22.200   2.189
  277    HB2  SER  41           1HB      SER  41  15.928  22.908  -0.063
  278    HB3  SER  41           2HB      SER  41  15.144  21.332  -0.158
  279    HG   SER  41           HG       SER  41  14.051  22.607  -1.564
  280    H    GLY  42           H        GLY  42  16.136  24.453   2.126
  281    HA2  GLY  42           1HA      GLY  42  14.355  26.122   3.485
  282    HA3  GLY  42           2HA      GLY  42  15.815  26.660   2.667
  283    HA   PRO  43           HA       PRO  43  11.715  27.784   0.389
  284    HB2  PRO  43           1HB      PRO  43  11.042  30.120   1.598
  285    HB3  PRO  43           2HB      PRO  43  10.413  28.552   2.120
  286    HG2  PRO  43           1HG      PRO  43  12.659  30.169   3.264
  287    HG3  PRO  43           2HG      PRO  43  11.373  29.286   4.107
  288    HD2  PRO  43           1HD      PRO  43  13.878  28.298   3.831
  289    HD3  PRO  43           2HD      PRO  43  12.441  27.257   3.877
  290    H    SER  44           H        SER  44  12.923  28.271  -1.402
  291    HA   SER  44           HA       SER  44  14.056  30.985  -1.498
  292    HB2  SER  44           1HB      SER  44  15.279  28.428  -2.538
  293    HB3  SER  44           2HB      SER  44  15.789  30.019  -3.100
  294    HG   SER  44           HG       SER  44  16.151  30.494  -0.806
  295    H    SER  45           H        SER  45  12.169  31.736  -2.500
  296    HA   SER  45           HA       SER  45  11.201  30.514  -4.921
  297    HB2  SER  45           1HB      SER  45   9.587  31.590  -3.487
  298    HB3  SER  45           2HB      SER  45  10.487  33.105  -3.530
  299    HG   SER  45           HG       SER  45   9.069  33.473  -5.078
  300    H    GLY  46           H        GLY  46  11.400  31.265  -7.010
  301    HA2  GLY  46           1HA      GLY  46  13.568  33.223  -7.416
  302    HA3  GLY  46           2HA      GLY  46  13.149  31.939  -8.540
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1  -9.517 -10.357   5.458
    2    HA2  GLY   1           1HA      GLY   1  -9.264 -13.237   4.940
    3    HA3  GLY   1           2HA      GLY   1  -8.160 -12.486   6.083
    4    H    SER   2           H        SER   2  -8.813 -13.483   7.930
    5    HA   SER   2           HA       SER   2 -11.500 -12.782   8.879
    6    HB2  SER   2           1HB      SER   2 -11.827 -15.008   9.816
    7    HB3  SER   2           2HB      SER   2 -11.544 -15.131   8.080
    8    HG   SER   2           HG       SER   2  -9.304 -15.273   9.713
    9    H    SER   3           H        SER   3 -11.048 -11.406  10.480
   10    HA   SER   3           HA       SER   3  -9.624 -12.355  12.793
   11    HB2  SER   3           1HB      SER   3  -7.685 -11.589  11.642
   12    HB3  SER   3           2HB      SER   3  -8.498 -10.120  11.103
   13    HG   SER   3           HG       SER   3  -7.654 -10.795  13.719
   14    H    GLY   4           H        GLY   4 -10.743 -11.680  14.493
   15    HA2  GLY   4           1HA      GLY   4 -12.762  -9.657  14.226
   16    HA3  GLY   4           2HA      GLY   4 -12.364 -10.549  15.688
   17    H    SER   5           H        SER   5 -11.009  -8.022  13.574
   18    HA   SER   5           HA       SER   5 -10.548  -6.328  15.873
   19    HB2  SER   5           1HB      SER   5  -8.162  -6.067  15.534
   20    HB3  SER   5           2HB      SER   5  -8.517  -7.777  15.775
   21    HG   SER   5           HG       SER   5  -7.445  -6.517  13.617
   22    H    SER   6           H        SER   6  -9.523  -4.204  15.147
   23    HA   SER   6           HA       SER   6 -11.076  -2.831  13.435
   24    HB2  SER   6           1HB      SER   6  -8.241  -2.485  14.276
   25    HB3  SER   6           2HB      SER   6  -8.818  -1.483  12.944
   26    HG   SER   6           HG       SER   6  -9.830  -0.316  14.353
   27    H    GLY   7           H        GLY   7 -11.718  -3.663  11.518
   28    HA2  GLY   7           1HA      GLY   7 -11.116  -3.403   9.132
   29    HA3  GLY   7           2HA      GLY   7  -9.595  -4.189   9.528
   30    H    SER   8           H        SER   8 -13.104  -4.715   9.495
   31    HA   SER   8           HA       SER   8 -12.829  -7.572   9.628
   32    HB2  SER   8           1HB      SER   8 -15.273  -7.597   9.301
   33    HB3  SER   8           2HB      SER   8 -14.806  -6.461  10.566
   34    HG   SER   8           HG       SER   8 -15.840  -5.977   8.021
   35    H    GLY   9           H        GLY   9 -11.471  -8.034   7.844
   36    HA2  GLY   9           1HA      GLY   9 -11.836  -9.225   5.731
   37    HA3  GLY   9           2HA      GLY   9 -12.877  -7.894   5.249
   38    H    GLU  10           H        GLU  10 -12.003  -6.097   4.322
   39    HA   GLU  10           HA       GLU  10  -9.101  -5.789   4.289
   40    HB2  GLU  10           1HB      GLU  10  -9.036  -5.581   1.846
   41    HB3  GLU  10           2HB      GLU  10  -9.567  -7.182   2.340
   42    HG2  GLU  10           1HG      GLU  10 -11.850  -6.642   1.838
   43    HG3  GLU  10           2HG      GLU  10 -11.420  -4.966   1.502
   44    H    LYS  11           H        LYS  11  -8.403  -3.699   3.516
   45    HA   LYS  11           HA       LYS  11 -10.522  -1.659   3.710
   46    HB2  LYS  11           1HB      LYS  11  -7.695  -1.664   4.747
   47    HB3  LYS  11           2HB      LYS  11  -8.594  -0.168   4.523
   48    HG2  LYS  11           1HG      LYS  11  -9.421  -2.465   6.287
   49    HG3  LYS  11           2HG      LYS  11  -8.697  -0.950   6.830
   50    HD2  LYS  11           1HD      LYS  11 -10.633   0.250   5.796
   51    HD3  LYS  11           2HD      LYS  11 -11.373  -1.323   5.490
   52    HE2  LYS  11           1HE      LYS  11 -11.172  -1.777   7.955
   53    HE3  LYS  11           2HE      LYS  11 -10.695  -0.091   8.155
   54    HZ1  LYS  11           3HZ      LYS  11 -13.273  -1.059   7.041
   55    HZ2  LYS  11           1HZ      LYS  11 -12.815   0.566   7.160
   56    HZ3  LYS  11           2HZ      LYS  11 -13.043  -0.353   8.561
   57    HA   PRO  12           HA       PRO  12  -9.363  -0.303  -0.314
   58    HB2  PRO  12           1HB      PRO  12 -10.275   2.251  -0.189
   59    HB3  PRO  12           2HB      PRO  12 -11.348   0.854  -0.333
   60    HG2  PRO  12           1HG      PRO  12 -10.604   2.428   2.102
   61    HG3  PRO  12           2HG      PRO  12 -12.193   1.817   1.608
   62    HD2  PRO  12           1HD      PRO  12 -10.669   0.575   3.470
   63    HD3  PRO  12           2HD      PRO  12 -11.754  -0.311   2.379
   64    H    PHE  13           H        PHE  13  -8.658   1.988   2.325
   65    HA   PHE  13           HA       PHE  13  -6.497   3.204   0.869
   66    HB2  PHE  13           1HB      PHE  13  -7.135   3.500   3.807
   67    HB3  PHE  13           2HB      PHE  13  -6.204   4.604   2.800
   68    HD1  PHE  13           HD1      PHE  13  -7.317   6.052   1.185
   69    HD2  PHE  13           HD2      PHE  13  -9.530   3.491   3.766
   70    HE1  PHE  13           HE1      PHE  13  -9.364   7.320   0.682
   71    HE2  PHE  13           HE2      PHE  13 -11.581   4.755   3.266
   72    HZ   PHE  13           HZ       PHE  13 -11.500   6.672   1.722
   73    H    GLN  14           H        GLN  14  -4.576   2.287   0.640
   74    HA   GLN  14           HA       GLN  14  -3.385   0.897   2.928
   75    HB2  GLN  14           1HB      GLN  14  -3.417  -0.186   0.106
   76    HB3  GLN  14           2HB      GLN  14  -2.553  -0.895   1.464
   77    HG2  GLN  14           1HG      GLN  14  -4.894  -0.979   2.577
   78    HG3  GLN  14           2HG      GLN  14  -5.486  -0.811   0.925
   79   HE21  GLN  14          1HE2      GLN  14  -2.876  -2.623   2.514
   80   HE22  GLN  14          2HE2      GLN  14  -3.287  -4.152   1.822
   81    H    CYS  15           H        CYS  15  -1.235   1.242   3.194
   82    HA   CYS  15           HA       CYS  15  -0.011   3.445   2.024
   83    HB2  CYS  15           1HB      CYS  15   0.571   2.003   4.169
   84    HB3  CYS  15           2HB      CYS  15   1.692   1.222   3.060
   85    H    GLU  16           H        GLU  16   2.282   3.212   0.969
   86    HA   GLU  16           HA       GLU  16   2.028   1.337  -1.291
   87    HB2  GLU  16           1HB      GLU  16   2.749   4.227  -1.190
   88    HB3  GLU  16           2HB      GLU  16   3.548   3.221  -2.390
   89    HG2  GLU  16           1HG      GLU  16   1.510   4.394  -3.202
   90    HG3  GLU  16           2HG      GLU  16   1.481   2.643  -3.405
   91    H    GLU  17           H        GLU  17   3.997   2.535   1.249
   92    HA   GLU  17           HA       GLU  17   6.397   1.260   0.155
   93    HB2  GLU  17           1HB      GLU  17   5.984   3.090   2.521
   94    HB3  GLU  17           2HB      GLU  17   7.520   2.321   2.148
   95    HG2  GLU  17           1HG      GLU  17   7.361   3.430  -0.123
   96    HG3  GLU  17           2HG      GLU  17   6.040   4.383   0.550
   97    H    CYS  18           H        CYS  18   3.940   0.862   2.550
   98    HA   CYS  18           HA       CYS  18   5.235  -1.628   3.422
   99    HB2  CYS  18           1HB      CYS  18   4.604  -1.249   5.715
  100    HB3  CYS  18           2HB      CYS  18   5.510   0.153   5.154
  101    H    GLY  19           H        GLY  19   2.675  -0.265   1.924
  102    HA2  GLY  19           1HA      GLY  19   0.435  -0.820   1.661
  103    HA3  GLY  19           2HA      GLY  19   1.137  -2.422   1.498
  104    H    LYS  20           H        LYS  20  -0.256  -0.141   3.801
  105    HA   LYS  20           HA       LYS  20  -0.822  -2.394   5.609
  106    HB2  LYS  20           1HB      LYS  20  -0.227   0.480   6.048
  107    HB3  LYS  20           2HB      LYS  20  -1.406  -0.255   7.127
  108    HG2  LYS  20           1HG      LYS  20   0.471  -2.113   7.311
  109    HG3  LYS  20           2HG      LYS  20   1.504  -0.753   6.867
  110    HD2  LYS  20           1HD      LYS  20   1.487  -0.653   9.187
  111    HD3  LYS  20           2HD      LYS  20   0.237   0.510   8.738
  112    HE2  LYS  20           1HE      LYS  20  -0.769  -0.720  10.432
  113    HE3  LYS  20           2HE      LYS  20  -1.384  -1.481   8.966
  114    HZ1  LYS  20           3HZ      LYS  20  -0.717  -3.339  10.014
  115    HZ2  LYS  20           1HZ      LYS  20   0.410  -2.538  10.989
  116    HZ3  LYS  20           2HZ      LYS  20   0.802  -2.930   9.391
  117    H    ARG  21           H        ARG  21  -2.873  -1.545   7.073
  118    HA   ARG  21           HA       ARG  21  -5.009  -0.922   5.141
  119    HB2  ARG  21           1HB      ARG  21  -5.074  -2.924   7.405
  120    HB3  ARG  21           2HB      ARG  21  -6.481  -2.435   6.471
  121    HG2  ARG  21           1HG      ARG  21  -5.764  -3.528   4.567
  122    HG3  ARG  21           2HG      ARG  21  -4.077  -3.534   5.084
  123    HD2  ARG  21           1HD      ARG  21  -6.078  -5.014   6.717
  124    HD3  ARG  21           2HD      ARG  21  -5.556  -5.715   5.185
  125    HE   ARG  21           HE       ARG  21  -4.018  -5.489   7.603
  126   HH11  ARG  21          1HH1      ARG  21  -3.880  -5.790   4.137
  127   HH12  ARG  21          2HH1      ARG  21  -2.295  -6.491   4.131
  128   HH21  ARG  21          1HH2      ARG  21  -1.931  -6.411   7.607
  129   HH22  ARG  21          2HH2      ARG  21  -1.188  -6.844   6.105
  130    H    PHE  22           H        PHE  22  -6.471   0.583   5.737
  131    HA   PHE  22           HA       PHE  22  -6.527   1.469   8.532
  132    HB2  PHE  22           1HB      PHE  22  -6.247   3.321   6.155
  133    HB3  PHE  22           2HB      PHE  22  -6.473   3.827   7.826
  134    HD1  PHE  22           HD2      PHE  22  -4.142   2.235   5.465
  135    HD2  PHE  22           HD1      PHE  22  -4.663   3.873   9.359
  136    HE1  PHE  22           HE2      PHE  22  -1.704   2.217   5.795
  137    HE2  PHE  22           HE1      PHE  22  -2.225   3.859   9.694
  138    HZ   PHE  22           HZ       PHE  22  -0.742   3.029   7.912
  139    H    THR  23           H        THR  23  -8.431   2.724   9.082
  140    HA   THR  23           HA       THR  23 -10.753   1.818   7.561
  141    HB   THR  23           HB       THR  23 -10.881   1.361   9.915
  142    HG1  THR  23           HG1      THR  23 -12.861   1.974   9.069
  143   HG21  THR  23          3HG2      THR  23  -9.630   3.929  10.153
  144   HG22  THR  23          1HG2      THR  23  -9.852   2.685  11.383
  145   HG23  THR  23          2HG2      THR  23 -11.104   3.899  11.120
  146    H    GLN  24           H        GLN  24  -8.821   4.533   7.765
  147    HA   GLN  24           HA       GLN  24 -10.800   6.123   6.350
  148    HB2  GLN  24           1HB      GLN  24 -10.802   6.577   8.935
  149    HB3  GLN  24           2HB      GLN  24  -9.338   7.484   8.579
  150    HG2  GLN  24           1HG      GLN  24 -10.471   9.030   7.257
  151    HG3  GLN  24           2HG      GLN  24 -11.872   7.976   7.064
  152   HE21  GLN  24          1HE2      GLN  24 -12.840  10.136   7.694
  153   HE22  GLN  24          2HE2      GLN  24 -13.119  10.390   9.380
  154    H    ASN  25           H        ASN  25  -9.911   7.709   5.015
  155    HA   ASN  25           HA       ASN  25  -7.370   7.183   3.968
  156    HB2  ASN  25           1HB      ASN  25  -7.805   8.859   2.436
  157    HB3  ASN  25           2HB      ASN  25  -9.437   8.471   2.972
  158   HD21  ASN  25          1HD2      ASN  25 -10.301   9.809   4.744
  159   HD22  ASN  25          2HD2      ASN  25  -9.884  11.486   4.773
  160    H    SER  26           H        SER  26  -8.470   9.806   6.099
  161    HA   SER  26           HA       SER  26  -6.150  11.272   6.300
  162    HB2  SER  26           1HB      SER  26  -8.277  10.686   8.360
  163    HB3  SER  26           2HB      SER  26  -6.959  11.820   8.656
  164    HG   SER  26           HG       SER  26  -8.017  13.234   7.537
  165    H    HIS  27           H        HIS  27  -7.084   8.424   8.203
  166    HA   HIS  27           HA       HIS  27  -4.957   8.310   9.959
  167    HB2  HIS  27           1HB      HIS  27  -6.694   6.214   8.707
  168    HB3  HIS  27           2HB      HIS  27  -5.329   5.725   9.707
  169    HD1  HIS  27           HD1      HIS  27  -8.744   6.039  10.061
  170    HD2  HIS  27           HD2      HIS  27  -5.562   7.533  12.276
  171    HE1  HIS  27           HE1      HIS  27  -9.689   6.549  12.335
  172    H    LEU  28           H        LEU  28  -5.076   7.446   6.573
  173    HA   LEU  28           HA       LEU  28  -2.500   6.152   6.591
  174    HB2  LEU  28           1HB      LEU  28  -4.001   5.323   4.990
  175    HB3  LEU  28           2HB      LEU  28  -4.442   6.940   4.444
  176    HG   LEU  28           HG       LEU  28  -2.064   7.121   3.556
  177   HD11  LEU  28          1HD1      LEU  28  -1.206   4.742   2.964
  178   HD12  LEU  28          2HD1      LEU  28  -2.147   4.248   4.371
  179   HD13  LEU  28          3HD1      LEU  28  -0.850   5.430   4.549
  180   HD21  LEU  28          3HD2      LEU  28  -3.047   6.734   1.604
  181   HD22  LEU  28          1HD2      LEU  28  -4.411   6.028   2.470
  182   HD23  LEU  28          2HD2      LEU  28  -3.088   4.999   1.921
  183    H    HIS  29           H        HIS  29  -3.791   9.165   5.191
  184    HA   HIS  29           HA       HIS  29  -1.559  10.241   4.073
  185    HB2  HIS  29           1HB      HIS  29  -3.909  11.431   5.464
  186    HB3  HIS  29           2HB      HIS  29  -2.556  12.495   5.091
  187    HD1  HIS  29           HD1      HIS  29  -3.823  13.812   3.305
  188    HD2  HIS  29           HD2      HIS  29  -3.647   9.731   2.546
  189    HE1  HIS  29           HE1      HIS  29  -4.618  13.534   0.935
  190    H    SER  30           H        SER  30  -2.444  10.397   7.507
  191    HA   SER  30           HA       SER  30  -0.092  11.848   8.249
  192    HB2  SER  30           1HB      SER  30  -0.826  11.441  10.558
  193    HB3  SER  30           2HB      SER  30  -2.170  11.999   9.562
  194    HG   SER  30           HG       SER  30  -3.125  10.274  10.286
  195    H    HIS  31           H        HIS  31  -1.013   8.472   8.107
  196    HA   HIS  31           HA       HIS  31   1.128   7.431   9.633
  197    HB2  HIS  31           1HB      HIS  31  -0.526   5.857   9.367
  198    HB3  HIS  31           2HB      HIS  31  -0.849   6.320   7.699
  199    HD1  HIS  31           HD1      HIS  31   1.360   4.136   9.781
  200    HD2  HIS  31           HD2      HIS  31   0.684   4.994   5.772
  201    HE1  HIS  31           HE1      HIS  31   2.590   2.359   8.496
  202    H    GLN  32           H        GLN  32   0.917   8.634   6.411
  203    HA   GLN  32           HA       GLN  32   3.053   7.254   5.217
  204    HB2  GLN  32           1HB      GLN  32   1.684   9.863   4.691
  205    HB3  GLN  32           2HB      GLN  32   3.166   9.480   3.826
  206    HG2  GLN  32           1HG      GLN  32   2.202   7.798   2.626
  207    HG3  GLN  32           2HG      GLN  32   1.004   7.447   3.871
  208   HE21  GLN  32          1HE2      GLN  32  -0.226   7.420   1.721
  209   HE22  GLN  32          2HE2      GLN  32  -0.998   8.902   1.281
  210    H    ARG  33           H        ARG  33   3.043   9.501   7.734
  211    HA   ARG  33           HA       ARG  33   5.507  10.821   7.244
  212    HB2  ARG  33           1HB      ARG  33   3.678  10.499   9.570
  213    HB3  ARG  33           2HB      ARG  33   5.327  11.015   9.897
  214    HG2  ARG  33           1HG      ARG  33   3.774  12.900   9.667
  215    HG3  ARG  33           2HG      ARG  33   5.056  12.931   8.454
  216    HD2  ARG  33           1HD      ARG  33   3.530  11.974   6.807
  217    HD3  ARG  33           2HD      ARG  33   2.252  11.907   8.020
  218    HE   ARG  33           HE       ARG  33   3.047  14.179   6.496
  219   HH11  ARG  33          1HH1      ARG  33   1.786  13.189   9.587
  220   HH12  ARG  33          2HH1      ARG  33   0.990  14.697   9.891
  221   HH21  ARG  33          1HH2      ARG  33   2.003  16.169   6.886
  222   HH22  ARG  33          2HH2      ARG  33   1.113  16.391   8.354
  223    H    VAL  34           H        VAL  34   4.645   7.761   8.671
  224    HA   VAL  34           HA       VAL  34   6.939   7.186  10.136
  225    HB   VAL  34           HB       VAL  34   6.384   4.844   9.896
  226   HG11  VAL  34          1HG1      VAL  34   3.955   4.934  10.522
  227   HG12  VAL  34          2HG1      VAL  34   5.003   6.019  11.439
  228   HG13  VAL  34          3HG1      VAL  34   3.991   6.656  10.142
  229   HG21  VAL  34          3HG2      VAL  34   5.175   5.769   7.407
  230   HG22  VAL  34          1HG2      VAL  34   5.773   4.171   7.852
  231   HG23  VAL  34          2HG2      VAL  34   4.145   4.665   8.317
  232    H    HIS  35           H        HIS  35   6.484   7.386   6.728
  233    HA   HIS  35           HA       HIS  35   9.135   6.182   6.279
  234    HB2  HIS  35           1HB      HIS  35   7.054   6.626   4.145
  235    HB3  HIS  35           2HB      HIS  35   8.464   5.572   4.091
  236    HD1  HIS  35           HD1      HIS  35   8.322   3.411   5.697
  237    HD2  HIS  35           HD2      HIS  35   4.756   5.420   4.983
  238    HE1  HIS  35           HE1      HIS  35   6.503   1.802   6.347
  239    H    THR  36           H        THR  36   8.042   9.045   6.913
  240    HA   THR  36           HA       THR  36   8.616  10.706   4.730
  241    HB   THR  36           HB       THR  36   7.432  11.469   6.770
  242    HG1  THR  36           HG1      THR  36   8.133  13.175   5.625
  243   HG21  THR  36          3HG2      THR  36   8.348  11.488   8.822
  244   HG22  THR  36          1HG2      THR  36   9.897  12.086   8.229
  245   HG23  THR  36          2HG2      THR  36   9.525  10.364   8.144
  246    H    GLY  37           H        GLY  37  10.689   8.744   6.484
  247    HA2  GLY  37           1HA      GLY  37  12.966   8.527   5.677
  248    HA3  GLY  37           2HA      GLY  37  13.011  10.274   5.498
  249    H    GLU  38           H        GLU  38  13.095   7.616   7.782
  250    HA   GLU  38           HA       GLU  38  13.357   9.141  10.137
  251    HB2  GLU  38           1HB      GLU  38  12.790   6.777  10.209
  252    HB3  GLU  38           2HB      GLU  38  14.342   6.356   9.499
  253    HG2  GLU  38           1HG      GLU  38  15.515   6.955  11.444
  254    HG3  GLU  38           2HG      GLU  38  14.124   7.803  12.116
  255    H    LYS  39           H        LYS  39  15.087  10.000  11.175
  256    HA   LYS  39           HA       LYS  39  17.788   9.450  10.329
  257    HB2  LYS  39           1HB      LYS  39  18.314  11.810   9.789
  258    HB3  LYS  39           2HB      LYS  39  17.189  11.085   8.648
  259    HG2  LYS  39           1HG      LYS  39  16.154  13.076   8.968
  260    HG3  LYS  39           2HG      LYS  39  15.406  12.160  10.279
  261    HD2  LYS  39           1HD      LYS  39  17.415  13.033  11.681
  262    HD3  LYS  39           2HD      LYS  39  17.552  14.244  10.404
  263    HE2  LYS  39           1HE      LYS  39  16.199  15.113  12.206
  264    HE3  LYS  39           2HE      LYS  39  15.193  14.861  10.781
  265    HZ1  LYS  39           3HZ      LYS  39  15.266  12.565  12.483
  266    HZ2  LYS  39           1HZ      LYS  39  13.934  13.406  11.866
  267    HZ3  LYS  39           2HZ      LYS  39  14.681  13.931  13.290
  268    HA   PRO  40           HA       PRO  40  18.389  10.327  14.610
  269    HB2  PRO  40           1HB      PRO  40  21.099  10.483  14.598
  270    HB3  PRO  40           2HB      PRO  40  20.225   8.952  14.471
  271    HG2  PRO  40           1HG      PRO  40  21.466  10.609  12.309
  272    HG3  PRO  40           2HG      PRO  40  21.503   8.851  12.531
  273    HD2  PRO  40           1HD      PRO  40  19.829  10.063  10.782
  274    HD3  PRO  40           2HD      PRO  40  19.399   8.566  11.635
  275    H    SER  41           H        SER  41  20.463  12.217  12.400
  276    HA   SER  41           HA       SER  41  20.984  14.359  14.070
  277    HB2  SER  41           1HB      SER  41  21.511  15.630  12.070
  278    HB3  SER  41           2HB      SER  41  22.059  13.968  11.856
  279    HG   SER  41           HG       SER  41  20.688  15.172  10.148
  280    H    GLY  42           H        GLY  42  19.434  15.346  15.226
  281    HA2  GLY  42           1HA      GLY  42  17.649  17.147  13.991
  282    HA3  GLY  42           2HA      GLY  42  16.765  15.704  14.467
  283    HA   PRO  43           HA       PRO  43  18.467  17.558  18.588
  284    HB2  PRO  43           1HB      PRO  43  19.762  19.939  18.431
  285    HB3  PRO  43           2HB      PRO  43  20.592  18.384  18.301
  286    HG2  PRO  43           1HG      PRO  43  19.715  20.250  16.131
  287    HG3  PRO  43           2HG      PRO  43  21.239  19.358  16.291
  288    HD2  PRO  43           1HD      PRO  43  19.227  18.528  14.680
  289    HD3  PRO  43           2HD      PRO  43  20.319  17.396  15.504
  290    H    SER  44           H        SER  44  17.060  19.434  16.058
  291    HA   SER  44           HA       SER  44  16.085  21.699  17.067
  292    HB2  SER  44           1HB      SER  44  14.297  19.661  15.720
  293    HB3  SER  44           2HB      SER  44  14.059  21.408  15.757
  294    HG   SER  44           HG       SER  44  16.482  20.992  14.818
  295    H    SER  45           H        SER  45  15.267  22.268  18.959
  296    HA   SER  45           HA       SER  45  14.203  20.381  20.808
  297    HB2  SER  45           1HB      SER  45  15.375  22.289  21.679
  298    HB3  SER  45           2HB      SER  45  14.304  23.404  20.831
  299    HG   SER  45           HG       SER  45  13.088  23.334  22.529
  300    H    GLY  46           H        GLY  46  12.709  23.178  19.162
  301    HA2  GLY  46           1HA      GLY  46  10.407  21.962  18.286
  302    HA3  GLY  46           2HA      GLY  46  10.064  22.416  19.949
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1  -0.227 -26.796   3.976
    2    HA2  GLY   1           1HA      GLY   1  -1.285 -24.579   5.003
    3    HA3  GLY   1           2HA      GLY   1  -0.132 -23.886   3.872
    4    H    SER   2           H        SER   2  -3.235 -25.187   4.269
    5    HA   SER   2           HA       SER   2  -3.609 -25.628   1.402
    6    HB2  SER   2           1HB      SER   2  -4.487 -27.252   3.157
    7    HB3  SER   2           2HB      SER   2  -5.672 -26.014   3.574
    8    HG   SER   2           HG       SER   2  -6.018 -27.781   1.786
    9    H    SER   3           H        SER   3  -5.399 -24.640   0.283
   10    HA   SER   3           HA       SER   3  -6.377 -22.143   1.479
   11    HB2  SER   3           1HB      SER   3  -4.355 -21.830  -0.093
   12    HB3  SER   3           2HB      SER   3  -5.475 -22.238  -1.393
   13    HG   SER   3           HG       SER   3  -5.311 -19.955   0.160
   14    H    GLY   4           H        GLY   4  -8.443 -21.580   0.941
   15    HA2  GLY   4           1HA      GLY   4  -9.817 -22.795  -1.281
   16    HA3  GLY   4           2HA      GLY   4 -10.321 -23.432   0.278
   17    H    SER   5           H        SER   5 -10.132 -21.067   1.792
   18    HA   SER   5           HA       SER   5 -12.652 -19.937   1.331
   19    HB2  SER   5           1HB      SER   5 -10.346 -19.318   3.109
   20    HB3  SER   5           2HB      SER   5 -11.556 -18.054   2.883
   21    HG   SER   5           HG       SER   5 -12.484 -20.624   3.413
   22    H    SER   6           H        SER   6 -13.352 -18.191   0.230
   23    HA   SER   6           HA       SER   6 -11.330 -16.571  -1.175
   24    HB2  SER   6           1HB      SER   6 -12.657 -18.208  -2.616
   25    HB3  SER   6           2HB      SER   6 -14.067 -17.201  -2.283
   26    HG   SER   6           HG       SER   6 -12.417 -16.829  -4.199
   27    H    GLY   7           H        GLY   7 -12.265 -15.816   1.310
   28    HA2  GLY   7           1HA      GLY   7 -13.827 -13.425   0.596
   29    HA3  GLY   7           2HA      GLY   7 -14.311 -14.398   1.977
   30    H    SER   8           H        SER   8 -11.758 -12.354   0.671
   31    HA   SER   8           HA       SER   8 -10.799 -11.920   3.425
   32    HB2  SER   8           1HB      SER   8  -9.239 -11.697   0.839
   33    HB3  SER   8           2HB      SER   8  -8.604 -11.357   2.449
   34    HG   SER   8           HG       SER   8  -8.045 -13.416   2.172
   35    H    GLY   9           H        GLY   9 -11.210  -9.974   4.222
   36    HA2  GLY   9           1HA      GLY   9 -12.428  -7.910   2.754
   37    HA3  GLY   9           2HA      GLY   9 -11.727  -7.742   4.357
   38    H    GLU  10           H        GLU  10 -11.700  -6.033   1.858
   39    HA   GLU  10           HA       GLU  10  -8.808  -5.534   1.887
   40    HB2  GLU  10           1HB      GLU  10 -10.549  -6.039  -0.475
   41    HB3  GLU  10           2HB      GLU  10  -9.303  -4.809  -0.629
   42    HG2  GLU  10           1HG      GLU  10  -7.577  -6.347  -0.287
   43    HG3  GLU  10           2HG      GLU  10  -8.672  -7.561   0.370
   44    H    LYS  11           H        LYS  11  -8.355  -3.501   2.395
   45    HA   LYS  11           HA       LYS  11 -10.507  -1.527   2.378
   46    HB2  LYS  11           1HB      LYS  11  -7.736  -1.411   3.585
   47    HB3  LYS  11           2HB      LYS  11  -8.972  -0.171   3.759
   48    HG2  LYS  11           1HG      LYS  11 -10.424  -1.990   4.788
   49    HG3  LYS  11           2HG      LYS  11  -8.946  -2.950   4.887
   50    HD2  LYS  11           1HD      LYS  11  -7.980  -0.806   6.030
   51    HD3  LYS  11           2HD      LYS  11  -9.681  -0.436   6.325
   52    HE2  LYS  11           1HE      LYS  11  -8.519  -3.110   7.031
   53    HE3  LYS  11           2HE      LYS  11  -8.379  -1.734   8.125
   54    HZ1  LYS  11           3HZ      LYS  11 -10.566  -1.788   8.619
   55    HZ2  LYS  11           1HZ      LYS  11 -10.418  -3.415   8.177
   56    HZ3  LYS  11           2HZ      LYS  11 -11.035  -2.292   7.074
   57    HA   PRO  12           HA       PRO  12  -9.016   0.563  -1.197
   58    HB2  PRO  12           1HB      PRO  12 -10.034   3.033  -0.714
   59    HB3  PRO  12           2HB      PRO  12 -11.033   1.663  -1.213
   60    HG2  PRO  12           1HG      PRO  12 -10.591   2.787   1.526
   61    HG3  PRO  12           2HG      PRO  12 -12.099   2.241   0.771
   62    HD2  PRO  12           1HD      PRO  12 -10.716   0.717   2.530
   63    HD3  PRO  12           2HD      PRO  12 -11.654   0.020   1.194
   64    H    PHE  13           H        PHE  13  -8.421   1.923   1.997
   65    HA   PHE  13           HA       PHE  13  -6.217   3.539   0.959
   66    HB2  PHE  13           1HB      PHE  13  -7.107   3.403   3.834
   67    HB3  PHE  13           2HB      PHE  13  -6.232   4.697   3.021
   68    HD1  PHE  13           HD1      PHE  13  -7.450   6.043   1.258
   69    HD2  PHE  13           HD2      PHE  13  -9.437   3.423   3.961
   70    HE1  PHE  13           HE1      PHE  13  -9.574   7.204   0.816
   71    HE2  PHE  13           HE2      PHE  13 -11.564   4.579   3.522
   72    HZ   PHE  13           HZ       PHE  13 -11.635   6.471   1.948
   73    H    GLN  14           H        GLN  14  -4.536   2.187   0.554
   74    HA   GLN  14           HA       GLN  14  -3.445   0.737   2.867
   75    HB2  GLN  14           1HB      GLN  14  -3.720  -0.250   0.032
   76    HB3  GLN  14           2HB      GLN  14  -2.604  -0.976   1.181
   77    HG2  GLN  14           1HG      GLN  14  -4.734  -1.156   2.683
   78    HG3  GLN  14           2HG      GLN  14  -5.579  -1.019   1.142
   79   HE21  GLN  14          1HE2      GLN  14  -2.696  -2.709   2.348
   80   HE22  GLN  14          2HE2      GLN  14  -3.122  -4.252   1.699
   81    H    CYS  15           H        CYS  15  -1.373   1.164   3.294
   82    HA   CYS  15           HA       CYS  15   0.041   3.223   2.145
   83    HB2  CYS  15           1HB      CYS  15   0.458   1.755   4.311
   84    HB3  CYS  15           2HB      CYS  15   1.583   0.916   3.248
   85    H    GLU  16           H        GLU  16   2.249   3.011   1.072
   86    HA   GLU  16           HA       GLU  16   2.054   1.064  -1.132
   87    HB2  GLU  16           1HB      GLU  16   2.759   3.955  -1.075
   88    HB3  GLU  16           2HB      GLU  16   3.616   2.934  -2.221
   89    HG2  GLU  16           1HG      GLU  16   0.676   3.495  -2.065
   90    HG3  GLU  16           2HG      GLU  16   1.789   3.819  -3.393
   91    H    GLU  17           H        GLU  17   4.000   2.347   1.398
   92    HA   GLU  17           HA       GLU  17   6.409   1.032   0.383
   93    HB2  GLU  17           1HB      GLU  17   6.493   3.374   1.309
   94    HB3  GLU  17           2HB      GLU  17   6.116   2.695   2.886
   95    HG2  GLU  17           1HG      GLU  17   8.408   2.888   2.957
   96    HG3  GLU  17           2HG      GLU  17   8.183   1.205   2.482
   97    H    CYS  18           H        CYS  18   3.918   0.693   2.760
   98    HA   CYS  18           HA       CYS  18   5.182  -1.795   3.681
   99    HB2  CYS  18           1HB      CYS  18   4.696  -1.368   5.948
  100    HB3  CYS  18           2HB      CYS  18   5.371   0.143   5.347
  101    H    GLY  19           H        GLY  19   2.685  -0.493   2.081
  102    HA2  GLY  19           1HA      GLY  19   0.440  -1.025   1.797
  103    HA3  GLY  19           2HA      GLY  19   1.125  -2.642   1.723
  104    H    LYS  20           H        LYS  20  -0.252  -0.236   3.914
  105    HA   LYS  20           HA       LYS  20  -0.858  -2.379   5.830
  106    HB2  LYS  20           1HB      LYS  20  -0.545   0.590   6.086
  107    HB3  LYS  20           2HB      LYS  20  -1.503  -0.290   7.269
  108    HG2  LYS  20           1HG      LYS  20   1.215  -1.307   6.646
  109    HG3  LYS  20           2HG      LYS  20   1.074   0.163   7.612
  110    HD2  LYS  20           1HD      LYS  20   1.025  -1.400   9.279
  111    HD3  LYS  20           2HD      LYS  20  -0.701  -1.296   8.922
  112    HE2  LYS  20           1HE      LYS  20   0.934  -3.250   7.391
  113    HE3  LYS  20           2HE      LYS  20   0.567  -3.619   9.075
  114    HZ1  LYS  20           3HZ      LYS  20  -1.577  -3.998   8.607
  115    HZ2  LYS  20           1HZ      LYS  20  -1.040  -4.204   7.016
  116    HZ3  LYS  20           2HZ      LYS  20  -1.689  -2.721   7.504
  117    H    ARG  21           H        ARG  21  -2.983  -1.518   7.161
  118    HA   ARG  21           HA       ARG  21  -5.072  -1.044   5.141
  119    HB2  ARG  21           1HB      ARG  21  -5.042  -3.084   7.363
  120    HB3  ARG  21           2HB      ARG  21  -6.523  -2.581   6.559
  121    HG2  ARG  21           1HG      ARG  21  -6.009  -3.665   4.624
  122    HG3  ARG  21           2HG      ARG  21  -4.269  -3.499   4.863
  123    HD2  ARG  21           1HD      ARG  21  -5.820  -5.200   6.752
  124    HD3  ARG  21           2HD      ARG  21  -5.478  -5.824   5.139
  125    HE   ARG  21           HE       ARG  21  -3.599  -5.435   7.288
  126   HH11  ARG  21          1HH1      ARG  21  -4.014  -5.785   3.849
  127   HH12  ARG  21          2HH1      ARG  21  -2.394  -6.337   3.578
  128   HH21  ARG  21          1HH2      ARG  21  -1.464  -6.160   6.945
  129   HH22  ARG  21          2HH2      ARG  21  -0.944  -6.550   5.340
  130    H    PHE  22           H        PHE  22  -6.485   0.517   5.625
  131    HA   PHE  22           HA       PHE  22  -6.986   1.257   8.391
  132    HB2  PHE  22           1HB      PHE  22  -6.125   3.401   6.455
  133    HB3  PHE  22           2HB      PHE  22  -6.325   3.525   8.200
  134    HD1  PHE  22           HD1      PHE  22  -4.694   2.366   9.699
  135    HD2  PHE  22           HD2      PHE  22  -4.081   2.740   5.504
  136    HE1  PHE  22           HE1      PHE  22  -2.301   1.884  10.010
  137    HE2  PHE  22           HE2      PHE  22  -1.688   2.257   5.807
  138    HZ   PHE  22           HZ       PHE  22  -0.795   1.828   8.062
  139    H    THR  23           H        THR  23  -9.026   1.945   8.701
  140    HA   THR  23           HA       THR  23 -10.870   1.808   6.516
  141    HB   THR  23           HB       THR  23 -11.523   1.020   8.737
  142    HG1  THR  23           HG1      THR  23 -12.923   3.055   7.426
  143   HG21  THR  23          3HG2      THR  23 -11.558   2.297  10.637
  144   HG22  THR  23          1HG2      THR  23 -11.810   3.802   9.755
  145   HG23  THR  23          2HG2      THR  23 -10.209   3.063   9.800
  146    H    GLN  24           H        GLN  24  -9.439   4.385   8.438
  147    HA   GLN  24           HA       GLN  24 -10.921   6.372   6.862
  148    HB2  GLN  24           1HB      GLN  24  -9.630   6.420   9.559
  149    HB3  GLN  24           2HB      GLN  24  -9.805   7.926   8.669
  150    HG2  GLN  24           1HG      GLN  24 -12.213   7.580   8.535
  151    HG3  GLN  24           2HG      GLN  24 -12.045   6.057   9.409
  152   HE21  GLN  24          1HE2      GLN  24 -10.631   6.422  11.498
  153   HE22  GLN  24          2HE2      GLN  24 -11.182   7.717  12.500
  154    H    ASN  25           H        ASN  25  -9.886   7.898   5.638
  155    HA   ASN  25           HA       ASN  25  -7.356   7.248   4.580
  156    HB2  ASN  25           1HB      ASN  25  -7.578   9.676   3.629
  157    HB3  ASN  25           2HB      ASN  25  -8.688   8.422   3.084
  158   HD21  ASN  25          1HD2      ASN  25  -8.314  11.267   5.048
  159   HD22  ASN  25          2HD2      ASN  25  -9.999  11.588   5.258
  160    H    SER  26           H        SER  26  -8.392   9.772   6.847
  161    HA   SER  26           HA       SER  26  -6.144  11.256   7.164
  162    HB2  SER  26           1HB      SER  26  -7.977  10.241   9.347
  163    HB3  SER  26           2HB      SER  26  -6.805  11.542   9.558
  164    HG   SER  26           HG       SER  26  -8.393  12.751   8.893
  165    H    HIS  27           H        HIS  27  -6.770   8.102   8.659
  166    HA   HIS  27           HA       HIS  27  -4.499   7.899  10.240
  167    HB2  HIS  27           1HB      HIS  27  -5.962   5.711   8.749
  168    HB3  HIS  27           2HB      HIS  27  -4.793   5.440  10.038
  169    HD1  HIS  27           HD1      HIS  27  -7.721   4.475  10.272
  170    HD2  HIS  27           HD2      HIS  27  -6.301   8.078  11.776
  171    HE1  HIS  27           HE1      HIS  27  -9.316   5.112  12.109
  172    H    LEU  28           H        LEU  28  -4.938   6.954   6.844
  173    HA   LEU  28           HA       LEU  28  -2.293   5.995   6.492
  174    HB2  LEU  28           1HB      LEU  28  -3.894   5.219   4.965
  175    HB3  LEU  28           2HB      LEU  28  -4.468   6.847   4.610
  176    HG   LEU  28           HG       LEU  28  -2.273   7.275   3.475
  177   HD11  LEU  28          1HD1      LEU  28  -1.935   4.356   4.081
  178   HD12  LEU  28          2HD1      LEU  28  -0.816   5.684   4.381
  179   HD13  LEU  28          3HD1      LEU  28  -1.106   5.132   2.732
  180   HD21  LEU  28          3HD2      LEU  28  -3.811   6.936   1.860
  181   HD22  LEU  28          1HD2      LEU  28  -4.394   5.435   2.579
  182   HD23  LEU  28          2HD2      LEU  28  -2.915   5.435   1.618
  183    H    HIS  29           H        HIS  29  -3.850   9.022   5.428
  184    HA   HIS  29           HA       HIS  29  -1.861  10.343   4.201
  185    HB2  HIS  29           1HB      HIS  29  -3.959  11.273   6.110
  186    HB3  HIS  29           2HB      HIS  29  -2.729  12.423   5.596
  187    HD1  HIS  29           HD1      HIS  29  -4.645  13.754   4.383
  188    HD2  HIS  29           HD2      HIS  29  -3.920   9.950   2.878
  189    HE1  HIS  29           HE1      HIS  29  -5.796  13.684   2.148
  190    H    SER  30           H        SER  30  -2.307  10.679   7.726
  191    HA   SER  30           HA       SER  30   0.191  11.880   8.179
  192    HB2  SER  30           1HB      SER  30  -1.742  11.960   9.757
  193    HB3  SER  30           2HB      SER  30  -1.442  10.268  10.155
  194    HG   SER  30           HG       SER  30   0.833  11.221  10.555
  195    H    HIS  31           H        HIS  31  -0.843   8.511   8.239
  196    HA   HIS  31           HA       HIS  31   1.399   7.343   9.390
  197    HB2  HIS  31           1HB      HIS  31  -0.593   6.044   8.976
  198    HB3  HIS  31           2HB      HIS  31  -0.442   6.285   7.238
  199    HD1  HIS  31           HD1      HIS  31   1.587   4.696  10.041
  200    HD2  HIS  31           HD2      HIS  31   0.786   4.226   5.991
  201    HE1  HIS  31           HE1      HIS  31   2.785   2.592   9.358
  202    H    GLN  32           H        GLN  32   0.841   8.386   6.074
  203    HA   GLN  32           HA       GLN  32   3.003   7.204   4.807
  204    HB2  GLN  32           1HB      GLN  32   1.588   9.818   4.338
  205    HB3  GLN  32           2HB      GLN  32   2.912   9.290   3.308
  206    HG2  GLN  32           1HG      GLN  32   1.688   7.317   2.669
  207    HG3  GLN  32           2HG      GLN  32   0.392   7.720   3.793
  208   HE21  GLN  32          1HE2      GLN  32   0.783   7.485   0.730
  209   HE22  GLN  32          2HE2      GLN  32  -0.047   8.876   0.130
  210    H    ARG  33           H        ARG  33   2.871  10.156   6.732
  211    HA   ARG  33           HA       ARG  33   5.449  11.110   6.179
  212    HB2  ARG  33           1HB      ARG  33   3.450  11.527   8.343
  213    HB3  ARG  33           2HB      ARG  33   5.104  12.033   8.663
  214    HG2  ARG  33           1HG      ARG  33   4.147  13.951   7.818
  215    HG3  ARG  33           2HG      ARG  33   4.914  13.253   6.390
  216    HD2  ARG  33           1HD      ARG  33   2.734  12.218   5.798
  217    HD3  ARG  33           2HD      ARG  33   2.004  13.070   7.158
  218    HE   ARG  33           HE       ARG  33   2.817  14.200   4.622
  219   HH11  ARG  33          1HH1      ARG  33   1.933  14.808   7.934
  220   HH12  ARG  33          2HH1      ARG  33   1.475  16.454   7.647
  221   HH21  ARG  33          1HH2      ARG  33   2.218  16.366   4.231
  222   HH22  ARG  33          2HH2      ARG  33   1.637  17.339   5.540
  223    H    VAL  34           H        VAL  34   4.361   8.483   8.127
  224    HA   VAL  34           HA       VAL  34   6.480   8.271   9.953
  225    HB   VAL  34           HB       VAL  34   4.807   6.065   8.742
  226   HG11  VAL  34          1HG1      VAL  34   6.838   5.169   9.718
  227   HG12  VAL  34          2HG1      VAL  34   6.546   6.070  11.207
  228   HG13  VAL  34          3HG1      VAL  34   5.451   4.771  10.732
  229   HG21  VAL  34          3HG2      VAL  34   4.450   7.316  11.447
  230   HG22  VAL  34          1HG2      VAL  34   3.669   7.976  10.010
  231   HG23  VAL  34          2HG2      VAL  34   3.315   6.328  10.528
  232    H    HIS  35           H        HIS  35   6.278   7.534   6.578
  233    HA   HIS  35           HA       HIS  35   8.806   6.053   6.659
  234    HB2  HIS  35           1HB      HIS  35   6.938   6.501   4.323
  235    HB3  HIS  35           2HB      HIS  35   8.327   5.420   4.358
  236    HD1  HIS  35           HD1      HIS  35   8.056   3.545   6.455
  237    HD2  HIS  35           HD2      HIS  35   4.635   5.172   4.750
  238    HE1  HIS  35           HE1      HIS  35   6.197   1.950   7.025
  239    H    THR  36           H        THR  36   8.286   9.074   6.903
  240    HA   THR  36           HA       THR  36   9.097  10.554   4.773
  241    HB   THR  36           HB       THR  36  10.380  11.992   6.492
  242    HG1  THR  36           HG1      THR  36   8.986  10.499   8.424
  243   HG21  THR  36          3HG2      THR  36   8.395  13.004   6.253
  244   HG22  THR  36          1HG2      THR  36   7.926  12.175   7.737
  245   HG23  THR  36          2HG2      THR  36   7.531  11.469   6.169
  246    H    GLY  37           H        GLY  37  11.321   9.035   7.120
  247    HA2  GLY  37           1HA      GLY  37  13.151   8.017   5.343
  248    HA3  GLY  37           2HA      GLY  37  13.642   9.688   5.577
  249    H    GLU  38           H        GLU  38  12.222   7.487   7.957
  250    HA   GLU  38           HA       GLU  38  14.778   7.523   9.416
  251    HB2  GLU  38           1HB      GLU  38  12.024   8.165  10.416
  252    HB3  GLU  38           2HB      GLU  38  13.227   7.499  11.512
  253    HG2  GLU  38           1HG      GLU  38  13.697   9.964   9.861
  254    HG3  GLU  38           2HG      GLU  38  13.021  10.001  11.489
  255    H    LYS  39           H        LYS  39  14.120   5.454   7.759
  256    HA   LYS  39           HA       LYS  39  13.088   3.340   9.516
  257    HB2  LYS  39           1HB      LYS  39  13.444   3.483   6.523
  258    HB3  LYS  39           2HB      LYS  39  13.043   1.993   7.367
  259    HG2  LYS  39           1HG      LYS  39  11.031   3.185   8.292
  260    HG3  LYS  39           2HG      LYS  39  11.397   4.499   7.171
  261    HD2  LYS  39           1HD      LYS  39  11.214   1.716   6.119
  262    HD3  LYS  39           2HD      LYS  39   9.725   2.579   6.509
  263    HE2  LYS  39           1HE      LYS  39   9.987   3.190   4.319
  264    HE3  LYS  39           2HE      LYS  39  10.864   4.497   5.114
  265    HZ1  LYS  39           3HZ      LYS  39  11.894   3.107   3.133
  266    HZ2  LYS  39           1HZ      LYS  39  12.388   2.113   4.409
  267    HZ3  LYS  39           2HZ      LYS  39  12.849   3.740   4.377
  268    HA   PRO  40           HA       PRO  40  17.097   1.633  10.102
  269    HB2  PRO  40           1HB      PRO  40  16.438  -0.968  10.516
  270    HB3  PRO  40           2HB      PRO  40  16.141   0.300  11.711
  271    HG2  PRO  40           1HG      PRO  40  14.247  -0.935   9.749
  272    HG3  PRO  40           2HG      PRO  40  13.983  -0.529  11.455
  273    HD2  PRO  40           1HD      PRO  40  13.098   1.038   9.431
  274    HD3  PRO  40           2HD      PRO  40  13.609   1.699  10.997
  275    H    SER  41           H        SER  41  14.959  -0.246   7.961
  276    HA   SER  41           HA       SER  41  16.657  -1.889   6.666
  277    HB2  SER  41           1HB      SER  41  14.340  -1.843   6.038
  278    HB3  SER  41           2HB      SER  41  14.474  -0.186   5.451
  279    HG   SER  41           HG       SER  41  16.165  -2.085   4.316
  280    H    GLY  42           H        GLY  42  18.410  -1.761   5.405
  281    HA2  GLY  42           1HA      GLY  42  20.115   0.263   5.155
  282    HA3  GLY  42           2HA      GLY  42  19.881  -0.867   3.830
  283    HA   PRO  43           HA       PRO  43  17.446   3.294   3.062
  284    HB2  PRO  43           1HB      PRO  43  18.825   5.447   3.974
  285    HB3  PRO  43           2HB      PRO  43  17.586   4.624   4.930
  286    HG2  PRO  43           1HG      PRO  43  20.565   4.356   5.057
  287    HG3  PRO  43           2HG      PRO  43  19.394   4.463   6.384
  288    HD2  PRO  43           1HD      PRO  43  20.463   2.112   5.570
  289    HD3  PRO  43           2HD      PRO  43  18.816   2.237   6.220
  290    H    SER  44           H        SER  44  20.997   3.519   3.306
  291    HA   SER  44           HA       SER  44  22.576   4.223   1.810
  292    HB2  SER  44           1HB      SER  44  20.775   2.714  -0.101
  293    HB3  SER  44           2HB      SER  44  22.474   3.104  -0.370
  294    HG   SER  44           HG       SER  44  22.668   1.160   0.482
  295    H    SER  45           H        SER  45  20.815   6.248   2.323
  296    HA   SER  45           HA       SER  45  20.404   7.484  -0.322
  297    HB2  SER  45           1HB      SER  45  18.933   8.059   2.262
  298    HB3  SER  45           2HB      SER  45  18.646   8.857   0.716
  299    HG   SER  45           HG       SER  45  17.894   6.341   1.584
  300    H    GLY  46           H        GLY  46  21.230   8.196   3.067
  301    HA2  GLY  46           1HA      GLY  46  22.779   9.661   3.938
  302    HA3  GLY  46           2HA      GLY  46  23.406   9.876   2.311
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1   2.028 -18.088  21.121
    2    HA2  GLY   1           1HA      GLY   1   2.224 -15.435  20.047
    3    HA3  GLY   1           2HA      GLY   1   1.049 -16.661  19.592
    4    H    SER   2           H        SER   2  -0.218 -14.533  19.549
    5    HA   SER   2           HA       SER   2  -1.943 -14.517  21.827
    6    HB2  SER   2           1HB      SER   2  -1.591 -12.279  22.602
    7    HB3  SER   2           2HB      SER   2  -0.013 -13.065  22.575
    8    HG   SER   2           HG       SER   2  -0.106 -12.055  20.261
    9    H    SER   3           H        SER   3  -3.939 -14.051  21.163
   10    HA   SER   3           HA       SER   3  -4.450 -13.406  18.446
   11    HB2  SER   3           1HB      SER   3  -5.920 -14.778  20.034
   12    HB3  SER   3           2HB      SER   3  -6.477 -13.232  20.674
   13    HG   SER   3           HG       SER   3  -7.878 -13.507  19.091
   14    H    GLY   4           H        GLY   4  -4.825 -11.506  17.471
   15    HA2  GLY   4           1HA      GLY   4  -5.660  -9.179  18.972
   16    HA3  GLY   4           2HA      GLY   4  -4.014  -9.090  18.362
   17    H    SER   5           H        SER   5  -3.793  -9.580  15.972
   18    HA   SER   5           HA       SER   5  -5.460  -7.785  14.535
   19    HB2  SER   5           1HB      SER   5  -4.134  -8.425  12.580
   20    HB3  SER   5           2HB      SER   5  -3.082  -8.153  13.969
   21    HG   SER   5           HG       SER   5  -4.031 -10.742  13.482
   22    H    SER   6           H        SER   6  -7.301  -8.135  13.481
   23    HA   SER   6           HA       SER   6  -7.944 -10.792  12.476
   24    HB2  SER   6           1HB      SER   6  -9.771  -9.315  14.388
   25    HB3  SER   6           2HB      SER   6 -10.152 -10.822  13.556
   26    HG   SER   6           HG       SER   6  -9.175 -11.812  15.114
   27    H    GLY   7           H        GLY   7  -8.344 -10.386  10.403
   28    HA2  GLY   7           1HA      GLY   7 -10.516  -9.240   9.318
   29    HA3  GLY   7           2HA      GLY   7  -9.476  -7.846   9.573
   30    H    SER   8           H        SER   8 -10.506  -9.614   7.194
   31    HA   SER   8           HA       SER   8  -8.006 -10.354   5.934
   32    HB2  SER   8           1HB      SER   8  -9.429 -11.082   4.056
   33    HB3  SER   8           2HB      SER   8  -9.988 -11.756   5.586
   34    HG   SER   8           HG       SER   8 -11.058  -9.447   4.325
   35    H    GLY   9           H        GLY   9  -7.833  -7.728   6.491
   36    HA2  GLY   9           1HA      GLY   9  -7.484  -5.646   5.582
   37    HA3  GLY   9           2HA      GLY   9  -7.125  -6.532   4.107
   38    H    GLU  10           H        GLU  10  -8.332  -6.053   2.403
   39    HA   GLU  10           HA       GLU  10 -10.060  -5.340   1.105
   40    HB2  GLU  10           1HB      GLU  10 -11.273  -6.989   2.750
   41    HB3  GLU  10           2HB      GLU  10 -11.961  -5.512   3.410
   42    HG2  GLU  10           1HG      GLU  10 -12.084  -6.017   0.474
   43    HG3  GLU  10           2HG      GLU  10 -13.216  -6.828   1.555
   44    H    LYS  11           H        LYS  11  -8.467  -3.418   2.300
   45    HA   LYS  11           HA       LYS  11 -10.400  -1.259   2.844
   46    HB2  LYS  11           1HB      LYS  11  -7.563  -1.519   3.860
   47    HB3  LYS  11           2HB      LYS  11  -8.623  -0.145   4.147
   48    HG2  LYS  11           1HG      LYS  11  -9.272  -2.948   5.023
   49    HG3  LYS  11           2HG      LYS  11  -8.435  -1.771   6.039
   50    HD2  LYS  11           1HD      LYS  11 -10.302  -0.448   6.277
   51    HD3  LYS  11           2HD      LYS  11 -11.016  -0.998   4.760
   52    HE2  LYS  11           1HE      LYS  11 -10.665  -2.924   7.016
   53    HE3  LYS  11           2HE      LYS  11 -12.006  -1.781   7.050
   54    HZ1  LYS  11           3HZ      LYS  11 -12.339  -4.086   5.979
   55    HZ2  LYS  11           1HZ      LYS  11 -11.531  -3.419   4.650
   56    HZ3  LYS  11           2HZ      LYS  11 -12.971  -2.723   5.200
   57    HA   PRO  12           HA       PRO  12  -8.865   0.529  -0.901
   58    HB2  PRO  12           1HB      PRO  12  -9.979   2.985  -0.592
   59    HB3  PRO  12           2HB      PRO  12 -10.913   1.558  -1.057
   60    HG2  PRO  12           1HG      PRO  12 -10.622   2.837   1.634
   61    HG3  PRO  12           2HG      PRO  12 -12.080   2.203   0.848
   62    HD2  PRO  12           1HD      PRO  12 -10.725   0.818   2.740
   63    HD3  PRO  12           2HD      PRO  12 -11.584   0.022   1.406
   64    H    PHE  13           H        PHE  13  -8.318   1.873   2.272
   65    HA   PHE  13           HA       PHE  13  -6.219   3.638   1.250
   66    HB2  PHE  13           1HB      PHE  13  -7.165   3.388   4.106
   67    HB3  PHE  13           2HB      PHE  13  -6.237   4.703   3.392
   68    HD1  PHE  13           HD1      PHE  13  -7.446   5.852   1.318
   69    HD2  PHE  13           HD2      PHE  13  -9.404   3.725   4.442
   70    HE1  PHE  13           HE1      PHE  13  -9.533   7.059   0.828
   71    HE2  PHE  13           HE2      PHE  13 -11.494   4.929   3.956
   72    HZ   PHE  13           HZ       PHE  13 -11.561   6.598   2.147
   73    H    GLN  14           H        GLN  14  -4.621   2.144   0.724
   74    HA   GLN  14           HA       GLN  14  -3.402   0.772   3.029
   75    HB2  GLN  14           1HB      GLN  14  -3.527  -0.137   0.150
   76    HB3  GLN  14           2HB      GLN  14  -2.547  -0.910   1.389
   77    HG2  GLN  14           1HG      GLN  14  -4.852  -1.041   2.652
   78    HG3  GLN  14           2HG      GLN  14  -5.492  -0.922   1.014
   79   HE21  GLN  14          1HE2      GLN  14  -2.923  -2.649   2.755
   80   HE22  GLN  14          2HE2      GLN  14  -3.222  -4.184   2.020
   81    H    CYS  15           H        CYS  15  -1.298   1.155   3.415
   82    HA   CYS  15           HA       CYS  15   0.028   3.340   2.397
   83    HB2  CYS  15           1HB      CYS  15   0.543   1.722   4.430
   84    HB3  CYS  15           2HB      CYS  15   1.655   0.994   3.275
   85    H    GLU  16           H        GLU  16   2.269   3.201   1.300
   86    HA   GLU  16           HA       GLU  16   2.025   1.467  -1.070
   87    HB2  GLU  16           1HB      GLU  16   2.716   4.345  -0.776
   88    HB3  GLU  16           2HB      GLU  16   3.566   3.434  -2.016
   89    HG2  GLU  16           1HG      GLU  16   1.253   2.684  -2.797
   90    HG3  GLU  16           2HG      GLU  16   0.632   3.984  -1.781
   91    H    GLU  17           H        GLU  17   4.026   2.558   1.514
   92    HA   GLU  17           HA       GLU  17   6.414   1.336   0.349
   93    HB2  GLU  17           1HB      GLU  17   6.451   3.606   1.504
   94    HB3  GLU  17           2HB      GLU  17   6.213   2.734   3.012
   95    HG2  GLU  17           1HG      GLU  17   8.487   2.964   2.981
   96    HG3  GLU  17           2HG      GLU  17   8.294   1.378   2.237
   97    H    CYS  18           H        CYS  18   3.996   0.817   2.782
   98    HA   CYS  18           HA       CYS  18   5.249  -1.763   3.421
   99    HB2  CYS  18           1HB      CYS  18   4.908  -1.527   5.738
  100    HB3  CYS  18           2HB      CYS  18   5.576   0.021   5.234
  101    H    GLY  19           H        GLY  19   2.743  -0.343   2.010
  102    HA2  GLY  19           1HA      GLY  19   0.480  -0.801   1.768
  103    HA3  GLY  19           2HA      GLY  19   1.105  -2.438   1.642
  104    H    LYS  20           H        LYS  20  -0.052  -0.027   3.963
  105    HA   LYS  20           HA       LYS  20  -0.634  -2.156   5.884
  106    HB2  LYS  20           1HB      LYS  20  -0.300   0.795   6.044
  107    HB3  LYS  20           2HB      LYS  20  -1.398   0.046   7.195
  108    HG2  LYS  20           1HG      LYS  20   1.294  -1.156   6.857
  109    HG3  LYS  20           2HG      LYS  20   1.165   0.378   7.721
  110    HD2  LYS  20           1HD      LYS  20  -0.544  -2.005   8.394
  111    HD3  LYS  20           2HD      LYS  20   1.042  -1.741   9.123
  112    HE2  LYS  20           1HE      LYS  20   0.342   0.262  10.155
  113    HE3  LYS  20           2HE      LYS  20  -1.118   0.349   9.171
  114    HZ1  LYS  20           3HZ      LYS  20  -0.534  -1.459  11.433
  115    HZ2  LYS  20           1HZ      LYS  20  -1.746  -1.822  10.311
  116    HZ3  LYS  20           2HZ      LYS  20  -1.844  -0.408  11.232
  117    H    ARG  21           H        ARG  21  -2.772  -1.354   7.229
  118    HA   ARG  21           HA       ARG  21  -4.911  -1.005   5.238
  119    HB2  ARG  21           1HB      ARG  21  -4.773  -3.005   7.492
  120    HB3  ARG  21           2HB      ARG  21  -6.274  -2.588   6.677
  121    HG2  ARG  21           1HG      ARG  21  -5.678  -3.646   4.736
  122    HG3  ARG  21           2HG      ARG  21  -3.949  -3.463   5.039
  123    HD2  ARG  21           1HD      ARG  21  -4.032  -5.163   6.755
  124    HD3  ARG  21           2HD      ARG  21  -5.783  -5.287   6.589
  125    HE   ARG  21           HE       ARG  21  -4.305  -5.821   4.169
  126   HH11  ARG  21          1HH1      ARG  21  -5.686  -7.158   7.072
  127   HH12  ARG  21          2HH1      ARG  21  -5.796  -8.765   6.435
  128   HH21  ARG  21          1HH2      ARG  21  -4.445  -7.933   3.319
  129   HH22  ARG  21          2HH2      ARG  21  -5.089  -9.205   4.301
  130    H    PHE  22           H        PHE  22  -6.190   0.657   5.681
  131    HA   PHE  22           HA       PHE  22  -6.676   1.392   8.476
  132    HB2  PHE  22           1HB      PHE  22  -6.069   3.464   6.366
  133    HB3  PHE  22           2HB      PHE  22  -6.239   3.710   8.101
  134    HD1  PHE  22           HD1      PHE  22  -4.494   2.783   9.638
  135    HD2  PHE  22           HD2      PHE  22  -4.001   2.893   5.412
  136    HE1  PHE  22           HE1      PHE  22  -2.066   2.502   9.917
  137    HE2  PHE  22           HE2      PHE  22  -1.572   2.611   5.684
  138    HZ   PHE  22           HZ       PHE  22  -0.602   2.415   7.939
  139    H    THR  23           H        THR  23  -8.666   2.353   8.879
  140    HA   THR  23           HA       THR  23 -10.733   1.711   7.009
  141    HB   THR  23           HB       THR  23 -12.275   2.660   8.681
  142    HG1  THR  23           HG1      THR  23 -11.279   3.393  10.686
  143   HG21  THR  23          3HG2      THR  23 -11.269   0.329   8.867
  144   HG22  THR  23          1HG2      THR  23 -11.959   1.008  10.340
  145   HG23  THR  23          2HG2      THR  23 -10.210   0.998  10.108
  146    H    GLN  24           H        GLN  24  -9.630   4.786   8.443
  147    HA   GLN  24           HA       GLN  24 -11.037   6.234   6.323
  148    HB2  GLN  24           1HB      GLN  24  -9.807   7.139   8.925
  149    HB3  GLN  24           2HB      GLN  24 -10.448   8.253   7.725
  150    HG2  GLN  24           1HG      GLN  24 -12.652   7.340   7.971
  151    HG3  GLN  24           2HG      GLN  24 -12.050   6.073   9.039
  152   HE21  GLN  24          1HE2      GLN  24 -14.067   8.200   9.440
  153   HE22  GLN  24          2HE2      GLN  24 -13.558   9.050  10.856
  154    H    ASN  25           H        ASN  25  -9.900   8.170   5.411
  155    HA   ASN  25           HA       ASN  25  -7.412   7.346   4.278
  156    HB2  ASN  25           1HB      ASN  25  -7.535   9.809   3.371
  157    HB3  ASN  25           2HB      ASN  25  -8.654   8.588   2.772
  158   HD21  ASN  25          1HD2      ASN  25 -10.241  10.032   2.221
  159   HD22  ASN  25          2HD2      ASN  25 -11.163  10.909   3.390
  160    H    SER  26           H        SER  26  -8.357   9.990   6.463
  161    HA   SER  26           HA       SER  26  -6.043  11.326   6.842
  162    HB2  SER  26           1HB      SER  26  -7.991  11.987   8.070
  163    HB3  SER  26           2HB      SER  26  -8.038  10.452   8.938
  164    HG   SER  26           HG       SER  26  -6.869  11.431  10.373
  165    H    HIS  27           H        HIS  27  -6.919   8.395   8.674
  166    HA   HIS  27           HA       HIS  27  -4.650   8.066  10.170
  167    HB2  HIS  27           1HB      HIS  27  -6.333   5.945   8.826
  168    HB3  HIS  27           2HB      HIS  27  -5.119   5.603  10.055
  169    HD1  HIS  27           HD1      HIS  27  -8.393   5.307  10.122
  170    HD2  HIS  27           HD2      HIS  27  -5.990   8.019  12.154
  171    HE1  HIS  27           HE1      HIS  27  -9.740   6.035  12.117
  172    H    LEU  28           H        LEU  28  -5.144   7.176   6.788
  173    HA   LEU  28           HA       LEU  28  -2.621   5.892   6.480
  174    HB2  LEU  28           1HB      LEU  28  -4.306   5.281   4.957
  175    HB3  LEU  28           2HB      LEU  28  -4.662   6.959   4.555
  176    HG   LEU  28           HG       LEU  28  -2.348   7.038   3.502
  177   HD11  LEU  28          1HD1      LEU  28  -2.515   4.090   3.219
  178   HD12  LEU  28          2HD1      LEU  28  -1.855   4.740   4.719
  179   HD13  LEU  28          3HD1      LEU  28  -1.112   5.157   3.175
  180   HD21  LEU  28          3HD2      LEU  28  -4.452   6.925   2.229
  181   HD22  LEU  28          1HD2      LEU  28  -4.378   5.164   2.293
  182   HD23  LEU  28          2HD2      LEU  28  -3.135   6.068   1.427
  183    H    HIS  29           H        HIS  29  -3.845   9.112   5.604
  184    HA   HIS  29           HA       HIS  29  -1.568  10.114   4.376
  185    HB2  HIS  29           1HB      HIS  29  -3.701  11.491   6.007
  186    HB3  HIS  29           2HB      HIS  29  -2.429  12.373   5.168
  187    HD1  HIS  29           HD1      HIS  29  -5.463  12.671   4.483
  188    HD2  HIS  29           HD2      HIS  29  -2.780  10.223   2.465
  189    HE1  HIS  29           HE1      HIS  29  -6.449  12.336   2.193
  190    H    SER  30           H        SER  30  -2.440  10.113   7.812
  191    HA   SER  30           HA       SER  30  -0.043  11.472   8.609
  192    HB2  SER  30           1HB      SER  30  -2.303  10.138  10.071
  193    HB3  SER  30           2HB      SER  30  -0.846  10.621  10.939
  194    HG   SER  30           HG       SER  30  -1.203  12.754  10.080
  195    H    HIS  31           H        HIS  31  -0.709   8.334   7.655
  196    HA   HIS  31           HA       HIS  31   1.310   7.095   9.353
  197    HB2  HIS  31           1HB      HIS  31  -0.668   5.778   8.990
  198    HB3  HIS  31           2HB      HIS  31  -0.543   5.976   7.245
  199    HD1  HIS  31           HD1      HIS  31   1.440   4.395  10.078
  200    HD2  HIS  31           HD2      HIS  31   0.745   3.937   6.007
  201    HE1  HIS  31           HE1      HIS  31   2.643   2.286   9.424
  202    H    GLN  32           H        GLN  32   0.747   7.841   5.939
  203    HA   GLN  32           HA       GLN  32   2.948   6.644   4.792
  204    HB2  GLN  32           1HB      GLN  32   1.440   9.153   4.130
  205    HB3  GLN  32           2HB      GLN  32   2.843   8.681   3.180
  206    HG2  GLN  32           1HG      GLN  32   1.695   6.448   2.854
  207    HG3  GLN  32           2HG      GLN  32   0.251   7.209   3.519
  208   HE21  GLN  32          1HE2      GLN  32  -1.096   7.647   1.933
  209   HE22  GLN  32          2HE2      GLN  32  -0.683   8.346   0.408
  210    H    ARG  33           H        ARG  33   2.750   9.898   6.212
  211    HA   ARG  33           HA       ARG  33   5.320  10.772   5.701
  212    HB2  ARG  33           1HB      ARG  33   5.056  12.240   7.659
  213    HB3  ARG  33           2HB      ARG  33   3.612  12.221   6.655
  214    HG2  ARG  33           1HG      ARG  33   2.643  12.032   8.696
  215    HG3  ARG  33           2HG      ARG  33   2.901  10.320   8.352
  216    HD2  ARG  33           1HD      ARG  33   5.107  10.539   9.562
  217    HD3  ARG  33           2HD      ARG  33   4.564  12.133  10.085
  218    HE   ARG  33           HE       ARG  33   2.753   9.954  10.672
  219   HH11  ARG  33          1HH1      ARG  33   5.379  11.946  11.792
  220   HH12  ARG  33          2HH1      ARG  33   5.070  11.638  13.468
  221   HH21  ARG  33          1HH2      ARG  33   2.336   9.541  12.876
  222   HH22  ARG  33          2HH2      ARG  33   3.340  10.269  14.084
  223    H    VAL  34           H        VAL  34   4.232   8.377   7.953
  224    HA   VAL  34           HA       VAL  34   6.257   8.332   9.833
  225    HB   VAL  34           HB       VAL  34   4.904   5.920   8.615
  226   HG11  VAL  34          1HG1      VAL  34   6.984   5.554  10.017
  227   HG12  VAL  34          2HG1      VAL  34   6.055   6.178  11.381
  228   HG13  VAL  34          3HG1      VAL  34   5.525   4.717  10.546
  229   HG21  VAL  34          3HG2      VAL  34   3.524   7.892   9.661
  230   HG22  VAL  34          1HG2      VAL  34   3.122   6.216  10.034
  231   HG23  VAL  34          2HG2      VAL  34   4.054   7.176  11.183
  232    H    HIS  35           H        HIS  35   6.212   6.933   6.587
  233    HA   HIS  35           HA       HIS  35   8.903   5.884   6.904
  234    HB2  HIS  35           1HB      HIS  35   7.224   5.905   4.394
  235    HB3  HIS  35           2HB      HIS  35   8.602   4.870   4.757
  236    HD1  HIS  35           HD1      HIS  35   8.187   2.829   6.274
  237    HD2  HIS  35           HD2      HIS  35   4.794   5.117   5.557
  238    HE1  HIS  35           HE1      HIS  35   6.254   1.432   7.069
  239    H    THR  36           H        THR  36   8.223   8.826   6.882
  240    HA   THR  36           HA       THR  36   8.969  10.142   4.590
  241    HB   THR  36           HB       THR  36   8.219  11.383   6.518
  242    HG1  THR  36           HG1      THR  36  10.832  12.337   6.381
  243   HG21  THR  36          3HG2      THR  36   8.946  10.479   8.472
  244   HG22  THR  36          1HG2      THR  36  10.191  11.716   8.304
  245   HG23  THR  36          2HG2      THR  36  10.527  10.056   7.815
  246    H    GLY  37           H        GLY  37  10.897   8.100   6.541
  247    HA2  GLY  37           1HA      GLY  37  13.164   8.517   4.783
  248    HA3  GLY  37           2HA      GLY  37  13.444   8.961   6.460
  249    H    GLU  38           H        GLU  38  14.352   7.435   7.653
  250    HA   GLU  38           HA       GLU  38  14.298   4.676   6.717
  251    HB2  GLU  38           1HB      GLU  38  15.912   6.106   8.825
  252    HB3  GLU  38           2HB      GLU  38  15.968   4.361   8.615
  253    HG2  GLU  38           1HG      GLU  38  16.608   6.340   6.442
  254    HG3  GLU  38           2HG      GLU  38  17.810   5.600   7.498
  255    H    LYS  39           H        LYS  39  11.945   4.614   7.296
  256    HA   LYS  39           HA       LYS  39  10.196   4.232   8.758
  257    HB2  LYS  39           1HB      LYS  39  11.537   2.054   8.327
  258    HB3  LYS  39           2HB      LYS  39  12.073   2.236   9.992
  259    HG2  LYS  39           1HG      LYS  39   9.726   2.224  10.727
  260    HG3  LYS  39           2HG      LYS  39   9.223   1.975   9.054
  261    HD2  LYS  39           1HD      LYS  39  10.821  -0.069   9.147
  262    HD3  LYS  39           2HD      LYS  39  10.669   0.110  10.897
  263    HE2  LYS  39           1HE      LYS  39   8.405  -0.382  10.878
  264    HE3  LYS  39           2HE      LYS  39   8.223   0.046   9.177
  265    HZ1  LYS  39           3HZ      LYS  39   8.714  -2.017   8.545
  266    HZ2  LYS  39           1HZ      LYS  39   8.469  -2.471  10.157
  267    HZ3  LYS  39           2HZ      LYS  39  10.031  -2.140   9.599
  268    HA   PRO  40           HA       PRO  40  12.324   6.426  12.376
  269    HB2  PRO  40           1HB      PRO  40  11.219   8.874  11.981
  270    HB3  PRO  40           2HB      PRO  40  12.754   8.384  11.255
  271    HG2  PRO  40           1HG      PRO  40  10.018   8.444  10.041
  272    HG3  PRO  40           2HG      PRO  40  11.564   8.957   9.340
  273    HD2  PRO  40           1HD      PRO  40  10.416   6.576   8.751
  274    HD3  PRO  40           2HD      PRO  40  12.177   6.802   8.797
  275    H    SER  41           H        SER  41  11.323   6.627  14.322
  276    HA   SER  41           HA       SER  41   8.451   6.103  14.383
  277    HB2  SER  41           1HB      SER  41   8.867   5.699  16.834
  278    HB3  SER  41           2HB      SER  41   9.760   4.625  15.756
  279    HG   SER  41           HG       SER  41  11.051   5.515  17.460
  280    H    GLY  42           H        GLY  42  10.713   8.194  16.196
  281    HA2  GLY  42           1HA      GLY  42   9.468  10.615  15.740
  282    HA3  GLY  42           2HA      GLY  42   8.634   9.914  17.119
  283    HA   PRO  43           HA       PRO  43  12.627  12.176  18.341
  284    HB2  PRO  43           1HB      PRO  43  11.484  14.340  19.515
  285    HB3  PRO  43           2HB      PRO  43  11.930  14.298  17.805
  286    HG2  PRO  43           1HG      PRO  43   9.251  13.880  19.074
  287    HG3  PRO  43           2HG      PRO  43   9.669  14.808  17.622
  288    HD2  PRO  43           1HD      PRO  43   8.617  12.315  17.506
  289    HD3  PRO  43           2HD      PRO  43   9.761  12.926  16.294
  290    H    SER  44           H        SER  44  12.893  10.509  19.853
  291    HA   SER  44           HA       SER  44  12.670   9.375  21.840
  292    HB2  SER  44           1HB      SER  44  13.133  10.779  23.771
  293    HB3  SER  44           2HB      SER  44  14.074  11.354  22.394
  294    HG   SER  44           HG       SER  44  11.549  12.470  22.824
  295    H    SER  45           H        SER  45  10.200   9.540  20.621
  296    HA   SER  45           HA       SER  45   8.404   9.947  22.923
  297    HB2  SER  45           1HB      SER  45   7.908  10.476  19.991
  298    HB3  SER  45           2HB      SER  45   6.602  10.347  21.169
  299    HG   SER  45           HG       SER  45   8.372  12.391  20.727
  300    H    GLY  46           H        GLY  46   6.776   8.422  23.260
  301    HA2  GLY  46           1HA      GLY  46   7.310   5.781  22.958
  302    HA3  GLY  46           2HA      GLY  46   5.670   6.403  23.061
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -12.860 -24.029   9.848
    2    HA2  GLY   1           1HA      GLY   1 -13.036 -26.434   8.832
    3    HA3  GLY   1           2HA      GLY   1 -14.395 -26.525   9.942
    4    H    SER   2           H        SER   2 -13.119 -24.256   7.502
    5    HA   SER   2           HA       SER   2 -15.882 -23.931   6.528
    6    HB2  SER   2           1HB      SER   2 -13.619 -21.931   6.321
    7    HB3  SER   2           2HB      SER   2 -15.292 -21.679   5.822
    8    HG   SER   2           HG       SER   2 -15.376 -20.871   7.789
    9    H    SER   3           H        SER   3 -16.158 -23.607   4.240
   10    HA   SER   3           HA       SER   3 -14.093 -25.004   2.680
   11    HB2  SER   3           1HB      SER   3 -17.071 -24.904   2.529
   12    HB3  SER   3           2HB      SER   3 -16.175 -25.117   1.025
   13    HG   SER   3           HG       SER   3 -16.776 -26.964   2.773
   14    H    GLY   4           H        GLY   4 -13.663 -22.314   3.219
   15    HA2  GLY   4           1HA      GLY   4 -12.719 -21.075   1.159
   16    HA3  GLY   4           2HA      GLY   4 -14.418 -20.933   0.732
   17    H    SER   5           H        SER   5 -12.593 -18.774   1.172
   18    HA   SER   5           HA       SER   5 -13.770 -17.568   3.591
   19    HB2  SER   5           1HB      SER   5 -11.061 -17.158   2.323
   20    HB3  SER   5           2HB      SER   5 -11.731 -16.038   3.509
   21    HG   SER   5           HG       SER   5 -12.046 -18.255   4.681
   22    H    SER   6           H        SER   6 -15.593 -16.859   2.384
   23    HA   SER   6           HA       SER   6 -15.020 -14.700   0.463
   24    HB2  SER   6           1HB      SER   6 -16.322 -16.608  -0.450
   25    HB3  SER   6           2HB      SER   6 -17.570 -16.307   0.759
   26    HG   SER   6           HG       SER   6 -16.725 -14.524  -1.283
   27    H    GLY   7           H        GLY   7 -15.886 -12.692   0.763
   28    HA2  GLY   7           1HA      GLY   7 -17.999 -11.771   2.115
   29    HA3  GLY   7           2HA      GLY   7 -16.892 -12.128   3.432
   30    H    SER   8           H        SER   8 -16.465 -10.090   4.127
   31    HA   SER   8           HA       SER   8 -14.829  -8.447   2.356
   32    HB2  SER   8           1HB      SER   8 -17.459  -7.624   3.525
   33    HB3  SER   8           2HB      SER   8 -16.184  -6.418   3.353
   34    HG   SER   8           HG       SER   8 -16.166  -7.574   1.078
   35    H    GLY   9           H        GLY   9 -13.026  -7.963   3.407
   36    HA2  GLY   9           1HA      GLY   9 -13.167  -7.227   6.238
   37    HA3  GLY   9           2HA      GLY   9 -12.130  -8.578   5.801
   38    H    GLU  10           H        GLU  10 -11.046  -7.676   3.423
   39    HA   GLU  10           HA       GLU  10  -8.849  -6.241   4.203
   40    HB2  GLU  10           1HB      GLU  10 -10.141  -6.266   1.471
   41    HB3  GLU  10           2HB      GLU  10  -8.507  -5.711   1.802
   42    HG2  GLU  10           1HG      GLU  10  -8.019  -8.003   2.700
   43    HG3  GLU  10           2HG      GLU  10  -9.590  -8.500   2.071
   44    H    LYS  11           H        LYS  11  -8.215  -4.034   3.169
   45    HA   LYS  11           HA       LYS  11 -10.400  -2.115   3.644
   46    HB2  LYS  11           1HB      LYS  11  -7.498  -1.870   4.456
   47    HB3  LYS  11           2HB      LYS  11  -8.681  -0.574   4.579
   48    HG2  LYS  11           1HG      LYS  11 -10.016  -2.334   5.982
   49    HG3  LYS  11           2HG      LYS  11  -8.423  -3.067   6.186
   50    HD2  LYS  11           1HD      LYS  11  -7.598  -0.820   6.951
   51    HD3  LYS  11           2HD      LYS  11  -9.278  -0.279   6.949
   52    HE2  LYS  11           1HE      LYS  11  -8.493  -2.753   8.437
   53    HE3  LYS  11           2HE      LYS  11  -8.207  -1.165   9.148
   54    HZ1  LYS  11           3HZ      LYS  11 -10.774  -2.446   8.466
   55    HZ2  LYS  11           1HZ      LYS  11 -10.663  -0.762   8.595
   56    HZ3  LYS  11           2HZ      LYS  11 -10.293  -1.739   9.925
   57    HA   PRO  12           HA       PRO  12  -9.471  -0.491  -0.341
   58    HB2  PRO  12           1HB      PRO  12 -10.485   2.010  -0.038
   59    HB3  PRO  12           2HB      PRO  12 -11.503   0.575  -0.215
   60    HG2  PRO  12           1HG      PRO  12 -10.724   2.049   2.271
   61    HG3  PRO  12           2HG      PRO  12 -12.305   1.394   1.808
   62    HD2  PRO  12           1HD      PRO  12 -10.652   0.125   3.536
   63    HD3  PRO  12           2HD      PRO  12 -11.743  -0.749   2.442
   64    H    PHE  13           H        PHE  13  -8.770   1.711   2.377
   65    HA   PHE  13           HA       PHE  13  -6.671   3.024   0.890
   66    HB2  PHE  13           1HB      PHE  13  -7.398   3.331   3.809
   67    HB3  PHE  13           2HB      PHE  13  -6.412   4.429   2.848
   68    HD1  PHE  13           HD1      PHE  13  -7.491   5.683   0.956
   69    HD2  PHE  13           HD2      PHE  13  -9.731   3.527   3.863
   70    HE1  PHE  13           HE1      PHE  13  -9.505   6.958   0.345
   71    HE2  PHE  13           HE2      PHE  13 -11.748   4.798   3.256
   72    HZ   PHE  13           HZ       PHE  13 -11.637   6.515   1.495
   73    H    GLN  14           H        GLN  14  -4.682   2.250   0.727
   74    HA   GLN  14           HA       GLN  14  -3.457   0.934   3.031
   75    HB2  GLN  14           1HB      GLN  14  -3.614  -0.257   0.260
   76    HB3  GLN  14           2HB      GLN  14  -2.516  -0.829   1.508
   77    HG2  GLN  14           1HG      GLN  14  -4.756  -0.996   2.898
   78    HG3  GLN  14           2HG      GLN  14  -5.458  -1.121   1.286
   79   HE21  GLN  14          1HE2      GLN  14  -2.849  -2.462   3.271
   80   HE22  GLN  14          2HE2      GLN  14  -2.974  -4.072   2.656
   81    H    CYS  15           H        CYS  15  -1.272   1.248   3.213
   82    HA   CYS  15           HA       CYS  15  -0.125   3.489   2.037
   83    HB2  CYS  15           1HB      CYS  15   0.560   2.024   4.133
   84    HB3  CYS  15           2HB      CYS  15   1.645   1.270   2.969
   85    H    GLU  16           H        GLU  16   2.221   3.186   0.973
   86    HA   GLU  16           HA       GLU  16   1.814   1.476  -1.392
   87    HB2  GLU  16           1HB      GLU  16   1.837   4.123  -1.518
   88    HB3  GLU  16           2HB      GLU  16   3.578   3.879  -1.511
   89    HG2  GLU  16           1HG      GLU  16   1.920   2.309  -3.415
   90    HG3  GLU  16           2HG      GLU  16   2.232   4.010  -3.753
   91    H    GLU  17           H        GLU  17   4.055   2.610   1.037
   92    HA   GLU  17           HA       GLU  17   6.232   1.029  -0.093
   93    HB2  GLU  17           1HB      GLU  17   6.391   2.559   2.485
   94    HB3  GLU  17           2HB      GLU  17   7.678   2.166   1.354
   95    HG2  GLU  17           1HG      GLU  17   7.424   4.360   0.862
   96    HG3  GLU  17           2HG      GLU  17   6.238   3.688  -0.256
   97    H    CYS  18           H        CYS  18   3.908   0.964   2.486
   98    HA   CYS  18           HA       CYS  18   5.012  -1.622   3.361
   99    HB2  CYS  18           1HB      CYS  18   4.587  -1.141   5.627
  100    HB3  CYS  18           2HB      CYS  18   5.322   0.329   4.996
  101    H    GLY  19           H        GLY  19   2.566  -0.218   1.773
  102    HA2  GLY  19           1HA      GLY  19   0.282  -0.621   1.556
  103    HA3  GLY  19           2HA      GLY  19   0.889  -2.266   1.441
  104    H    LYS  20           H        LYS  20   0.208   0.125   4.000
  105    HA   LYS  20           HA       LYS  20  -0.547  -1.974   5.836
  106    HB2  LYS  20           1HB      LYS  20  -0.176   0.974   5.980
  107    HB3  LYS  20           2HB      LYS  20  -1.254   0.239   7.159
  108    HG2  LYS  20           1HG      LYS  20   1.418  -0.990   6.758
  109    HG3  LYS  20           2HG      LYS  20   1.323   0.544   7.625
  110    HD2  LYS  20           1HD      LYS  20  -0.317  -0.454   9.167
  111    HD3  LYS  20           2HD      LYS  20  -0.161  -1.992   8.315
  112    HE2  LYS  20           1HE      LYS  20   1.227  -2.138  10.228
  113    HE3  LYS  20           2HE      LYS  20   2.300  -1.905   8.849
  114    HZ1  LYS  20           3HZ      LYS  20   1.390   0.295  10.619
  115    HZ2  LYS  20           1HZ      LYS  20   2.577   0.375   9.416
  116    HZ3  LYS  20           2HZ      LYS  20   2.853  -0.529  10.819
  117    H    ARG  21           H        ARG  21  -2.644  -1.135   7.227
  118    HA   ARG  21           HA       ARG  21  -4.823  -0.803   5.274
  119    HB2  ARG  21           1HB      ARG  21  -4.773  -2.653   7.666
  120    HB3  ARG  21           2HB      ARG  21  -6.185  -2.343   6.665
  121    HG2  ARG  21           1HG      ARG  21  -5.407  -3.595   4.930
  122    HG3  ARG  21           2HG      ARG  21  -3.714  -3.282   5.319
  123    HD2  ARG  21           1HD      ARG  21  -4.175  -5.584   5.783
  124    HD3  ARG  21           2HD      ARG  21  -3.974  -4.742   7.319
  125    HE   ARG  21           HE       ARG  21  -6.199  -5.119   7.797
  126   HH11  ARG  21          1HH1      ARG  21  -5.513  -6.000   4.500
  127   HH12  ARG  21          2HH1      ARG  21  -7.027  -6.808   4.263
  128   HH21  ARG  21          1HH2      ARG  21  -8.197  -6.178   7.497
  129   HH22  ARG  21          2HH2      ARG  21  -8.554  -6.907   5.968
  130    H    PHE  22           H        PHE  22  -6.340   0.671   5.771
  131    HA   PHE  22           HA       PHE  22  -6.675   1.580   8.511
  132    HB2  PHE  22           1HB      PHE  22  -6.094   3.615   6.363
  133    HB3  PHE  22           2HB      PHE  22  -6.194   3.870   8.102
  134    HD1  PHE  22           HD2      PHE  22  -4.135   2.543   5.371
  135    HD2  PHE  22           HD1      PHE  22  -4.338   3.400   9.535
  136    HE1  PHE  22           HE2      PHE  22  -1.702   2.233   5.549
  137    HE2  PHE  22           HE1      PHE  22  -1.904   3.091   9.720
  138    HZ   PHE  22           HZ       PHE  22  -0.583   2.506   7.726
  139    H    THR  23           H        THR  23  -8.699   2.333   8.933
  140    HA   THR  23           HA       THR  23 -10.725   1.825   6.971
  141    HB   THR  23           HB       THR  23 -11.121   1.341   9.346
  142    HG1  THR  23           HG1      THR  23 -12.844   3.409   8.403
  143   HG21  THR  23          3HG2      THR  23 -11.144   4.336   9.729
  144   HG22  THR  23          1HG2      THR  23  -9.847   3.265  10.258
  145   HG23  THR  23          2HG2      THR  23 -11.458   3.113  10.960
  146    H    GLN  24           H        GLN  24  -9.239   4.687   8.377
  147    HA   GLN  24           HA       GLN  24 -10.902   6.371   6.629
  148    HB2  GLN  24           1HB      GLN  24 -10.700   6.678   9.245
  149    HB3  GLN  24           2HB      GLN  24  -9.218   7.520   8.812
  150    HG2  GLN  24           1HG      GLN  24 -10.802   9.207   8.930
  151    HG3  GLN  24           2HG      GLN  24 -10.677   8.871   7.204
  152   HE21  GLN  24          1HE2      GLN  24 -12.704   8.912   9.953
  153   HE22  GLN  24          2HE2      GLN  24 -14.152   8.377   9.178
  154    H    ASN  25           H        ASN  25  -9.988   7.510   5.028
  155    HA   ASN  25           HA       ASN  25  -7.459   6.945   4.055
  156    HB2  ASN  25           1HB      ASN  25  -9.200   7.936   2.664
  157    HB3  ASN  25           2HB      ASN  25  -9.133   9.425   3.603
  158   HD21  ASN  25          1HD2      ASN  25  -8.326  10.917   2.310
  159   HD22  ASN  25          2HD2      ASN  25  -6.887  10.765   1.366
  160    H    SER  26           H        SER  26  -8.494   9.488   6.253
  161    HA   SER  26           HA       SER  26  -6.242  11.106   6.246
  162    HB2  SER  26           1HB      SER  26  -8.202  11.820   7.430
  163    HB3  SER  26           2HB      SER  26  -8.143  10.414   8.493
  164    HG   SER  26           HG       SER  26  -7.295  12.415   9.395
  165    H    HIS  27           H        HIS  27  -6.924   8.308   8.339
  166    HA   HIS  27           HA       HIS  27  -4.719   8.247   9.926
  167    HB2  HIS  27           1HB      HIS  27  -6.721   6.538   9.576
  168    HB3  HIS  27           2HB      HIS  27  -5.500   5.662   8.656
  169    HD1  HIS  27           HD1      HIS  27  -6.052   3.934  10.746
  170    HD2  HIS  27           HD2      HIS  27  -3.782   7.315  11.570
  171    HE1  HIS  27           HE1      HIS  27  -4.874   3.442  12.913
  172    H    LEU  28           H        LEU  28  -4.915   6.932   6.627
  173    HA   LEU  28           HA       LEU  28  -2.267   6.007   6.485
  174    HB2  LEU  28           1HB      LEU  28  -3.769   5.202   4.872
  175    HB3  LEU  28           2HB      LEU  28  -4.275   6.827   4.412
  176    HG   LEU  28           HG       LEU  28  -2.068   7.188   3.369
  177   HD11  LEU  28          1HD1      LEU  28  -0.352   5.762   3.530
  178   HD12  LEU  28          2HD1      LEU  28  -1.382   4.345   3.336
  179   HD13  LEU  28          3HD1      LEU  28  -1.224   5.109   4.917
  180   HD21  LEU  28          3HD2      LEU  28  -2.473   5.100   1.692
  181   HD22  LEU  28          1HD2      LEU  28  -3.410   6.595   1.667
  182   HD23  LEU  28          2HD2      LEU  28  -4.033   5.178   2.513
  183    H    HIS  29           H        HIS  29  -3.627   8.926   4.943
  184    HA   HIS  29           HA       HIS  29  -1.478  10.155   3.949
  185    HB2  HIS  29           1HB      HIS  29  -3.809  11.258   5.462
  186    HB3  HIS  29           2HB      HIS  29  -2.513  12.351   4.983
  187    HD1  HIS  29           HD1      HIS  29  -2.679  13.285   2.690
  188    HD2  HIS  29           HD2      HIS  29  -4.962   9.843   3.140
  189    HE1  HIS  29           HE1      HIS  29  -3.946  13.031   0.532
  190    H    SER  30           H        SER  30  -2.387  10.474   7.383
  191    HA   SER  30           HA       SER  30  -0.022  11.861   8.108
  192    HB2  SER  30           1HB      SER  30  -2.157  11.931   9.404
  193    HB3  SER  30           2HB      SER  30  -1.861  10.267   9.910
  194    HG   SER  30           HG       SER  30   0.193  12.099  10.315
  195    H    HIS  31           H        HIS  31  -1.007   8.465   8.354
  196    HA   HIS  31           HA       HIS  31   1.140   7.449   9.768
  197    HB2  HIS  31           1HB      HIS  31  -0.534   5.891   9.414
  198    HB3  HIS  31           2HB      HIS  31  -0.705   6.306   7.711
  199    HD1  HIS  31           HD1      HIS  31   1.412   4.264  10.046
  200    HD2  HIS  31           HD2      HIS  31   0.894   4.859   5.967
  201    HE1  HIS  31           HE1      HIS  31   2.730   2.438   8.928
  202    H    GLN  32           H        GLN  32   0.946   8.408   6.413
  203    HA   GLN  32           HA       GLN  32   3.167   7.140   5.353
  204    HB2  GLN  32           1HB      GLN  32   2.111   9.908   4.755
  205    HB3  GLN  32           2HB      GLN  32   3.277   9.046   3.759
  206    HG2  GLN  32           1HG      GLN  32   1.433   7.195   3.726
  207    HG3  GLN  32           2HG      GLN  32   0.370   8.538   4.145
  208   HE21  GLN  32          1HE2      GLN  32   0.883   6.805   1.674
  209   HE22  GLN  32          2HE2      GLN  32   0.975   7.956   0.389
  210    H    ARG  33           H        ARG  33   3.012   9.629   7.707
  211    HA   ARG  33           HA       ARG  33   5.507  10.866   7.315
  212    HB2  ARG  33           1HB      ARG  33   5.210  11.841   9.431
  213    HB3  ARG  33           2HB      ARG  33   3.575  11.597   8.831
  214    HG2  ARG  33           1HG      ARG  33   3.257   9.701  10.233
  215    HG3  ARG  33           2HG      ARG  33   4.963   9.680  10.685
  216    HD2  ARG  33           1HD      ARG  33   3.349  12.128  11.222
  217    HD3  ARG  33           2HD      ARG  33   3.154  10.728  12.276
  218    HE   ARG  33           HE       ARG  33   5.835  11.064  12.188
  219   HH11  ARG  33          1HH1      ARG  33   3.179  13.206  12.880
  220   HH12  ARG  33          2HH1      ARG  33   4.092  14.197  13.969
  221   HH21  ARG  33          1HH2      ARG  33   7.048  12.362  13.619
  222   HH22  ARG  33          2HH2      ARG  33   6.293  13.717  14.388
  223    H    VAL  34           H        VAL  34   4.624   7.813   8.681
  224    HA   VAL  34           HA       VAL  34   6.878   7.329  10.291
  225    HB   VAL  34           HB       VAL  34   6.327   4.942  10.066
  226   HG11  VAL  34          1HG1      VAL  34   4.888   6.848  11.330
  227   HG12  VAL  34          2HG1      VAL  34   3.638   6.106  10.330
  228   HG13  VAL  34          3HG1      VAL  34   4.567   5.119  11.459
  229   HG21  VAL  34          3HG2      VAL  34   3.927   4.959   8.640
  230   HG22  VAL  34          1HG2      VAL  34   5.066   5.867   7.645
  231   HG23  VAL  34          2HG2      VAL  34   5.452   4.222   8.150
  232    H    HIS  35           H        HIS  35   6.578   7.574   6.922
  233    HA   HIS  35           HA       HIS  35   9.126   6.150   6.522
  234    HB2  HIS  35           1HB      HIS  35   7.103   6.831   4.385
  235    HB3  HIS  35           2HB      HIS  35   8.492   5.758   4.243
  236    HD1  HIS  35           HD1      HIS  35   8.314   3.545   5.862
  237    HD2  HIS  35           HD2      HIS  35   4.788   5.552   4.969
  238    HE1  HIS  35           HE1      HIS  35   6.467   1.912   6.359
  239    H    THR  36           H        THR  36   8.379   9.042   7.294
  240    HA   THR  36           HA       THR  36   8.861  10.925   5.421
  241    HB   THR  36           HB       THR  36  10.404  12.001   7.311
  242    HG1  THR  36           HG1      THR  36  10.176   9.739   8.361
  243   HG21  THR  36          3HG2      THR  36   8.570  13.216   7.740
  244   HG22  THR  36          1HG2      THR  36   7.673  11.812   8.316
  245   HG23  THR  36          2HG2      THR  36   7.749  12.162   6.589
  246    H    GLY  37           H        GLY  37  11.329   8.891   6.955
  247    HA2  GLY  37           1HA      GLY  37  13.010   8.423   4.942
  248    HA3  GLY  37           2HA      GLY  37  13.421  10.088   5.322
  249    H    GLU  38           H        GLU  38  13.865   6.813   6.143
  250    HA   GLU  38           HA       GLU  38  15.454   7.609   8.494
  251    HB2  GLU  38           1HB      GLU  38  14.943   5.523   9.551
  252    HB3  GLU  38           2HB      GLU  38  13.426   6.247   9.038
  253    HG2  GLU  38           1HG      GLU  38  14.793   4.289   7.255
  254    HG3  GLU  38           2HG      GLU  38  13.881   3.714   8.649
  255    H    LYS  39           H        LYS  39  17.386   6.394   8.888
  256    HA   LYS  39           HA       LYS  39  18.497   5.194   6.437
  257    HB2  LYS  39           1HB      LYS  39  19.690   7.198   6.903
  258    HB3  LYS  39           2HB      LYS  39  19.802   6.818   8.616
  259    HG2  LYS  39           1HG      LYS  39  21.381   5.083   8.207
  260    HG3  LYS  39           2HG      LYS  39  21.136   5.196   6.462
  261    HD2  LYS  39           1HD      LYS  39  23.142   6.343   6.843
  262    HD3  LYS  39           2HD      LYS  39  21.931   7.619   6.695
  263    HE2  LYS  39           1HE      LYS  39  21.759   7.595   9.205
  264    HE3  LYS  39           2HE      LYS  39  23.160   6.525   9.218
  265    HZ1  LYS  39           3HZ      LYS  39  23.992   8.682   9.518
  266    HZ2  LYS  39           1HZ      LYS  39  23.022   9.334   8.294
  267    HZ3  LYS  39           2HZ      LYS  39  24.315   8.317   7.898
  268    HA   PRO  40           HA       PRO  40  18.780   1.429   8.747
  269    HB2  PRO  40           1HB      PRO  40  20.349   0.074   6.994
  270    HB3  PRO  40           2HB      PRO  40  18.628   0.363   6.717
  271    HG2  PRO  40           1HG      PRO  40  20.996   1.831   5.622
  272    HG3  PRO  40           2HG      PRO  40  19.515   1.319   4.791
  273    HD2  PRO  40           1HD      PRO  40  19.902   3.860   5.644
  274    HD3  PRO  40           2HD      PRO  40  18.297   3.103   5.595
  275    H    SER  41           H        SER  41  20.643  -0.164   9.304
  276    HA   SER  41           HA       SER  41  23.212   1.165   9.658
  277    HB2  SER  41           1HB      SER  41  21.733   1.712  11.652
  278    HB3  SER  41           2HB      SER  41  21.782  -0.006  12.048
  279    HG   SER  41           HG       SER  41  23.768   1.925  12.239
  280    H    GLY  42           H        GLY  42  24.853  -0.341  10.608
  281    HA2  GLY  42           1HA      GLY  42  24.205  -3.161  10.033
  282    HA3  GLY  42           2HA      GLY  42  25.638  -2.415   9.341
  283    HA   PRO  43           HA       PRO  43  27.979  -3.601  12.848
  284    HB2  PRO  43           1HB      PRO  43  29.766  -1.565  13.023
  285    HB3  PRO  43           2HB      PRO  43  29.827  -2.789  11.750
  286    HG2  PRO  43           1HG      PRO  43  28.713  -0.012  11.656
  287    HG3  PRO  43           2HG      PRO  43  29.702  -0.862  10.454
  288    HD2  PRO  43           1HD      PRO  43  27.016  -0.610  10.217
  289    HD3  PRO  43           2HD      PRO  43  27.899  -2.025   9.610
  290    H    SER  44           H        SER  44  26.820  -0.255  12.837
  291    HA   SER  44           HA       SER  44  27.226   0.250  15.585
  292    HB2  SER  44           1HB      SER  44  26.893   2.078  14.016
  293    HB3  SER  44           2HB      SER  44  25.273   1.495  13.635
  294    HG   SER  44           HG       SER  44  25.249   1.749  16.199
  295    H    SER  45           H        SER  45  24.341  -0.777  13.778
  296    HA   SER  45           HA       SER  45  22.454  -0.831  15.745
  297    HB2  SER  45           1HB      SER  45  22.199  -1.513  13.302
  298    HB3  SER  45           2HB      SER  45  22.769  -3.110  13.789
  299    HG   SER  45           HG       SER  45  20.319  -2.215  13.908
  300    H    GLY  46           H        GLY  46  22.230  -1.803  17.648
  301    HA2  GLY  46           1HA      GLY  46  24.207  -3.568  18.665
  302    HA3  GLY  46           2HA      GLY  46  22.694  -3.149  19.453
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1 -31.640 -16.746   2.974
    2    HA2  GLY   1           1HA      GLY   1 -29.316 -16.264   3.483
    3    HA3  GLY   1           2HA      GLY   1 -29.899 -17.420   4.672
    4    H    SER   2           H        SER   2 -29.453 -19.691   4.305
    5    HA   SER   2           HA       SER   2 -27.747 -21.240   4.153
    6    HB2  SER   2           1HB      SER   2 -29.245 -21.277   2.003
    7    HB3  SER   2           2HB      SER   2 -27.794 -20.667   1.208
    8    HG   SER   2           HG       SER   2 -27.343 -22.801   2.874
    9    H    SER   3           H        SER   3 -26.628 -18.795   4.818
   10    HA   SER   3           HA       SER   3 -24.181 -18.720   3.176
   11    HB2  SER   3           1HB      SER   3 -23.869 -16.414   4.156
   12    HB3  SER   3           2HB      SER   3 -25.264 -16.580   3.089
   13    HG   SER   3           HG       SER   3 -25.852 -15.482   4.973
   14    H    GLY   4           H        GLY   4 -22.245 -17.879   4.527
   15    HA2  GLY   4           1HA      GLY   4 -21.928 -18.101   7.222
   16    HA3  GLY   4           2HA      GLY   4 -21.869 -19.767   6.667
   17    H    SER   5           H        SER   5 -20.521 -19.492   4.273
   18    HA   SER   5           HA       SER   5 -17.903 -19.722   4.895
   19    HB2  SER   5           1HB      SER   5 -18.705 -20.212   2.663
   20    HB3  SER   5           2HB      SER   5 -19.055 -18.508   2.372
   21    HG   SER   5           HG       SER   5 -17.094 -18.425   1.639
   22    H    SER   6           H        SER   6 -16.146 -18.441   5.233
   23    HA   SER   6           HA       SER   6 -16.698 -15.596   5.681
   24    HB2  SER   6           1HB      SER   6 -14.633 -17.495   6.769
   25    HB3  SER   6           2HB      SER   6 -14.414 -15.750   6.893
   26    HG   SER   6           HG       SER   6 -16.602 -17.255   7.899
   27    H    GLY   7           H        GLY   7 -15.396 -13.974   4.829
   28    HA2  GLY   7           1HA      GLY   7 -13.066 -14.462   3.286
   29    HA3  GLY   7           2HA      GLY   7 -14.462 -14.295   2.231
   30    H    SER   8           H        SER   8 -12.457 -12.672   4.614
   31    HA   SER   8           HA       SER   8 -12.746 -10.164   3.294
   32    HB2  SER   8           1HB      SER   8 -14.878 -10.546   4.816
   33    HB3  SER   8           2HB      SER   8 -13.779 -10.035   6.097
   34    HG   SER   8           HG       SER   8 -13.397  -8.126   4.903
   35    H    GLY   9           H        GLY   9 -11.176  -8.701   3.909
   36    HA2  GLY   9           1HA      GLY   9  -9.782  -8.431   6.221
   37    HA3  GLY   9           2HA      GLY   9  -9.000  -9.803   5.449
   38    H    GLU  10           H        GLU  10 -10.046  -6.474   4.737
   39    HA   GLU  10           HA       GLU  10  -7.488  -5.651   3.885
   40    HB2  GLU  10           1HB      GLU  10  -7.840  -5.423   1.496
   41    HB3  GLU  10           2HB      GLU  10  -8.011  -7.109   1.964
   42    HG2  GLU  10           1HG      GLU  10 -10.414  -5.347   1.745
   43    HG3  GLU  10           2HG      GLU  10  -9.698  -6.077   0.309
   44    H    LYS  11           H        LYS  11  -7.718  -3.506   2.549
   45    HA   LYS  11           HA       LYS  11 -10.150  -2.044   3.202
   46    HB2  LYS  11           1HB      LYS  11  -7.434  -1.387   4.331
   47    HB3  LYS  11           2HB      LYS  11  -8.701  -0.175   4.184
   48    HG2  LYS  11           1HG      LYS  11  -9.223  -2.751   5.610
   49    HG3  LYS  11           2HG      LYS  11  -8.400  -1.418   6.422
   50    HD2  LYS  11           1HD      LYS  11 -10.304   0.053   5.874
   51    HD3  LYS  11           2HD      LYS  11 -11.130  -1.322   5.137
   52    HE2  LYS  11           1HE      LYS  11 -10.152  -1.597   7.932
   53    HE3  LYS  11           2HE      LYS  11 -11.578  -0.601   7.644
   54    HZ1  LYS  11           3HZ      LYS  11 -11.216  -3.488   7.155
   55    HZ2  LYS  11           1HZ      LYS  11 -12.409  -2.617   6.329
   56    HZ3  LYS  11           2HZ      LYS  11 -12.441  -2.702   8.018
   57    HA   PRO  12           HA       PRO  12  -9.333   0.005  -0.594
   58    HB2  PRO  12           1HB      PRO  12 -10.468   2.429  -0.141
   59    HB3  PRO  12           2HB      PRO  12 -11.414   0.957  -0.391
   60    HG2  PRO  12           1HG      PRO  12 -10.683   2.325   2.169
   61    HG3  PRO  12           2HG      PRO  12 -12.234   1.617   1.682
   62    HD2  PRO  12           1HD      PRO  12 -10.499   0.338   3.321
   63    HD3  PRO  12           2HD      PRO  12 -11.557  -0.527   2.188
   64    H    PHE  13           H        PHE  13  -8.543   1.843   2.334
   65    HA   PHE  13           HA       PHE  13  -6.516   3.351   0.859
   66    HB2  PHE  13           1HB      PHE  13  -7.252   3.705   3.762
   67    HB3  PHE  13           2HB      PHE  13  -6.456   4.857   2.694
   68    HD1  PHE  13           HD1      PHE  13  -7.817   5.735   0.702
   69    HD2  PHE  13           HD2      PHE  13  -9.546   3.785   4.068
   70    HE1  PHE  13           HE1      PHE  13  -9.997   6.740   0.161
   71    HE2  PHE  13           HE2      PHE  13 -11.729   4.786   3.531
   72    HZ   PHE  13           HZ       PHE  13 -11.957   6.264   1.575
   73    H    GLN  14           H        GLN  14  -4.716   2.155   0.618
   74    HA   GLN  14           HA       GLN  14  -3.486   1.077   3.064
   75    HB2  GLN  14           1HB      GLN  14  -3.515  -0.202   0.327
   76    HB3  GLN  14           2HB      GLN  14  -2.546  -0.766   1.681
   77    HG2  GLN  14           1HG      GLN  14  -4.816  -0.901   2.922
   78    HG3  GLN  14           2HG      GLN  14  -5.504  -0.874   1.299
   79   HE21  GLN  14          1HE2      GLN  14  -2.829  -2.473   3.005
   80   HE22  GLN  14          2HE2      GLN  14  -3.147  -4.050   2.376
   81    H    CYS  15           H        CYS  15  -1.208   1.129   3.150
   82    HA   CYS  15           HA       CYS  15  -0.029   3.403   1.961
   83    HB2  CYS  15           1HB      CYS  15   0.565   2.031   4.150
   84    HB3  CYS  15           2HB      CYS  15   1.676   1.210   3.057
   85    H    GLU  16           H        GLU  16   2.220   3.162   0.863
   86    HA   GLU  16           HA       GLU  16   1.925   1.227  -1.340
   87    HB2  GLU  16           1HB      GLU  16   2.725   4.091  -1.278
   88    HB3  GLU  16           2HB      GLU  16   3.535   3.052  -2.442
   89    HG2  GLU  16           1HG      GLU  16   1.778   3.837  -3.680
   90    HG3  GLU  16           2HG      GLU  16   1.117   2.323  -3.064
   91    H    GLU  17           H        GLU  17   3.953   2.407   1.170
   92    HA   GLU  17           HA       GLU  17   6.306   1.041   0.097
   93    HB2  GLU  17           1HB      GLU  17   6.686   3.270   0.979
   94    HB3  GLU  17           2HB      GLU  17   5.959   2.821   2.515
   95    HG2  GLU  17           1HG      GLU  17   7.772   1.200   2.875
   96    HG3  GLU  17           2HG      GLU  17   8.515   1.724   1.365
   97    H    CYS  18           H        CYS  18   3.847   0.733   2.519
   98    HA   CYS  18           HA       CYS  18   5.075  -1.796   3.391
   99    HB2  CYS  18           1HB      CYS  18   4.305  -1.408   5.662
  100    HB3  CYS  18           2HB      CYS  18   5.324  -0.067   5.149
  101    H    GLY  19           H        GLY  19   2.476  -0.278   1.971
  102    HA2  GLY  19           1HA      GLY  19   0.288  -0.876   1.554
  103    HA3  GLY  19           2HA      GLY  19   0.969  -2.494   1.454
  104    H    LYS  20           H        LYS  20   0.036  -0.141   3.967
  105    HA   LYS  20           HA       LYS  20  -0.781  -2.334   5.703
  106    HB2  LYS  20           1HB      LYS  20  -0.141   0.532   6.051
  107    HB3  LYS  20           2HB      LYS  20  -1.397  -0.101   7.107
  108    HG2  LYS  20           1HG      LYS  20   0.386  -2.018   7.478
  109    HG3  LYS  20           2HG      LYS  20   1.499  -0.731   7.009
  110    HD2  LYS  20           1HD      LYS  20   0.676   0.687   8.778
  111    HD3  LYS  20           2HD      LYS  20  -0.572  -0.492   9.191
  112    HE2  LYS  20           1HE      LYS  20   0.907  -1.899  10.219
  113    HE3  LYS  20           2HE      LYS  20   2.259  -1.393   9.209
  114    HZ1  LYS  20           3HZ      LYS  20   2.770   0.303  10.583
  115    HZ2  LYS  20           1HZ      LYS  20   1.997  -0.664  11.736
  116    HZ3  LYS  20           2HZ      LYS  20   1.162   0.614  11.008
  117    H    ARG  21           H        ARG  21  -2.859  -1.565   7.088
  118    HA   ARG  21           HA       ARG  21  -4.964  -0.899   5.137
  119    HB2  ARG  21           1HB      ARG  21  -5.125  -2.943   7.360
  120    HB3  ARG  21           2HB      ARG  21  -6.445  -2.492   6.288
  121    HG2  ARG  21           1HG      ARG  21  -5.553  -3.606   4.493
  122    HG3  ARG  21           2HG      ARG  21  -3.902  -3.490   5.105
  123    HD2  ARG  21           1HD      ARG  21  -4.218  -5.236   6.625
  124    HD3  ARG  21           2HD      ARG  21  -5.975  -5.121   6.529
  125    HE   ARG  21           HE       ARG  21  -5.255  -5.816   4.013
  126   HH11  ARG  21          1HH1      ARG  21  -4.556  -7.129   7.161
  127   HH12  ARG  21          2HH1      ARG  21  -4.404  -8.758   6.591
  128   HH21  ARG  21          1HH2      ARG  21  -5.057  -7.957   3.251
  129   HH22  ARG  21          2HH2      ARG  21  -4.688  -9.228   4.367
  130    H    PHE  22           H        PHE  22  -6.286   0.706   5.709
  131    HA   PHE  22           HA       PHE  22  -6.488   1.428   8.550
  132    HB2  PHE  22           1HB      PHE  22  -6.072   3.365   6.263
  133    HB3  PHE  22           2HB      PHE  22  -6.391   3.819   7.933
  134    HD1  PHE  22           HD1      PHE  22  -4.701   3.432   9.668
  135    HD2  PHE  22           HD2      PHE  22  -3.914   2.641   5.561
  136    HE1  PHE  22           HE1      PHE  22  -2.287   3.379  10.145
  137    HE2  PHE  22           HE2      PHE  22  -1.499   2.585   6.031
  138    HZ   PHE  22           HZ       PHE  22  -0.683   2.953   8.325
  139    H    THR  23           H        THR  23  -8.473   2.115   9.231
  140    HA   THR  23           HA       THR  23 -10.713   1.457   7.581
  141    HB   THR  23           HB       THR  23 -10.905   1.016   9.930
  142    HG1  THR  23           HG1      THR  23 -12.538   3.226   9.166
  143   HG21  THR  23          3HG2      THR  23  -9.502   3.403  10.250
  144   HG22  THR  23          1HG2      THR  23 -10.126   2.365  11.530
  145   HG23  THR  23          2HG2      THR  23 -11.092   3.719  10.944
  146    H    GLN  24           H        GLN  24  -8.872   4.275   8.044
  147    HA   GLN  24           HA       GLN  24 -10.873   5.831   6.567
  148    HB2  GLN  24           1HB      GLN  24  -9.390   6.716   9.041
  149    HB3  GLN  24           2HB      GLN  24 -10.180   7.840   7.943
  150    HG2  GLN  24           1HG      GLN  24 -11.606   5.584   9.325
  151    HG3  GLN  24           2HG      GLN  24 -11.501   7.221   9.969
  152   HE21  GLN  24          1HE2      GLN  24 -13.465   5.197   8.390
  153   HE22  GLN  24          2HE2      GLN  24 -14.408   6.320   7.477
  154    H    ASN  25           H        ASN  25  -9.872   7.872   5.649
  155    HA   ASN  25           HA       ASN  25  -7.458   7.130   4.263
  156    HB2  ASN  25           1HB      ASN  25  -7.797   9.337   3.099
  157    HB3  ASN  25           2HB      ASN  25  -9.154   8.222   2.968
  158   HD21  ASN  25          1HD2      ASN  25  -8.101  11.285   3.993
  159   HD22  ASN  25          2HD2      ASN  25  -9.594  11.834   4.667
  160    H    SER  26           H        SER  26  -8.427   9.798   6.412
  161    HA   SER  26           HA       SER  26  -6.173  11.287   6.554
  162    HB2  SER  26           1HB      SER  26  -8.361  11.504   7.903
  163    HB3  SER  26           2HB      SER  26  -7.571  10.474   9.097
  164    HG   SER  26           HG       SER  26  -6.072  12.025   9.458
  165    H    HIS  27           H        HIS  27  -6.743   8.273   8.342
  166    HA   HIS  27           HA       HIS  27  -4.424   8.165   9.837
  167    HB2  HIS  27           1HB      HIS  27  -6.037   5.959   8.558
  168    HB3  HIS  27           2HB      HIS  27  -4.682   5.639   9.637
  169    HD1  HIS  27           HD1      HIS  27  -8.076   5.460   9.863
  170    HD2  HIS  27           HD2      HIS  27  -5.293   7.592  12.092
  171    HE1  HIS  27           HE1      HIS  27  -9.201   5.942  12.060
  172    H    LEU  28           H        LEU  28  -4.920   7.301   6.456
  173    HA   LEU  28           HA       LEU  28  -2.327   6.187   6.070
  174    HB2  LEU  28           1HB      LEU  28  -3.961   5.495   4.546
  175    HB3  LEU  28           2HB      LEU  28  -4.493   7.146   4.232
  176    HG   LEU  28           HG       LEU  28  -2.325   7.541   3.057
  177   HD11  LEU  28          1HD1      LEU  28  -2.016   4.591   3.558
  178   HD12  LEU  28          2HD1      LEU  28  -0.910   5.891   3.999
  179   HD13  LEU  28          3HD1      LEU  28  -1.130   5.459   2.304
  180   HD21  LEU  28          3HD2      LEU  28  -2.971   5.843   1.146
  181   HD22  LEU  28          1HD2      LEU  28  -4.007   7.214   1.545
  182   HD23  LEU  28          2HD2      LEU  28  -4.398   5.606   2.157
  183    H    HIS  29           H        HIS  29  -3.768   9.313   5.146
  184    HA   HIS  29           HA       HIS  29  -1.625  10.510   3.935
  185    HB2  HIS  29           1HB      HIS  29  -3.605  11.800   5.824
  186    HB3  HIS  29           2HB      HIS  29  -2.559  12.673   4.707
  187    HD1  HIS  29           HD1      HIS  29  -5.696  12.771   4.619
  188    HD2  HIS  29           HD2      HIS  29  -3.288  10.372   2.230
  189    HE1  HIS  29           HE1      HIS  29  -7.073  12.257   2.579
  190    H    SER  30           H        SER  30  -2.351  10.570   7.423
  191    HA   SER  30           HA       SER  30   0.059  11.924   8.107
  192    HB2  SER  30           1HB      SER  30  -1.765  10.280   9.879
  193    HB3  SER  30           2HB      SER  30  -0.558  11.445  10.423
  194    HG   SER  30           HG       SER  30  -2.786  12.068   8.778
  195    H    HIS  31           H        HIS  31  -0.958   8.537   8.139
  196    HA   HIS  31           HA       HIS  31   1.196   7.386   9.434
  197    HB2  HIS  31           1HB      HIS  31  -0.635   5.984   8.913
  198    HB3  HIS  31           2HB      HIS  31  -0.557   6.381   7.199
  199    HD1  HIS  31           HD1      HIS  31   0.992   4.191   9.795
  200    HD2  HIS  31           HD2      HIS  31   1.341   4.937   5.723
  201    HE1  HIS  31           HE1      HIS  31   2.403   2.318   8.887
  202    H    GLN  32           H        GLN  32   0.958   8.582   6.151
  203    HA   GLN  32           HA       GLN  32   3.149   7.396   4.963
  204    HB2  GLN  32           1HB      GLN  32   1.724   9.979   4.599
  205    HB3  GLN  32           2HB      GLN  32   3.297   9.812   3.829
  206    HG2  GLN  32           1HG      GLN  32   2.577   8.190   2.386
  207    HG3  GLN  32           2HG      GLN  32   1.291   7.649   3.463
  208   HE21  GLN  32          1HE2      GLN  32   0.136   7.741   1.347
  209   HE22  GLN  32          2HE2      GLN  32  -0.629   9.231   0.924
  210    H    ARG  33           H        ARG  33   3.037  10.077   7.228
  211    HA   ARG  33           HA       ARG  33   5.690  10.961   6.941
  212    HB2  ARG  33           1HB      ARG  33   4.065  11.034   9.484
  213    HB3  ARG  33           2HB      ARG  33   5.380  12.108   9.026
  214    HG2  ARG  33           1HG      ARG  33   2.996  11.981   7.259
  215    HG3  ARG  33           2HG      ARG  33   2.857  12.828   8.801
  216    HD2  ARG  33           1HD      ARG  33   3.544  14.536   7.430
  217    HD3  ARG  33           2HD      ARG  33   5.094  13.953   8.035
  218    HE   ARG  33           HE       ARG  33   4.810  12.525   5.789
  219   HH11  ARG  33          1HH1      ARG  33   4.422  15.924   6.434
  220   HH12  ARG  33          2HH1      ARG  33   4.891  16.413   4.840
  221   HH21  ARG  33          1HH2      ARG  33   5.428  13.156   3.686
  222   HH22  ARG  33          2HH2      ARG  33   5.462  14.838   3.277
  223    H    VAL  34           H        VAL  34   4.320   8.225   8.563
  224    HA   VAL  34           HA       VAL  34   6.338   7.677  10.429
  225    HB   VAL  34           HB       VAL  34   4.568   5.729   8.944
  226   HG11  VAL  34          1HG1      VAL  34   5.053   4.474  11.229
  227   HG12  VAL  34          2HG1      VAL  34   6.107   4.296   9.825
  228   HG13  VAL  34          3HG1      VAL  34   6.551   5.398  11.129
  229   HG21  VAL  34          3HG2      VAL  34   4.116   6.555  11.767
  230   HG22  VAL  34          1HG2      VAL  34   3.642   7.663  10.479
  231   HG23  VAL  34          2HG2      VAL  34   2.958   6.038  10.542
  232    H    HIS  35           H        HIS  35   6.474   7.677   7.067
  233    HA   HIS  35           HA       HIS  35   8.804   5.874   7.063
  234    HB2  HIS  35           1HB      HIS  35   7.004   6.687   4.771
  235    HB3  HIS  35           2HB      HIS  35   8.423   5.655   4.623
  236    HD1  HIS  35           HD1      HIS  35   8.200   3.484   6.462
  237    HD2  HIS  35           HD2      HIS  35   4.760   5.206   4.893
  238    HE1  HIS  35           HE1      HIS  35   6.395   1.756   6.742
  239    H    THR  36           H        THR  36   8.369   8.916   7.568
  240    HA   THR  36           HA       THR  36   9.445  10.529   5.667
  241    HB   THR  36           HB       THR  36  10.670  11.684   7.677
  242    HG1  THR  36           HG1      THR  36   8.851  10.034   9.108
  243   HG21  THR  36          3HG2      THR  36   7.834  11.501   6.938
  244   HG22  THR  36          1HG2      THR  36   8.861  12.919   7.147
  245   HG23  THR  36          2HG2      THR  36   8.132  12.143   8.553
  246    H    GLY  37           H        GLY  37  11.179  10.322   4.418
  247    HA2  GLY  37           1HA      GLY  37  13.766   9.772   5.603
  248    HA3  GLY  37           2HA      GLY  37  13.191   8.534   4.496
  249    H    GLU  38           H        GLU  38  13.413  12.096   4.595
  250    HA   GLU  38           HA       GLU  38  14.476  11.986   1.848
  251    HB2  GLU  38           1HB      GLU  38  12.139  12.971   2.149
  252    HB3  GLU  38           2HB      GLU  38  12.922  14.304   2.986
  253    HG2  GLU  38           1HG      GLU  38  13.880  15.125   1.084
  254    HG3  GLU  38           2HG      GLU  38  13.915  13.552   0.290
  255    H    LYS  39           H        LYS  39  16.148  11.802   4.057
  256    HA   LYS  39           HA       LYS  39  17.753  14.194   3.685
  257    HB2  LYS  39           1HB      LYS  39  18.079  14.579   6.071
  258    HB3  LYS  39           2HB      LYS  39  16.379  14.736   5.648
  259    HG2  LYS  39           1HG      LYS  39  16.227  12.254   6.379
  260    HG3  LYS  39           2HG      LYS  39  17.748  12.589   7.208
  261    HD2  LYS  39           1HD      LYS  39  16.624  14.530   8.314
  262    HD3  LYS  39           2HD      LYS  39  15.104  13.986   7.601
  263    HE2  LYS  39           1HE      LYS  39  16.777  12.115   9.234
  264    HE3  LYS  39           2HE      LYS  39  15.703  13.271  10.020
  265    HZ1  LYS  39           3HZ      LYS  39  14.866  11.251   8.009
  266    HZ2  LYS  39           1HZ      LYS  39  13.846  12.334   8.814
  267    HZ3  LYS  39           2HZ      LYS  39  14.640  11.118   9.680
  268    HA   PRO  40           HA       PRO  40  21.064  11.310   3.778
  269    HB2  PRO  40           1HB      PRO  40  23.093  12.887   4.654
  270    HB3  PRO  40           2HB      PRO  40  22.407  13.018   3.030
  271    HG2  PRO  40           1HG      PRO  40  21.862  14.685   5.456
  272    HG3  PRO  40           2HG      PRO  40  22.101  15.199   3.776
  273    HD2  PRO  40           1HD      PRO  40  19.646  14.989   4.899
  274    HD3  PRO  40           2HD      PRO  40  19.938  14.678   3.175
  275    H    SER  41           H        SER  41  23.023  10.719   5.298
  276    HA   SER  41           HA       SER  41  21.962   9.632   7.644
  277    HB2  SER  41           1HB      SER  41  24.388   9.216   8.249
  278    HB3  SER  41           2HB      SER  41  23.888   8.600   6.674
  279    HG   SER  41           HG       SER  41  25.462  10.863   7.273
  280    H    GLY  42           H        GLY  42  24.039  12.480   7.179
  281    HA2  GLY  42           1HA      GLY  42  24.644  14.157   8.643
  282    HA3  GLY  42           2HA      GLY  42  22.932  14.133   9.040
  283    HA   PRO  43           HA       PRO  43  25.439  11.492  12.283
  284    HB2  PRO  43           1HB      PRO  43  27.987  12.365  12.626
  285    HB3  PRO  43           2HB      PRO  43  27.558  11.074  11.498
  286    HG2  PRO  43           1HG      PRO  43  28.070  13.973  10.954
  287    HG3  PRO  43           2HG      PRO  43  28.611  12.552  10.043
  288    HD2  PRO  43           1HD      PRO  43  26.499  14.060   9.270
  289    HD3  PRO  43           2HD      PRO  43  26.585  12.313   8.969
  290    H    SER  44           H        SER  44  25.129  14.788  11.716
  291    HA   SER  44           HA       SER  44  26.083  16.017  14.008
  292    HB2  SER  44           1HB      SER  44  24.477  17.788  13.569
  293    HB3  SER  44           2HB      SER  44  25.133  17.207  12.039
  294    HG   SER  44           HG       SER  44  22.757  16.108  13.067
  295    H    SER  45           H        SER  45  24.898  16.807  15.892
  296    HA   SER  45           HA       SER  45  23.799  14.787  17.425
  297    HB2  SER  45           1HB      SER  45  24.714  16.920  18.320
  298    HB3  SER  45           2HB      SER  45  23.267  17.751  17.747
  299    HG   SER  45           HG       SER  45  23.578  16.576  20.050
  300    H    GLY  46           H        GLY  46  21.670  14.361  18.171
  301    HA2  GLY  46           1HA      GLY  46  19.613  15.068  16.180
  302    HA3  GLY  46           2HA      GLY  46  19.609  13.606  17.156
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1  -2.786 -19.340   5.295
    2    HA2  GLY   1           1HA      GLY   1  -5.112 -18.576   3.970
    3    HA3  GLY   1           2HA      GLY   1  -5.269 -20.291   4.320
    4    H    SER   2           H        SER   2  -3.950 -17.516   6.128
    5    HA   SER   2           HA       SER   2  -5.560 -18.383   8.431
    6    HB2  SER   2           1HB      SER   2  -2.917 -17.006   8.171
    7    HB3  SER   2           2HB      SER   2  -3.892 -16.709   9.610
    8    HG   SER   2           HG       SER   2  -3.566 -18.707  10.262
    9    H    SER   3           H        SER   3  -7.460 -17.342   7.611
   10    HA   SER   3           HA       SER   3  -7.446 -14.473   7.264
   11    HB2  SER   3           1HB      SER   3  -9.929 -14.797   6.966
   12    HB3  SER   3           2HB      SER   3  -8.929 -15.714   5.839
   13    HG   SER   3           HG       SER   3 -10.096 -17.325   6.537
   14    H    GLY   4           H        GLY   4  -9.219 -16.689   9.437
   15    HA2  GLY   4           1HA      GLY   4  -9.531 -16.457  11.742
   16    HA3  GLY   4           2HA      GLY   4  -8.780 -14.870  11.660
   17    H    SER   5           H        SER   5 -11.065 -15.334  13.160
   18    HA   SER   5           HA       SER   5 -13.466 -14.741  11.795
   19    HB2  SER   5           1HB      SER   5 -13.070 -15.652  14.216
   20    HB3  SER   5           2HB      SER   5 -13.021 -13.945  14.655
   21    HG   SER   5           HG       SER   5 -15.119 -14.303  14.778
   22    H    SER   6           H        SER   6 -13.056 -13.007  10.401
   23    HA   SER   6           HA       SER   6 -13.197 -10.397  11.699
   24    HB2  SER   6           1HB      SER   6 -10.760 -11.073  11.018
   25    HB3  SER   6           2HB      SER   6 -11.310 -10.699   9.385
   26    HG   SER   6           HG       SER   6 -11.666  -8.895  11.529
   27    H    GLY   7           H        GLY   7 -14.019  -8.720  10.325
   28    HA2  GLY   7           1HA      GLY   7 -15.589  -9.810   8.077
   29    HA3  GLY   7           2HA      GLY   7 -16.075  -8.442   9.066
   30    H    SER   8           H        SER   8 -14.436  -6.571   9.011
   31    HA   SER   8           HA       SER   8 -13.981  -5.959   6.202
   32    HB2  SER   8           1HB      SER   8 -13.975  -4.291   8.715
   33    HB3  SER   8           2HB      SER   8 -13.436  -3.650   7.163
   34    HG   SER   8           HG       SER   8 -15.440  -3.506   6.548
   35    H    GLY   9           H        GLY   9 -12.234  -7.883   7.009
   36    HA2  GLY   9           1HA      GLY   9  -9.840  -7.275   8.161
   37    HA3  GLY   9           2HA      GLY   9  -9.987  -8.343   6.773
   38    H    GLU  10           H        GLU  10  -9.871  -7.375   4.631
   39    HA   GLU  10           HA       GLU  10  -7.677  -5.655   4.357
   40    HB2  GLU  10           1HB      GLU  10  -9.836  -6.395   2.377
   41    HB3  GLU  10           2HB      GLU  10  -8.374  -5.515   1.955
   42    HG2  GLU  10           1HG      GLU  10  -7.719  -7.617   1.415
   43    HG3  GLU  10           2HG      GLU  10  -7.210  -7.580   3.102
   44    H    LYS  11           H        LYS  11  -7.732  -3.571   3.098
   45    HA   LYS  11           HA       LYS  11 -10.103  -1.942   3.606
   46    HB2  LYS  11           1HB      LYS  11  -7.381  -1.468   4.783
   47    HB3  LYS  11           2HB      LYS  11  -8.459  -0.118   4.457
   48    HG2  LYS  11           1HG      LYS  11  -9.214  -2.481   6.158
   49    HG3  LYS  11           2HG      LYS  11  -8.528  -0.985   6.796
   50    HD2  LYS  11           1HD      LYS  11 -10.405   0.281   5.944
   51    HD3  LYS  11           2HD      LYS  11 -11.067  -1.162   5.174
   52    HE2  LYS  11           1HE      LYS  11 -11.022  -2.147   7.576
   53    HE3  LYS  11           2HE      LYS  11 -10.921  -0.461   8.080
   54    HZ1  LYS  11           3HZ      LYS  11 -13.102  -1.801   6.600
   55    HZ2  LYS  11           1HZ      LYS  11 -12.946  -0.116   6.617
   56    HZ3  LYS  11           2HZ      LYS  11 -13.187  -0.957   8.064
   57    HA   PRO  12           HA       PRO  12  -9.136  -0.205  -0.311
   58    HB2  PRO  12           1HB      PRO  12 -10.254   2.256  -0.053
   59    HB3  PRO  12           2HB      PRO  12 -11.211   0.781  -0.240
   60    HG2  PRO  12           1HG      PRO  12 -10.546   2.304   2.250
   61    HG3  PRO  12           2HG      PRO  12 -12.090   1.583   1.758
   62    HD2  PRO  12           1HD      PRO  12 -10.426   0.394   3.533
   63    HD3  PRO  12           2HD      PRO  12 -11.458  -0.531   2.423
   64    H    PHE  13           H        PHE  13  -8.470   1.882   2.488
   65    HA   PHE  13           HA       PHE  13  -6.437   3.337   1.012
   66    HB2  PHE  13           1HB      PHE  13  -7.081   3.608   3.947
   67    HB3  PHE  13           2HB      PHE  13  -6.309   4.790   2.895
   68    HD1  PHE  13           HD1      PHE  13  -7.699   5.784   1.007
   69    HD2  PHE  13           HD2      PHE  13  -9.384   3.629   4.268
   70    HE1  PHE  13           HE1      PHE  13  -9.888   6.809   0.550
   71    HE2  PHE  13           HE2      PHE  13 -11.576   4.650   3.815
   72    HZ   PHE  13           HZ       PHE  13 -11.831   6.242   1.953
   73    H    GLN  14           H        GLN  14  -4.758   1.947   0.629
   74    HA   GLN  14           HA       GLN  14  -3.400   0.864   3.010
   75    HB2  GLN  14           1HB      GLN  14  -3.332  -0.270   0.209
   76    HB3  GLN  14           2HB      GLN  14  -2.558  -0.955   1.632
   77    HG2  GLN  14           1HG      GLN  14  -4.656  -1.488   2.616
   78    HG3  GLN  14           2HG      GLN  14  -5.529  -0.579   1.383
   79   HE21  GLN  14          1HE2      GLN  14  -2.816  -2.771   0.916
   80   HE22  GLN  14          2HE2      GLN  14  -3.680  -3.932  -0.027
   81    H    CYS  15           H        CYS  15  -1.228   1.198   3.225
   82    HA   CYS  15           HA       CYS  15  -0.079   3.439   2.009
   83    HB2  CYS  15           1HB      CYS  15   0.535   2.159   4.213
   84    HB3  CYS  15           2HB      CYS  15   1.630   1.265   3.163
   85    H    GLU  16           H        GLU  16   2.229   3.230   0.977
   86    HA   GLU  16           HA       GLU  16   1.997   1.328  -1.261
   87    HB2  GLU  16           1HB      GLU  16   1.898   3.968  -1.549
   88    HB3  GLU  16           2HB      GLU  16   3.648   3.798  -1.506
   89    HG2  GLU  16           1HG      GLU  16   2.018   2.095  -3.339
   90    HG3  GLU  16           2HG      GLU  16   2.410   3.757  -3.775
   91    H    GLU  17           H        GLU  17   3.995   2.544   1.278
   92    HA   GLU  17           HA       GLU  17   6.358   1.160   0.258
   93    HB2  GLU  17           1HB      GLU  17   6.407   3.505   1.298
   94    HB3  GLU  17           2HB      GLU  17   6.177   2.695   2.841
   95    HG2  GLU  17           1HG      GLU  17   8.534   3.225   2.342
   96    HG3  GLU  17           2HG      GLU  17   8.238   1.506   2.598
   97    H    CYS  18           H        CYS  18   3.828   0.815   2.579
   98    HA   CYS  18           HA       CYS  18   5.053  -1.695   3.499
   99    HB2  CYS  18           1HB      CYS  18   4.246  -1.309   5.755
  100    HB3  CYS  18           2HB      CYS  18   5.263   0.040   5.259
  101    H    GLY  19           H        GLY  19   2.514  -0.224   1.972
  102    HA2  GLY  19           1HA      GLY  19   0.303  -0.791   1.580
  103    HA3  GLY  19           2HA      GLY  19   1.009  -2.390   1.401
  104    H    LYS  20           H        LYS  20   0.051  -0.182   4.034
  105    HA   LYS  20           HA       LYS  20  -0.743  -2.471   5.652
  106    HB2  LYS  20           1HB      LYS  20  -0.175   0.397   6.151
  107    HB3  LYS  20           2HB      LYS  20  -1.376  -0.355   7.193
  108    HG2  LYS  20           1HG      LYS  20   0.479  -2.211   7.420
  109    HG3  LYS  20           2HG      LYS  20   1.540  -0.875   6.969
  110    HD2  LYS  20           1HD      LYS  20   1.502  -0.762   9.292
  111    HD3  LYS  20           2HD      LYS  20   0.297   0.436   8.813
  112    HE2  LYS  20           1HE      LYS  20  -1.488  -0.960   9.399
  113    HE3  LYS  20           2HE      LYS  20  -0.473  -2.401   9.412
  114    HZ1  LYS  20           3HZ      LYS  20  -1.125  -1.505  11.645
  115    HZ2  LYS  20           1HZ      LYS  20  -0.124  -0.176  11.337
  116    HZ3  LYS  20           2HZ      LYS  20   0.536  -1.731  11.418
  117    H    ARG  21           H        ARG  21  -2.823  -1.684   7.101
  118    HA   ARG  21           HA       ARG  21  -4.943  -1.082   5.144
  119    HB2  ARG  21           1HB      ARG  21  -4.949  -3.087   7.401
  120    HB3  ARG  21           2HB      ARG  21  -6.407  -2.574   6.562
  121    HG2  ARG  21           1HG      ARG  21  -5.838  -3.662   4.620
  122    HG3  ARG  21           2HG      ARG  21  -4.111  -3.630   4.983
  123    HD2  ARG  21           1HD      ARG  21  -4.359  -5.340   6.636
  124    HD3  ARG  21           2HD      ARG  21  -6.117  -5.262   6.528
  125    HE   ARG  21           HE       ARG  21  -6.030  -6.598   4.667
  126   HH11  ARG  21          1HH1      ARG  21  -2.843  -5.381   5.362
  127   HH12  ARG  21          2HH1      ARG  21  -2.060  -6.394   4.195
  128   HH21  ARG  21          1HH2      ARG  21  -5.011  -7.936   3.127
  129   HH22  ARG  21          2HH2      ARG  21  -3.294  -7.846   2.923
  130    H    PHE  22           H        PHE  22  -6.280   0.536   5.648
  131    HA   PHE  22           HA       PHE  22  -6.502   1.386   8.446
  132    HB2  PHE  22           1HB      PHE  22  -6.007   3.273   6.134
  133    HB3  PHE  22           2HB      PHE  22  -6.262   3.737   7.813
  134    HD1  PHE  22           HD1      PHE  22  -4.548   3.235   9.509
  135    HD2  PHE  22           HD2      PHE  22  -3.897   2.496   5.368
  136    HE1  PHE  22           HE1      PHE  22  -2.128   3.076   9.922
  137    HE2  PHE  22           HE2      PHE  22  -1.475   2.335   5.774
  138    HZ   PHE  22           HZ       PHE  22  -0.588   2.624   8.054
  139    H    THR  23           H        THR  23  -8.416   2.557   8.945
  140    HA   THR  23           HA       THR  23 -10.689   1.701   7.425
  141    HB   THR  23           HB       THR  23 -12.010   2.968   9.120
  142    HG1  THR  23           HG1      THR  23  -9.805   3.368  10.737
  143   HG21  THR  23          3HG2      THR  23 -11.669   0.729   9.694
  144   HG22  THR  23          1HG2      THR  23 -11.112   1.606  11.118
  145   HG23  THR  23          2HG2      THR  23  -9.942   0.962   9.965
  146    H    GLN  24           H        GLN  24  -9.417   4.914   8.313
  147    HA   GLN  24           HA       GLN  24 -10.911   6.034   6.037
  148    HB2  GLN  24           1HB      GLN  24  -9.878   7.426   8.514
  149    HB3  GLN  24           2HB      GLN  24 -10.755   8.200   7.201
  150    HG2  GLN  24           1HG      GLN  24 -11.766   6.219   9.209
  151    HG3  GLN  24           2HG      GLN  24 -12.334   7.858   8.892
  152   HE21  GLN  24          1HE2      GLN  24 -12.804   4.597   8.280
  153   HE22  GLN  24          2HE2      GLN  24 -13.941   4.737   6.987
  154    H    ASN  25           H        ASN  25  -9.815   8.106   5.173
  155    HA   ASN  25           HA       ASN  25  -7.265   7.340   4.149
  156    HB2  ASN  25           1HB      ASN  25  -7.345   9.602   3.043
  157    HB3  ASN  25           2HB      ASN  25  -8.730   8.568   2.703
  158   HD21  ASN  25          1HD2      ASN  25  -8.832  11.283   2.319
  159   HD22  ASN  25          2HD2      ASN  25  -9.912  11.986   3.469
  160    H    SER  26           H        SER  26  -8.352   9.960   6.295
  161    HA   SER  26           HA       SER  26  -6.122  11.374   6.773
  162    HB2  SER  26           1HB      SER  26  -8.423  11.450   7.974
  163    HB3  SER  26           2HB      SER  26  -7.671  10.369   9.147
  164    HG   SER  26           HG       SER  26  -6.901  13.001   8.446
  165    H    HIS  27           H        HIS  27  -6.868   8.338   8.486
  166    HA   HIS  27           HA       HIS  27  -4.617   8.084  10.025
  167    HB2  HIS  27           1HB      HIS  27  -6.318   6.031   8.636
  168    HB3  HIS  27           2HB      HIS  27  -4.931   5.545   9.606
  169    HD1  HIS  27           HD1      HIS  27  -5.550   4.970  11.917
  170    HD2  HIS  27           HD2      HIS  27  -8.073   7.865  10.331
  171    HE1  HIS  27           HE1      HIS  27  -7.233   5.458  13.722
  172    H    LEU  28           H        LEU  28  -4.984   7.315   6.600
  173    HA   LEU  28           HA       LEU  28  -2.357   6.213   6.327
  174    HB2  LEU  28           1HB      LEU  28  -3.825   5.415   4.735
  175    HB3  LEU  28           2HB      LEU  28  -4.545   6.999   4.457
  176    HG   LEU  28           HG       LEU  28  -2.347   7.636   3.349
  177   HD11  LEU  28          1HD1      LEU  28  -1.047   5.757   4.299
  178   HD12  LEU  28          2HD1      LEU  28  -0.943   5.857   2.541
  179   HD13  LEU  28          3HD1      LEU  28  -1.979   4.645   3.296
  180   HD21  LEU  28          3HD2      LEU  28  -3.602   5.412   1.826
  181   HD22  LEU  28          1HD2      LEU  28  -3.183   7.044   1.307
  182   HD23  LEU  28          2HD2      LEU  28  -4.612   6.776   2.306
  183    H    HIS  29           H        HIS  29  -3.817   9.199   5.023
  184    HA   HIS  29           HA       HIS  29  -1.680  10.440   3.942
  185    HB2  HIS  29           1HB      HIS  29  -3.838  11.662   5.667
  186    HB3  HIS  29           2HB      HIS  29  -2.690  12.619   4.735
  187    HD1  HIS  29           HD1      HIS  29  -4.679  13.579   3.344
  188    HD2  HIS  29           HD2      HIS  29  -4.138   9.475   2.991
  189    HE1  HIS  29           HE1      HIS  29  -6.052  12.888   1.353
  190    H    SER  30           H        SER  30  -2.438  10.347   7.404
  191    HA   SER  30           HA       SER  30  -0.085  11.857   8.105
  192    HB2  SER  30           1HB      SER  30  -2.161  12.002   9.446
  193    HB3  SER  30           2HB      SER  30  -1.982  10.302   9.882
  194    HG   SER  30           HG       SER  30   0.240  11.863  10.354
  195    H    HIS  31           H        HIS  31  -1.150   8.485   8.426
  196    HA   HIS  31           HA       HIS  31   0.952   7.386   9.790
  197    HB2  HIS  31           1HB      HIS  31  -0.677   5.827   9.346
  198    HB3  HIS  31           2HB      HIS  31  -0.886   6.361   7.681
  199    HD1  HIS  31           HD1      HIS  31   1.126   4.050   9.808
  200    HD2  HIS  31           HD2      HIS  31   0.824   5.148   5.813
  201    HE1  HIS  31           HE1      HIS  31   2.453   2.333   8.537
  202    H    GLN  32           H        GLN  32   0.805   8.156   6.342
  203    HA   GLN  32           HA       GLN  32   3.081   6.990   5.389
  204    HB2  GLN  32           1HB      GLN  32   1.749   9.596   4.754
  205    HB3  GLN  32           2HB      GLN  32   3.265   9.180   3.968
  206    HG2  GLN  32           1HG      GLN  32   2.337   7.365   2.856
  207    HG3  GLN  32           2HG      GLN  32   0.958   7.278   3.951
  208   HE21  GLN  32          1HE2      GLN  32   0.713   7.281   1.179
  209   HE22  GLN  32          2HE2      GLN  32  -0.083   8.736   0.694
  210    H    ARG  33           H        ARG  33   2.830   9.792   7.468
  211    HA   ARG  33           HA       ARG  33   5.238  11.024   7.262
  212    HB2  ARG  33           1HB      ARG  33   3.594  10.351   9.686
  213    HB3  ARG  33           2HB      ARG  33   5.101  11.244   9.837
  214    HG2  ARG  33           1HG      ARG  33   4.079  12.819   8.066
  215    HG3  ARG  33           2HG      ARG  33   2.549  12.063   8.517
  216    HD2  ARG  33           1HD      ARG  33   2.631  12.890  10.681
  217    HD3  ARG  33           2HD      ARG  33   4.377  13.130  10.628
  218    HE   ARG  33           HE       ARG  33   2.901  14.790   8.795
  219   HH11  ARG  33          1HH1      ARG  33   4.162  14.482  12.025
  220   HH12  ARG  33          2HH1      ARG  33   4.200  16.190  12.313
  221   HH21  ARG  33          1HH2      ARG  33   2.946  17.040   9.162
  222   HH22  ARG  33          2HH2      ARG  33   3.508  17.644  10.684
  223    H    VAL  34           H        VAL  34   4.607   7.890   8.718
  224    HA   VAL  34           HA       VAL  34   6.983   7.436  10.061
  225    HB   VAL  34           HB       VAL  34   6.577   5.067   9.804
  226   HG11  VAL  34          1HG1      VAL  34   4.201   6.828  10.253
  227   HG12  VAL  34          2HG1      VAL  34   4.044   5.072  10.349
  228   HG13  VAL  34          3HG1      VAL  34   5.157   5.920  11.424
  229   HG21  VAL  34          3HG2      VAL  34   4.777   5.930   7.557
  230   HG22  VAL  34          1HG2      VAL  34   6.122   4.790   7.514
  231   HG23  VAL  34          2HG2      VAL  34   4.623   4.353   8.333
  232    H    HIS  35           H        HIS  35   6.252   6.999   6.626
  233    HA   HIS  35           HA       HIS  35   9.002   6.184   6.097
  234    HB2  HIS  35           1HB      HIS  35   6.826   6.544   4.044
  235    HB3  HIS  35           2HB      HIS  35   8.275   5.549   3.934
  236    HD1  HIS  35           HD1      HIS  35   8.270   3.526   5.865
  237    HD2  HIS  35           HD2      HIS  35   4.627   5.103   4.640
  238    HE1  HIS  35           HE1      HIS  35   6.546   1.808   6.499
  239    H    THR  36           H        THR  36   8.047   8.971   6.881
  240    HA   THR  36           HA       THR  36   8.291  10.727   4.719
  241    HB   THR  36           HB       THR  36   7.473  11.410   6.951
  242    HG1  THR  36           HG1      THR  36   8.396  12.937   5.381
  243   HG21  THR  36          3HG2      THR  36  10.294  11.690   7.889
  244   HG22  THR  36          1HG2      THR  36   9.477  10.138   8.070
  245   HG23  THR  36          2HG2      THR  36   8.805  11.583   8.826
  246    H    GLY  37           H        GLY  37  10.686   8.944   6.478
  247    HA2  GLY  37           1HA      GLY  37  12.804   8.594   5.283
  248    HA3  GLY  37           2HA      GLY  37  12.782  10.310   4.906
  249    H    GLU  38           H        GLU  38  12.843   8.072   7.669
  250    HA   GLU  38           HA       GLU  38  14.477  10.057   9.109
  251    HB2  GLU  38           1HB      GLU  38  12.190   9.404  10.061
  252    HB3  GLU  38           2HB      GLU  38  12.911   7.840  10.413
  253    HG2  GLU  38           1HG      GLU  38  14.264  10.315  11.366
  254    HG3  GLU  38           2HG      GLU  38  12.845   9.715  12.222
  255    H    LYS  39           H        LYS  39  16.296   9.349  10.249
  256    HA   LYS  39           HA       LYS  39  17.094   6.633  10.401
  257    HB2  LYS  39           1HB      LYS  39  18.839   6.547   8.782
  258    HB3  LYS  39           2HB      LYS  39  17.396   7.100   7.942
  259    HG2  LYS  39           1HG      LYS  39  18.211   9.231   7.657
  260    HG3  LYS  39           2HG      LYS  39  19.314   9.107   9.030
  261    HD2  LYS  39           1HD      LYS  39  20.735   9.002   7.189
  262    HD3  LYS  39           2HD      LYS  39  20.509   7.306   7.622
  263    HE2  LYS  39           1HE      LYS  39  18.924   8.752   5.505
  264    HE3  LYS  39           2HE      LYS  39  20.347   7.764   5.179
  265    HZ1  LYS  39           3HZ      LYS  39  18.751   6.206   4.887
  266    HZ2  LYS  39           1HZ      LYS  39  17.650   6.948   5.936
  267    HZ3  LYS  39           2HZ      LYS  39  18.928   6.032   6.560
  268    HA   PRO  40           HA       PRO  40  19.639   8.455  13.494
  269    HB2  PRO  40           1HB      PRO  40  21.382   6.412  13.890
  270    HB3  PRO  40           2HB      PRO  40  19.709   6.370  14.456
  271    HG2  PRO  40           1HG      PRO  40  20.912   5.137  12.008
  272    HG3  PRO  40           2HG      PRO  40  19.743   4.447  13.149
  273    HD2  PRO  40           1HD      PRO  40  19.008   5.473  10.754
  274    HD3  PRO  40           2HD      PRO  40  17.962   5.548  12.186
  275    H    SER  41           H        SER  41  21.239   9.893  13.362
  276    HA   SER  41           HA       SER  41  22.929  10.030  11.067
  277    HB2  SER  41           1HB      SER  41  23.840  12.034  12.081
  278    HB3  SER  41           2HB      SER  41  22.091  12.032  12.302
  279    HG   SER  41           HG       SER  41  23.142  10.788  14.379
  280    H    GLY  42           H        GLY  42  23.087   8.071  13.690
  281    HA2  GLY  42           1HA      GLY  42  24.755   6.872  14.725
  282    HA3  GLY  42           2HA      GLY  42  25.555   6.973  13.163
  283    HA   PRO  43           HA       PRO  43  28.158   9.105  16.395
  284    HB2  PRO  43           1HB      PRO  43  30.435   7.737  15.835
  285    HB3  PRO  43           2HB      PRO  43  29.229   7.161  16.992
  286    HG2  PRO  43           1HG      PRO  43  29.649   6.363  14.137
  287    HG3  PRO  43           2HG      PRO  43  29.306   5.342  15.546
  288    HD2  PRO  43           1HD      PRO  43  27.396   6.056  13.764
  289    HD3  PRO  43           2HD      PRO  43  27.048   5.801  15.486
  290    H    SER  44           H        SER  44  29.211   8.008  13.167
  291    HA   SER  44           HA       SER  44  29.746  10.739  12.376
  292    HB2  SER  44           1HB      SER  44  32.108  10.189  11.687
  293    HB3  SER  44           2HB      SER  44  31.854  10.276  13.430
  294    HG   SER  44           HG       SER  44  31.519   7.891  13.220
  295    H    SER  45           H        SER  45  30.785  10.676  10.064
  296    HA   SER  45           HA       SER  45  30.415  10.213   7.866
  297    HB2  SER  45           1HB      SER  45  31.794   8.252   8.393
  298    HB3  SER  45           2HB      SER  45  30.355   7.364   8.891
  299    HG   SER  45           HG       SER  45  30.999   6.898   6.727
  300    H    GLY  46           H        GLY  46  28.147  11.005   9.230
  301    HA2  GLY  46           1HA      GLY  46  25.863   9.632   9.328
  302    HA3  GLY  46           2HA      GLY  46  25.918  11.226   8.591
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1   6.396 -23.020   2.282
    2    HA2  GLY   1           1HA      GLY   1   4.704 -21.847   0.674
    3    HA3  GLY   1           2HA      GLY   1   3.551 -22.790   1.607
    4    H    SER   2           H        SER   2   4.165 -19.817   1.294
    5    HA   SER   2           HA       SER   2   4.095 -19.226   4.170
    6    HB2  SER   2           1HB      SER   2   5.762 -17.806   2.086
    7    HB3  SER   2           2HB      SER   2   5.433 -17.141   3.685
    8    HG   SER   2           HG       SER   2   7.146 -18.246   4.214
    9    H    SER   3           H        SER   3   1.908 -18.855   4.184
   10    HA   SER   3           HA       SER   3   1.047 -16.384   2.882
   11    HB2  SER   3           1HB      SER   3  -0.375 -19.040   2.618
   12    HB3  SER   3           2HB      SER   3  -1.124 -17.490   2.235
   13    HG   SER   3           HG       SER   3   1.340 -18.203   1.078
   14    H    GLY   4           H        GLY   4  -0.816 -15.411   3.859
   15    HA2  GLY   4           1HA      GLY   4  -1.560 -16.533   6.479
   16    HA3  GLY   4           2HA      GLY   4  -1.002 -14.870   6.367
   17    H    SER   5           H        SER   5  -3.674 -16.495   6.868
   18    HA   SER   5           HA       SER   5  -5.373 -14.907   5.075
   19    HB2  SER   5           1HB      SER   5  -5.956 -17.207   4.945
   20    HB3  SER   5           2HB      SER   5  -5.896 -17.398   6.698
   21    HG   SER   5           HG       SER   5  -7.672 -15.496   5.764
   22    H    SER   6           H        SER   6  -5.191 -12.936   6.192
   23    HA   SER   6           HA       SER   6  -6.168 -12.856   8.947
   24    HB2  SER   6           1HB      SER   6  -5.449 -10.461   8.860
   25    HB3  SER   6           2HB      SER   6  -4.140 -11.599   8.546
   26    HG   SER   6           HG       SER   6  -4.010 -10.919   6.540
   27    H    GLY   7           H        GLY   7  -6.839 -11.381   5.781
   28    HA2  GLY   7           1HA      GLY   7  -8.806 -10.598   4.885
   29    HA3  GLY   7           2HA      GLY   7  -9.648 -11.441   6.177
   30    H    SER   8           H        SER   8 -10.264 -10.335   8.012
   31    HA   SER   8           HA       SER   8 -11.108  -8.514   9.103
   32    HB2  SER   8           1HB      SER   8  -8.246  -7.691   8.600
   33    HB3  SER   8           2HB      SER   8  -9.345  -6.750   9.609
   34    HG   SER   8           HG       SER   8  -9.652  -8.791  10.799
   35    H    GLY   9           H        GLY   9 -11.760  -8.545   6.368
   36    HA2  GLY   9           1HA      GLY   9 -12.634  -7.188   4.736
   37    HA3  GLY   9           2HA      GLY   9 -12.735  -5.958   5.988
   38    H    GLU  10           H        GLU  10 -10.870  -7.209   3.329
   39    HA   GLU  10           HA       GLU  10  -8.518  -5.835   3.456
   40    HB2  GLU  10           1HB      GLU  10 -10.277  -6.376   1.065
   41    HB3  GLU  10           2HB      GLU  10  -8.659  -5.701   0.926
   42    HG2  GLU  10           1HG      GLU  10  -9.482  -8.424   1.854
   43    HG3  GLU  10           2HG      GLU  10  -8.379  -7.981   0.552
   44    H    LYS  11           H        LYS  11  -8.623  -3.830   4.410
   45    HA   LYS  11           HA       LYS  11 -10.407  -1.780   3.882
   46    HB2  LYS  11           1HB      LYS  11  -7.488  -1.587   4.647
   47    HB3  LYS  11           2HB      LYS  11  -8.632  -0.253   4.726
   48    HG2  LYS  11           1HG      LYS  11  -9.313  -2.761   6.162
   49    HG3  LYS  11           2HG      LYS  11  -8.055  -1.723   6.838
   50    HD2  LYS  11           1HD      LYS  11  -9.519   0.043   7.182
   51    HD3  LYS  11           2HD      LYS  11 -10.675  -0.552   5.988
   52    HE2  LYS  11           1HE      LYS  11 -11.697  -0.984   8.046
   53    HE3  LYS  11           2HE      LYS  11 -11.006  -2.535   7.571
   54    HZ1  LYS  11           3HZ      LYS  11 -10.604  -1.238   9.945
   55    HZ2  LYS  11           1HZ      LYS  11  -9.167  -0.971   9.091
   56    HZ3  LYS  11           2HZ      LYS  11  -9.711  -2.550   9.358
   57    HA   PRO  12           HA       PRO  12  -9.469  -0.411  -0.197
   58    HB2  PRO  12           1HB      PRO  12 -10.444   2.117  -0.030
   59    HB3  PRO  12           2HB      PRO  12 -11.484   0.691  -0.127
   60    HG2  PRO  12           1HG      PRO  12 -10.676   2.288   2.273
   61    HG3  PRO  12           2HG      PRO  12 -12.268   1.632   1.850
   62    HD2  PRO  12           1HD      PRO  12 -10.629   0.435   3.642
   63    HD3  PRO  12           2HD      PRO  12 -11.737  -0.482   2.600
   64    H    PHE  13           H        PHE  13  -8.689   1.866   2.430
   65    HA   PHE  13           HA       PHE  13  -6.624   3.137   0.869
   66    HB2  PHE  13           1HB      PHE  13  -7.041   3.485   3.831
   67    HB3  PHE  13           2HB      PHE  13  -6.371   4.634   2.677
   68    HD1  PHE  13           HD1      PHE  13  -7.839   5.861   1.152
   69    HD2  PHE  13           HD2      PHE  13  -9.399   3.251   4.130
   70    HE1  PHE  13           HE1      PHE  13 -10.059   6.886   0.882
   71    HE2  PHE  13           HE2      PHE  13 -11.622   4.271   3.865
   72    HZ   PHE  13           HZ       PHE  13 -11.954   6.091   2.239
   73    H    GLN  14           H        GLN  14  -4.682   2.279   0.597
   74    HA   GLN  14           HA       GLN  14  -3.395   0.928   2.858
   75    HB2  GLN  14           1HB      GLN  14  -3.620  -0.156   0.049
   76    HB3  GLN  14           2HB      GLN  14  -2.482  -0.772   1.240
   77    HG2  GLN  14           1HG      GLN  14  -4.426  -1.269   2.724
   78    HG3  GLN  14           2HG      GLN  14  -5.483  -0.835   1.381
   79   HE21  GLN  14          1HE2      GLN  14  -2.501  -2.736   1.701
   80   HE22  GLN  14          2HE2      GLN  14  -3.112  -4.144   0.907
   81    H    CYS  15           H        CYS  15  -1.225   1.274   3.042
   82    HA   CYS  15           HA       CYS  15  -0.102   3.532   1.838
   83    HB2  CYS  15           1HB      CYS  15   0.553   2.144   4.000
   84    HB3  CYS  15           2HB      CYS  15   1.684   1.381   2.887
   85    H    GLU  16           H        GLU  16   2.284   3.217   0.852
   86    HA   GLU  16           HA       GLU  16   1.962   1.417  -1.460
   87    HB2  GLU  16           1HB      GLU  16   1.941   4.065  -1.677
   88    HB3  GLU  16           2HB      GLU  16   3.685   3.843  -1.643
   89    HG2  GLU  16           1HG      GLU  16   2.838   3.932  -3.921
   90    HG3  GLU  16           2HG      GLU  16   3.559   2.364  -3.561
   91    H    GLU  17           H        GLU  17   4.000   2.495   1.107
   92    HA   GLU  17           HA       GLU  17   6.307   1.045   0.041
   93    HB2  GLU  17           1HB      GLU  17   6.501   3.372   1.055
   94    HB3  GLU  17           2HB      GLU  17   6.186   2.616   2.611
   95    HG2  GLU  17           1HG      GLU  17   8.581   2.984   2.167
   96    HG3  GLU  17           2HG      GLU  17   8.174   1.290   2.439
   97    H    CYS  18           H        CYS  18   3.790   0.786   2.384
   98    HA   CYS  18           HA       CYS  18   4.977  -1.732   3.346
   99    HB2  CYS  18           1HB      CYS  18   4.024  -1.327   5.553
  100    HB3  CYS  18           2HB      CYS  18   5.093  -0.002   5.102
  101    H    GLY  19           H        GLY  19   2.338  -0.130   1.939
  102    HA2  GLY  19           1HA      GLY  19   0.262  -0.834   1.259
  103    HA3  GLY  19           2HA      GLY  19   0.929  -2.458   1.333
  104    H    LYS  20           H        LYS  20   0.778  -0.432   4.162
  105    HA   LYS  20           HA       LYS  20  -0.548  -2.343   5.716
  106    HB2  LYS  20           1HB      LYS  20   0.217   0.498   6.026
  107    HB3  LYS  20           2HB      LYS  20  -1.084  -0.062   7.069
  108    HG2  LYS  20           1HG      LYS  20   0.619  -2.051   7.489
  109    HG3  LYS  20           2HG      LYS  20   1.784  -0.803   7.042
  110    HD2  LYS  20           1HD      LYS  20   1.665  -0.413   9.288
  111    HD3  LYS  20           2HD      LYS  20   0.345   0.627   8.749
  112    HE2  LYS  20           1HE      LYS  20  -0.215  -2.224   9.431
  113    HE3  LYS  20           2HE      LYS  20  -0.001  -1.051  10.730
  114    HZ1  LYS  20           3HZ      LYS  20  -2.204  -1.389   8.907
  115    HZ2  LYS  20           1HZ      LYS  20  -1.699   0.218   9.064
  116    HZ3  LYS  20           2HZ      LYS  20  -2.164  -0.660  10.433
  117    H    ARG  21           H        ARG  21  -2.602  -1.328   7.060
  118    HA   ARG  21           HA       ARG  21  -4.633  -0.640   5.044
  119    HB2  ARG  21           1HB      ARG  21  -5.030  -2.574   7.332
  120    HB3  ARG  21           2HB      ARG  21  -6.211  -2.149   6.100
  121    HG2  ARG  21           1HG      ARG  21  -5.160  -3.390   4.470
  122    HG3  ARG  21           2HG      ARG  21  -3.597  -3.333   5.288
  123    HD2  ARG  21           1HD      ARG  21  -5.968  -4.790   6.426
  124    HD3  ARG  21           2HD      ARG  21  -4.831  -5.555   5.317
  125    HE   ARG  21           HE       ARG  21  -3.226  -4.543   7.242
  126   HH11  ARG  21          1HH1      ARG  21  -6.058  -6.566   7.311
  127   HH12  ARG  21          2HH1      ARG  21  -5.584  -7.405   8.751
  128   HH21  ARG  21          1HH2      ARG  21  -2.591  -5.639   9.139
  129   HH22  ARG  21          2HH2      ARG  21  -3.612  -6.876   9.790
  130    H    PHE  22           H        PHE  22  -6.426   0.563   5.799
  131    HA   PHE  22           HA       PHE  22  -6.470   1.497   8.533
  132    HB2  PHE  22           1HB      PHE  22  -5.961   3.451   6.278
  133    HB3  PHE  22           2HB      PHE  22  -6.249   3.873   7.963
  134    HD1  PHE  22           HD2      PHE  22  -3.878   2.284   5.635
  135    HD2  PHE  22           HD1      PHE  22  -4.517   3.763   9.575
  136    HE1  PHE  22           HE2      PHE  22  -1.464   2.128   6.082
  137    HE2  PHE  22           HE1      PHE  22  -2.103   3.610  10.028
  138    HZ   PHE  22           HZ       PHE  22  -0.573   2.790   8.280
  139    H    THR  23           H        THR  23  -8.440   2.344   9.135
  140    HA   THR  23           HA       THR  23 -10.612   1.877   7.257
  141    HB   THR  23           HB       THR  23 -10.824   0.980   9.531
  142    HG1  THR  23           HG1      THR  23 -12.627   3.019   8.726
  143   HG21  THR  23          3HG2      THR  23 -10.081   3.710  10.242
  144   HG22  THR  23          1HG2      THR  23  -9.969   2.226  11.188
  145   HG23  THR  23          2HG2      THR  23 -11.487   3.122  11.130
  146    H    GLN  24           H        GLN  24  -8.666   4.423   7.939
  147    HA   GLN  24           HA       GLN  24 -10.711   6.334   7.069
  148    HB2  GLN  24           1HB      GLN  24 -10.466   6.606   9.497
  149    HB3  GLN  24           2HB      GLN  24  -8.734   6.833   9.301
  150    HG2  GLN  24           1HG      GLN  24  -9.588   8.984   9.556
  151    HG3  GLN  24           2HG      GLN  24  -9.325   8.815   7.822
  152   HE21  GLN  24          1HE2      GLN  24 -11.567   9.458  10.283
  153   HE22  GLN  24          2HE2      GLN  24 -12.979   9.578   9.297
  154    H    ASN  25           H        ASN  25 -10.068   7.528   5.396
  155    HA   ASN  25           HA       ASN  25  -7.692   7.112   4.037
  156    HB2  ASN  25           1HB      ASN  25  -8.237   9.253   2.835
  157    HB3  ASN  25           2HB      ASN  25  -9.561   8.092   2.895
  158   HD21  ASN  25          1HD2      ASN  25  -8.846  11.250   3.165
  159   HD22  ASN  25          2HD2      ASN  25 -10.146  11.772   4.177
  160    H    SER  26           H        SER  26  -8.543   9.900   6.090
  161    HA   SER  26           HA       SER  26  -6.163  11.290   5.930
  162    HB2  SER  26           1HB      SER  26  -8.194  11.039   8.140
  163    HB3  SER  26           2HB      SER  26  -6.772  12.067   8.317
  164    HG   SER  26           HG       SER  26  -7.572  13.442   6.912
  165    H    HIS  27           H        HIS  27  -7.043   8.710   8.205
  166    HA   HIS  27           HA       HIS  27  -4.844   8.676   9.840
  167    HB2  HIS  27           1HB      HIS  27  -6.700   6.569   8.845
  168    HB3  HIS  27           2HB      HIS  27  -5.241   6.044   9.680
  169    HD1  HIS  27           HD1      HIS  27  -6.724   5.143  11.629
  170    HD2  HIS  27           HD2      HIS  27  -6.953   9.248  11.031
  171    HE1  HIS  27           HE1      HIS  27  -7.835   6.062  13.690
  172    H    LEU  28           H        LEU  28  -5.163   7.160   6.649
  173    HA   LEU  28           HA       LEU  28  -2.599   5.973   6.620
  174    HB2  LEU  28           1HB      LEU  28  -4.165   5.118   5.101
  175    HB3  LEU  28           2HB      LEU  28  -4.566   6.719   4.483
  176    HG   LEU  28           HG       LEU  28  -2.235   6.783   3.501
  177   HD11  LEU  28          1HD1      LEU  28  -0.814   5.176   4.058
  178   HD12  LEU  28          2HD1      LEU  28  -1.831   4.023   3.194
  179   HD13  LEU  28          3HD1      LEU  28  -2.079   4.298   4.918
  180   HD21  LEU  28          3HD2      LEU  28  -2.863   5.307   1.600
  181   HD22  LEU  28          1HD2      LEU  28  -4.139   6.422   2.089
  182   HD23  LEU  28          2HD2      LEU  28  -4.225   4.724   2.558
  183    H    HIS  29           H        HIS  29  -3.799   8.936   5.040
  184    HA   HIS  29           HA       HIS  29  -1.523   9.848   3.852
  185    HB2  HIS  29           1HB      HIS  29  -3.804  11.262   5.175
  186    HB3  HIS  29           2HB      HIS  29  -2.434  12.203   4.595
  187    HD1  HIS  29           HD1      HIS  29  -5.290  12.442   3.372
  188    HD2  HIS  29           HD2      HIS  29  -2.231  10.083   1.843
  189    HE1  HIS  29           HE1      HIS  29  -5.840  12.123   0.939
  190    H    SER  30           H        SER  30  -2.436  10.312   7.252
  191    HA   SER  30           HA       SER  30  -0.088  11.776   7.925
  192    HB2  SER  30           1HB      SER  30  -2.078  10.306   9.669
  193    HB3  SER  30           2HB      SER  30  -0.805  11.363  10.279
  194    HG   SER  30           HG       SER  30  -1.922  12.866   8.588
  195    H    HIS  31           H        HIS  31  -1.051   8.386   8.251
  196    HA   HIS  31           HA       HIS  31   1.027   7.390   9.751
  197    HB2  HIS  31           1HB      HIS  31  -0.509   5.751   9.310
  198    HB3  HIS  31           2HB      HIS  31  -0.738   6.264   7.641
  199    HD1  HIS  31           HD1      HIS  31   1.440   4.107   9.792
  200    HD2  HIS  31           HD2      HIS  31   0.932   5.037   5.775
  201    HE1  HIS  31           HE1      HIS  31   2.808   2.414   8.532
  202    H    GLN  32           H        GLN  32   0.965   8.010   6.264
  203    HA   GLN  32           HA       GLN  32   3.303   6.902   5.424
  204    HB2  GLN  32           1HB      GLN  32   2.211   9.620   4.679
  205    HB3  GLN  32           2HB      GLN  32   3.463   8.768   3.784
  206    HG2  GLN  32           1HG      GLN  32   1.937   7.002   3.224
  207    HG3  GLN  32           2HG      GLN  32   0.687   7.707   4.247
  208   HE21  GLN  32          1HE2      GLN  32  -0.599   7.613   2.288
  209   HE22  GLN  32          2HE2      GLN  32  -0.477   8.895   1.137
  210    H    ARG  33           H        ARG  33   2.916   9.828   7.329
  211    HA   ARG  33           HA       ARG  33   5.360  11.022   7.163
  212    HB2  ARG  33           1HB      ARG  33   3.541  10.610   9.524
  213    HB3  ARG  33           2HB      ARG  33   5.037  11.524   9.672
  214    HG2  ARG  33           1HG      ARG  33   4.034  12.791   7.573
  215    HG3  ARG  33           2HG      ARG  33   2.520  12.212   8.269
  216    HD2  ARG  33           1HD      ARG  33   2.904  13.352  10.300
  217    HD3  ARG  33           2HD      ARG  33   4.595  13.651   9.899
  218    HE   ARG  33           HE       ARG  33   3.340  14.976   7.948
  219   HH11  ARG  33          1HH1      ARG  33   2.821  14.917  11.390
  220   HH12  ARG  33          2HH1      ARG  33   2.229  16.543  11.460
  221   HH21  ARG  33          1HH2      ARG  33   2.562  17.119   8.027
  222   HH22  ARG  33          2HH2      ARG  33   2.082  17.795   9.547
  223    H    VAL  34           H        VAL  34   4.532   8.152   9.057
  224    HA   VAL  34           HA       VAL  34   6.816   7.794  10.538
  225    HB   VAL  34           HB       VAL  34   6.351   5.427  10.571
  226   HG11  VAL  34          1HG1      VAL  34   3.966   5.461  11.188
  227   HG12  VAL  34          2HG1      VAL  34   4.852   6.833  11.856
  228   HG13  VAL  34          3HG1      VAL  34   3.814   7.054  10.448
  229   HG21  VAL  34          3HG2      VAL  34   4.999   6.026   7.999
  230   HG22  VAL  34          1HG2      VAL  34   5.967   4.630   8.474
  231   HG23  VAL  34          2HG2      VAL  34   4.295   4.769   9.016
  232    H    HIS  35           H        HIS  35   6.307   7.111   7.123
  233    HA   HIS  35           HA       HIS  35   8.782   5.753   6.729
  234    HB2  HIS  35           1HB      HIS  35   6.912   7.102   4.772
  235    HB3  HIS  35           2HB      HIS  35   8.308   6.135   4.303
  236    HD1  HIS  35           HD1      HIS  35   8.032   3.704   6.066
  237    HD2  HIS  35           HD2      HIS  35   4.795   5.519   4.198
  238    HE1  HIS  35           HE1      HIS  35   6.258   1.927   5.917
  239    H    THR  36           H        THR  36   7.808   9.082   6.782
  240    HA   THR  36           HA       THR  36   8.905  11.037   6.276
  241    HB   THR  36           HB       THR  36  11.402  10.850   7.203
  242    HG1  THR  36           HG1      THR  36  11.370   8.595   7.468
  243   HG21  THR  36          3HG2      THR  36   9.502  12.151   8.156
  244   HG22  THR  36          1HG2      THR  36  10.563  11.452   9.378
  245   HG23  THR  36          2HG2      THR  36   9.005  10.703   9.031
  246    H    GLY  37           H        GLY  37   8.930   9.152   4.098
  247    HA2  GLY  37           1HA      GLY  37  11.524   9.843   2.861
  248    HA3  GLY  37           2HA      GLY  37  10.654   8.359   2.506
  249    H    GLU  38           H        GLU  38   9.585  11.748   2.722
  250    HA   GLU  38           HA       GLU  38   8.540  11.473  -0.020
  251    HB2  GLU  38           1HB      GLU  38   7.421  12.729   2.435
  252    HB3  GLU  38           2HB      GLU  38   7.078  13.506   0.896
  253    HG2  GLU  38           1HG      GLU  38   6.075  11.480   0.051
  254    HG3  GLU  38           2HG      GLU  38   6.503  10.621   1.530
  255    H    LYS  39           H        LYS  39   9.556  12.652  -1.486
  256    HA   LYS  39           HA       LYS  39  11.305  14.818  -0.666
  257    HB2  LYS  39           1HB      LYS  39  11.995  14.839  -3.042
  258    HB3  LYS  39           2HB      LYS  39  12.151  13.249  -2.307
  259    HG2  LYS  39           1HG      LYS  39  10.053  12.560  -3.359
  260    HG3  LYS  39           2HG      LYS  39   9.911  14.152  -4.108
  261    HD2  LYS  39           1HD      LYS  39  11.855  13.792  -5.431
  262    HD3  LYS  39           2HD      LYS  39  12.279  12.337  -4.527
  263    HE2  LYS  39           1HE      LYS  39  11.342  11.486  -6.472
  264    HE3  LYS  39           2HE      LYS  39   9.994  11.447  -5.336
  265    HZ1  LYS  39           3HZ      LYS  39   9.877  12.533  -7.779
  266    HZ2  LYS  39           1HZ      LYS  39  10.244  13.899  -6.850
  267    HZ3  LYS  39           2HZ      LYS  39   8.869  12.980  -6.496
  268    HA   PRO  40           HA       PRO  40   8.477  18.077  -1.544
  269    HB2  PRO  40           1HB      PRO  40  10.255  20.077  -2.001
  270    HB3  PRO  40           2HB      PRO  40   9.921  19.439  -0.387
  271    HG2  PRO  40           1HG      PRO  40  12.193  18.820  -2.235
  272    HG3  PRO  40           2HG      PRO  40  12.220  19.108  -0.486
  273    HD2  PRO  40           1HD      PRO  40  12.308  16.622  -1.555
  274    HD3  PRO  40           2HD      PRO  40  11.532  16.964   0.005
  275    H    SER  41           H        SER  41  11.079  17.336  -3.789
  276    HA   SER  41           HA       SER  41   9.388  17.543  -6.052
  277    HB2  SER  41           1HB      SER  41  10.345  19.470  -7.158
  278    HB3  SER  41           2HB      SER  41   9.750  19.972  -5.576
  279    HG   SER  41           HG       SER  41  11.698  20.598  -5.149
  280    H    GLY  42           H        GLY  42  10.178  16.257  -7.601
  281    HA2  GLY  42           1HA      GLY  42  12.902  15.242  -7.266
  282    HA3  GLY  42           2HA      GLY  42  11.636  14.510  -8.240
  283    HA   PRO  43           HA       PRO  43  14.685  16.846 -10.942
  284    HB2  PRO  43           1HB      PRO  43  15.451  14.710 -12.433
  285    HB3  PRO  43           2HB      PRO  43  16.258  15.171 -10.929
  286    HG2  PRO  43           1HG      PRO  43  14.196  13.052 -11.399
  287    HG3  PRO  43           2HG      PRO  43  15.672  12.980 -10.419
  288    HD2  PRO  43           1HD      PRO  43  13.221  13.371  -9.336
  289    HD3  PRO  43           2HD      PRO  43  14.696  14.075  -8.641
  290    H    SER  44           H        SER  44  14.586  17.033 -13.325
  291    HA   SER  44           HA       SER  44  12.035  17.411 -14.282
  292    HB2  SER  44           1HB      SER  44  14.685  17.048 -15.639
  293    HB3  SER  44           2HB      SER  44  13.219  17.172 -16.612
  294    HG   SER  44           HG       SER  44  12.980  19.110 -14.952
  295    H    SER  45           H        SER  45  14.177  14.661 -15.023
  296    HA   SER  45           HA       SER  45  11.987  13.224 -16.267
  297    HB2  SER  45           1HB      SER  45  13.667  11.515 -16.774
  298    HB3  SER  45           2HB      SER  45  14.252  13.112 -17.242
  299    HG   SER  45           HG       SER  45  15.587  13.137 -15.487
  300    H    GLY  46           H        GLY  46  11.563  10.939 -15.643
  301    HA2  GLY  46           1HA      GLY  46  11.768  10.598 -12.714
  302    HA3  GLY  46           2HA      GLY  46  10.303  10.218 -13.607
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1  15.173  -9.696  -6.025
    2    HA2  GLY   1           1HA      GLY   1  12.939  -9.122  -6.043
    3    HA3  GLY   1           2HA      GLY   1  13.268  -8.736  -7.726
    4    H    SER   2           H        SER   2  12.418 -11.444  -5.592
    5    HA   SER   2           HA       SER   2  11.066 -12.725  -7.868
    6    HB2  SER   2           1HB      SER   2  11.133 -14.791  -6.514
    7    HB3  SER   2           2HB      SER   2  12.746 -14.126  -6.768
    8    HG   SER   2           HG       SER   2  12.760 -14.452  -4.651
    9    H    SER   3           H        SER   3   9.803 -10.539  -6.716
   10    HA   SER   3           HA       SER   3   7.672 -11.735  -5.078
   11    HB2  SER   3           1HB      SER   3   7.133  -9.492  -4.339
   12    HB3  SER   3           2HB      SER   3   8.864  -9.756  -4.129
   13    HG   SER   3           HG       SER   3   7.634  -7.866  -5.550
   14    H    GLY   4           H        GLY   4   5.454 -10.934  -5.497
   15    HA2  GLY   4           1HA      GLY   4   4.339  -9.567  -7.459
   16    HA3  GLY   4           2HA      GLY   4   4.969 -10.924  -8.380
   17    H    SER   5           H        SER   5   2.261  -9.763  -6.997
   18    HA   SER   5           HA       SER   5   0.924 -12.300  -7.145
   19    HB2  SER   5           1HB      SER   5   0.150 -12.439  -4.877
   20    HB3  SER   5           2HB      SER   5   1.905 -12.282  -4.821
   21    HG   SER   5           HG       SER   5   1.060 -10.859  -3.342
   22    H    SER   6           H        SER   6  -1.454 -12.037  -6.604
   23    HA   SER   6           HA       SER   6  -2.442  -9.309  -6.858
   24    HB2  SER   6           1HB      SER   6  -2.036 -10.432  -9.182
   25    HB3  SER   6           2HB      SER   6  -3.496 -11.344  -8.798
   26    HG   SER   6           HG       SER   6  -3.485  -9.059  -9.901
   27    H    GLY   7           H        GLY   7  -4.689  -9.090  -6.374
   28    HA2  GLY   7           1HA      GLY   7  -6.542 -11.038  -5.858
   29    HA3  GLY   7           2HA      GLY   7  -5.578 -10.963  -4.391
   30    H    SER   8           H        SER   8  -7.391 -10.256  -3.203
   31    HA   SER   8           HA       SER   8  -8.284  -7.519  -3.821
   32    HB2  SER   8           1HB      SER   8  -9.656  -9.674  -2.196
   33    HB3  SER   8           2HB      SER   8 -10.273  -8.039  -2.431
   34    HG   SER   8           HG       SER   8  -9.887 -10.053  -4.385
   35    H    GLY   9           H        GLY   9  -8.806  -6.164  -1.900
   36    HA2  GLY   9           1HA      GLY   9  -6.840  -6.665   0.248
   37    HA3  GLY   9           2HA      GLY   9  -7.236  -5.064  -0.359
   38    H    GLU  10           H        GLU  10  -7.350  -5.952   2.372
   39    HA   GLU  10           HA       GLU  10 -10.069  -6.447   3.095
   40    HB2  GLU  10           1HB      GLU  10  -7.647  -5.604   4.683
   41    HB3  GLU  10           2HB      GLU  10  -9.225  -5.851   5.417
   42    HG2  GLU  10           1HG      GLU  10  -8.063  -7.848   5.766
   43    HG3  GLU  10           2HG      GLU  10  -9.163  -8.182   4.430
   44    H    LYS  11           H        LYS  11  -7.997  -3.585   2.998
   45    HA   LYS  11           HA       LYS  11 -10.406  -1.928   3.367
   46    HB2  LYS  11           1HB      LYS  11  -7.614  -1.515   4.424
   47    HB3  LYS  11           2HB      LYS  11  -8.772  -0.197   4.304
   48    HG2  LYS  11           1HG      LYS  11  -9.393  -2.728   5.790
   49    HG3  LYS  11           2HG      LYS  11  -8.560  -1.369   6.548
   50    HD2  LYS  11           1HD      LYS  11 -10.417   0.070   6.215
   51    HD3  LYS  11           2HD      LYS  11 -11.201  -1.082   5.131
   52    HE2  LYS  11           1HE      LYS  11 -12.280  -1.120   7.297
   53    HE3  LYS  11           2HE      LYS  11 -11.449  -2.649   7.013
   54    HZ1  LYS  11           3HZ      LYS  11 -10.314  -2.344   8.871
   55    HZ2  LYS  11           1HZ      LYS  11 -11.133  -0.891   9.157
   56    HZ3  LYS  11           2HZ      LYS  11  -9.680  -0.887   8.290
   57    HA   PRO  12           HA       PRO  12  -9.494  -0.017  -0.481
   58    HB2  PRO  12           1HB      PRO  12 -10.472   2.479  -0.053
   59    HB3  PRO  12           2HB      PRO  12 -11.510   1.066  -0.277
   60    HG2  PRO  12           1HG      PRO  12 -10.675   2.421   2.259
   61    HG3  PRO  12           2HG      PRO  12 -12.271   1.805   1.793
   62    HD2  PRO  12           1HD      PRO  12 -10.607   0.442   3.437
   63    HD3  PRO  12           2HD      PRO  12 -11.726  -0.371   2.324
   64    H    PHE  13           H        PHE  13  -8.609   1.872   2.396
   65    HA   PHE  13           HA       PHE  13  -6.524   3.252   0.901
   66    HB2  PHE  13           1HB      PHE  13  -7.100   3.562   3.842
   67    HB3  PHE  13           2HB      PHE  13  -6.329   4.712   2.754
   68    HD1  PHE  13           HD1      PHE  13  -7.909   5.338   0.658
   69    HD2  PHE  13           HD2      PHE  13  -9.233   4.056   4.495
   70    HE1  PHE  13           HE1      PHE  13 -10.080   6.428   0.269
   71    HE2  PHE  13           HE2      PHE  13 -11.407   5.143   4.112
   72    HZ   PHE  13           HZ       PHE  13 -11.833   6.330   1.997
   73    H    GLN  14           H        GLN  14  -4.485   2.588   0.852
   74    HA   GLN  14           HA       GLN  14  -3.353   1.147   3.113
   75    HB2  GLN  14           1HB      GLN  14  -3.268   0.011   0.313
   76    HB3  GLN  14           2HB      GLN  14  -2.508  -0.680   1.740
   77    HG2  GLN  14           1HG      GLN  14  -4.822  -0.857   2.732
   78    HG3  GLN  14           2HG      GLN  14  -5.437  -0.464   1.127
   79   HE21  GLN  14          1HE2      GLN  14  -2.853  -2.556   2.373
   80   HE22  GLN  14          2HE2      GLN  14  -3.365  -3.976   1.533
   81    H    CYS  15           H        CYS  15  -1.112   1.283   3.257
   82    HA   CYS  15           HA       CYS  15   0.077   3.572   2.141
   83    HB2  CYS  15           1HB      CYS  15   0.671   2.113   4.273
   84    HB3  CYS  15           2HB      CYS  15   1.784   1.339   3.149
   85    H    GLU  16           H        GLU  16   2.421   3.260   1.125
   86    HA   GLU  16           HA       GLU  16   2.089   1.478  -1.200
   87    HB2  GLU  16           1HB      GLU  16   2.055   4.123  -1.404
   88    HB3  GLU  16           2HB      GLU  16   3.800   3.915  -1.368
   89    HG2  GLU  16           1HG      GLU  16   3.750   2.543  -3.318
   90    HG3  GLU  16           2HG      GLU  16   1.988   2.486  -3.294
   91    H    GLU  17           H        GLU  17   4.172   2.598   1.331
   92    HA   GLU  17           HA       GLU  17   6.465   1.145   0.249
   93    HB2  GLU  17           1HB      GLU  17   6.193   2.902   2.694
   94    HB3  GLU  17           2HB      GLU  17   7.683   2.119   2.189
   95    HG2  GLU  17           1HG      GLU  17   7.911   3.473   0.317
   96    HG3  GLU  17           2HG      GLU  17   6.213   3.946   0.334
   97    H    CYS  18           H        CYS  18   3.955   0.834   2.586
   98    HA   CYS  18           HA       CYS  18   5.120  -1.718   3.464
   99    HB2  CYS  18           1HB      CYS  18   4.402  -1.338   5.739
  100    HB3  CYS  18           2HB      CYS  18   5.410   0.014   5.233
  101    H    GLY  19           H        GLY  19   2.660  -0.230   1.907
  102    HA2  GLY  19           1HA      GLY  19   0.403  -0.689   1.586
  103    HA3  GLY  19           2HA      GLY  19   1.059  -2.305   1.370
  104    H    LYS  20           H        LYS  20  -0.033  -0.077   3.917
  105    HA   LYS  20           HA       LYS  20  -0.755  -2.368   5.585
  106    HB2  LYS  20           1HB      LYS  20  -0.183   0.496   6.068
  107    HB3  LYS  20           2HB      LYS  20  -1.414  -0.226   7.094
  108    HG2  LYS  20           1HG      LYS  20   0.422  -2.105   7.369
  109    HG3  LYS  20           2HG      LYS  20   1.499  -0.771   6.948
  110    HD2  LYS  20           1HD      LYS  20   1.406  -0.628   9.259
  111    HD3  LYS  20           2HD      LYS  20   0.177   0.536   8.758
  112    HE2  LYS  20           1HE      LYS  20  -1.580  -1.002   9.224
  113    HE3  LYS  20           2HE      LYS  20  -0.441  -2.328   9.451
  114    HZ1  LYS  20           3HZ      LYS  20  -0.289  -1.806  11.582
  115    HZ2  LYS  20           1HZ      LYS  20  -1.429  -0.574  11.374
  116    HZ3  LYS  20           2HZ      LYS  20   0.220  -0.237  11.208
  117    H    ARG  21           H        ARG  21  -2.849  -1.590   7.015
  118    HA   ARG  21           HA       ARG  21  -4.954  -0.901   5.076
  119    HB2  ARG  21           1HB      ARG  21  -4.993  -3.115   7.131
  120    HB3  ARG  21           2HB      ARG  21  -6.421  -2.554   6.272
  121    HG2  ARG  21           1HG      ARG  21  -5.797  -3.523   4.312
  122    HG3  ARG  21           2HG      ARG  21  -4.073  -3.364   4.654
  123    HD2  ARG  21           1HD      ARG  21  -5.935  -5.297   6.029
  124    HD3  ARG  21           2HD      ARG  21  -4.871  -5.709   4.684
  125    HE   ARG  21           HE       ARG  21  -3.507  -4.530   6.924
  126   HH11  ARG  21          1HH1      ARG  21  -4.703  -7.487   5.528
  127   HH12  ARG  21          2HH1      ARG  21  -3.594  -8.498   6.395
  128   HH21  ARG  21          1HH2      ARG  21  -2.042  -5.850   8.070
  129   HH22  ARG  21          2HH2      ARG  21  -2.081  -7.566   7.841
  130    H    PHE  22           H        PHE  22  -6.116   0.788   5.699
  131    HA   PHE  22           HA       PHE  22  -6.433   1.303   8.579
  132    HB2  PHE  22           1HB      PHE  22  -6.032   3.428   6.464
  133    HB3  PHE  22           2HB      PHE  22  -6.193   3.687   8.198
  134    HD1  PHE  22           HD2      PHE  22  -4.006   2.308   5.570
  135    HD2  PHE  22           HD1      PHE  22  -4.341   3.475   9.649
  136    HE1  PHE  22           HE2      PHE  22  -1.565   2.129   5.818
  137    HE2  PHE  22           HE1      PHE  22  -1.900   3.299   9.904
  138    HZ   PHE  22           HZ       PHE  22  -0.509   2.624   7.987
  139    H    THR  23           H        THR  23  -8.360   2.394   9.193
  140    HA   THR  23           HA       THR  23 -10.643   1.603   7.684
  141    HB   THR  23           HB       THR  23 -10.747   1.662  10.115
  142    HG1  THR  23           HG1      THR  23 -12.766   2.552  10.215
  143   HG21  THR  23          3HG2      THR  23 -10.676   4.667   9.992
  144   HG22  THR  23          1HG2      THR  23  -9.224   3.707  10.274
  145   HG23  THR  23          2HG2      THR  23 -10.571   3.623  11.409
  146    H    GLN  24           H        GLN  24  -9.293   4.791   8.528
  147    HA   GLN  24           HA       GLN  24 -10.887   5.947   6.339
  148    HB2  GLN  24           1HB      GLN  24  -9.854   7.157   8.899
  149    HB3  GLN  24           2HB      GLN  24 -10.444   8.138   7.565
  150    HG2  GLN  24           1HG      GLN  24 -12.617   7.000   7.717
  151    HG3  GLN  24           2HG      GLN  24 -12.018   6.081   9.096
  152   HE21  GLN  24          1HE2      GLN  24 -11.691   7.125  11.061
  153   HE22  GLN  24          2HE2      GLN  24 -12.380   8.671  11.405
  154    H    ASN  25           H        ASN  25  -9.896   7.655   5.083
  155    HA   ASN  25           HA       ASN  25  -7.282   6.976   4.222
  156    HB2  ASN  25           1HB      ASN  25  -7.497   8.940   2.734
  157    HB3  ASN  25           2HB      ASN  25  -8.919   7.902   2.672
  158   HD21  ASN  25          1HD2      ASN  25  -8.113  10.957   2.502
  159   HD22  ASN  25          2HD2      ASN  25  -9.448  11.712   3.299
  160    H    SER  26           H        SER  26  -8.575   9.714   6.072
  161    HA   SER  26           HA       SER  26  -6.384  11.325   6.297
  162    HB2  SER  26           1HB      SER  26  -8.770  11.477   7.388
  163    HB3  SER  26           2HB      SER  26  -7.966  10.744   8.777
  164    HG   SER  26           HG       SER  26  -6.500  12.776   7.761
  165    H    HIS  27           H        HIS  27  -7.106   8.479   8.299
  166    HA   HIS  27           HA       HIS  27  -4.930   8.604  10.018
  167    HB2  HIS  27           1HB      HIS  27  -6.703   6.429   9.031
  168    HB3  HIS  27           2HB      HIS  27  -5.212   5.950   9.836
  169    HD1  HIS  27           HD1      HIS  27  -7.945   5.330  11.098
  170    HD2  HIS  27           HD2      HIS  27  -5.693   8.715  11.957
  171    HE1  HIS  27           HE1      HIS  27  -8.718   6.095  13.366
  172    H    LEU  28           H        LEU  28  -5.138   7.396   6.728
  173    HA   LEU  28           HA       LEU  28  -2.534   6.210   6.721
  174    HB2  LEU  28           1HB      LEU  28  -3.883   5.256   5.133
  175    HB3  LEU  28           2HB      LEU  28  -4.633   6.790   4.695
  176    HG   LEU  28           HG       LEU  28  -2.571   7.418   3.489
  177   HD11  LEU  28          1HD1      LEU  28  -1.632   4.593   3.719
  178   HD12  LEU  28          2HD1      LEU  28  -1.191   5.772   4.954
  179   HD13  LEU  28          3HD1      LEU  28  -0.734   6.044   3.273
  180   HD21  LEU  28          3HD2      LEU  28  -2.862   5.152   1.939
  181   HD22  LEU  28          1HD2      LEU  28  -3.823   6.627   1.824
  182   HD23  LEU  28          2HD2      LEU  28  -4.400   5.272   2.795
  183    H    HIS  29           H        HIS  29  -3.841   9.073   5.037
  184    HA   HIS  29           HA       HIS  29  -1.673  10.154   3.898
  185    HB2  HIS  29           1HB      HIS  29  -3.975  11.386   5.329
  186    HB3  HIS  29           2HB      HIS  29  -2.636  12.440   4.884
  187    HD1  HIS  29           HD1      HIS  29  -4.243  13.653   3.208
  188    HD2  HIS  29           HD2      HIS  29  -3.516   9.654   2.346
  189    HE1  HIS  29           HE1      HIS  29  -5.038  13.319   0.846
  190    H    SER  30           H        SER  30  -2.409  10.376   7.359
  191    HA   SER  30           HA       SER  30  -0.038  11.872   7.959
  192    HB2  SER  30           1HB      SER  30  -2.069  12.055   9.347
  193    HB3  SER  30           2HB      SER  30  -1.898  10.363   9.814
  194    HG   SER  30           HG       SER  30   0.295  12.036  10.214
  195    H    HIS  31           H        HIS  31  -1.015   8.487   8.187
  196    HA   HIS  31           HA       HIS  31   1.165   7.483   9.599
  197    HB2  HIS  31           1HB      HIS  31  -0.538   5.936   9.332
  198    HB3  HIS  31           2HB      HIS  31  -0.756   6.314   7.626
  199    HD1  HIS  31           HD1      HIS  31   1.075   4.077   9.928
  200    HD2  HIS  31           HD2      HIS  31   1.121   5.046   5.888
  201    HE1  HIS  31           HE1      HIS  31   2.432   2.273   8.819
  202    H    GLN  32           H        GLN  32   0.815   8.244   6.184
  203    HA   GLN  32           HA       GLN  32   2.978   6.985   5.071
  204    HB2  GLN  32           1HB      GLN  32   1.575   9.548   4.513
  205    HB3  GLN  32           2HB      GLN  32   3.117   9.279   3.712
  206    HG2  GLN  32           1HG      GLN  32   2.276   7.209   2.753
  207    HG3  GLN  32           2HG      GLN  32   0.737   7.442   3.581
  208   HE21  GLN  32          1HE2      GLN  32  -0.783   8.120   2.270
  209   HE22  GLN  32          2HE2      GLN  32  -0.583   9.209   0.943
  210    H    ARG  33           H        ARG  33   2.984   9.534   7.383
  211    HA   ARG  33           HA       ARG  33   5.506  10.666   6.891
  212    HB2  ARG  33           1HB      ARG  33   3.740  10.471   9.306
  213    HB3  ARG  33           2HB      ARG  33   5.364  11.129   9.459
  214    HG2  ARG  33           1HG      ARG  33   4.567  12.601   7.410
  215    HG3  ARG  33           2HG      ARG  33   2.981  12.247   8.097
  216    HD2  ARG  33           1HD      ARG  33   3.835  14.322   9.007
  217    HD3  ARG  33           2HD      ARG  33   3.756  13.095  10.271
  218    HE   ARG  33           HE       ARG  33   6.016  13.274  10.508
  219   HH11  ARG  33          1HH1      ARG  33   5.122  14.531   7.387
  220   HH12  ARG  33          2HH1      ARG  33   6.719  15.090   7.010
  221   HH21  ARG  33          1HH2      ARG  33   8.121  14.004  10.024
  222   HH22  ARG  33          2HH2      ARG  33   8.424  14.789   8.510
  223    H    VAL  34           H        VAL  34   4.521   7.842   8.758
  224    HA   VAL  34           HA       VAL  34   6.729   7.227  10.216
  225    HB   VAL  34           HB       VAL  34   6.201   4.854   9.928
  226   HG11  VAL  34          1HG1      VAL  34   4.840   6.168  11.452
  227   HG12  VAL  34          2HG1      VAL  34   3.755   6.608  10.132
  228   HG13  VAL  34          3HG1      VAL  34   3.861   4.930  10.666
  229   HG21  VAL  34          3HG2      VAL  34   3.903   4.997   8.265
  230   HG22  VAL  34          1HG2      VAL  34   5.257   5.720   7.396
  231   HG23  VAL  34          2HG2      VAL  34   5.385   4.074   8.015
  232    H    HIS  35           H        HIS  35   6.504   7.340   6.782
  233    HA   HIS  35           HA       HIS  35   9.184   6.137   6.549
  234    HB2  HIS  35           1HB      HIS  35   7.269   6.464   4.251
  235    HB3  HIS  35           2HB      HIS  35   8.660   5.391   4.376
  236    HD1  HIS  35           HD1      HIS  35   8.328   3.423   6.274
  237    HD2  HIS  35           HD2      HIS  35   4.909   5.245   4.774
  238    HE1  HIS  35           HE1      HIS  35   6.438   1.855   6.814
  239    H    THR  36           H        THR  36   7.260   8.947   6.063
  240    HA   THR  36           HA       THR  36   8.408  10.392   4.096
  241    HB   THR  36           HB       THR  36   7.482  11.229   6.820
  242    HG1  THR  36           HG1      THR  36   6.567  12.139   4.302
  243   HG21  THR  36          3HG2      THR  36   7.703  13.614   5.599
  244   HG22  THR  36          1HG2      THR  36   9.131  12.813   4.945
  245   HG23  THR  36          2HG2      THR  36   8.930  12.971   6.690
  246    H    GLY  37           H        GLY  37  10.563   9.946   3.688
  247    HA2  GLY  37           1HA      GLY  37  12.690  11.124   3.900
  248    HA3  GLY  37           2HA      GLY  37  12.451  11.103   5.641
  249    H    GLU  38           H        GLU  38  12.455   8.698   3.003
  250    HA   GLU  38           HA       GLU  38  13.870   6.844   4.761
  251    HB2  GLU  38           1HB      GLU  38  13.406   5.173   2.994
  252    HB3  GLU  38           2HB      GLU  38  11.947   5.940   3.607
  253    HG2  GLU  38           1HG      GLU  38  11.764   7.310   1.663
  254    HG3  GLU  38           2HG      GLU  38  13.342   6.782   1.080
  255    H    LYS  39           H        LYS  39  15.930   6.188   4.456
  256    HA   LYS  39           HA       LYS  39  17.361   7.254   2.111
  257    HB2  LYS  39           1HB      LYS  39  17.795   8.247   4.518
  258    HB3  LYS  39           2HB      LYS  39  18.781   6.802   4.703
  259    HG2  LYS  39           1HG      LYS  39  19.146   8.574   2.326
  260    HG3  LYS  39           2HG      LYS  39  19.870   8.998   3.879
  261    HD2  LYS  39           1HD      LYS  39  20.250   6.298   2.608
  262    HD3  LYS  39           2HD      LYS  39  21.312   7.664   2.257
  263    HE2  LYS  39           1HE      LYS  39  20.759   6.824   5.080
  264    HE3  LYS  39           2HE      LYS  39  21.985   6.003   4.116
  265    HZ1  LYS  39           3HZ      LYS  39  23.070   8.149   3.769
  266    HZ2  LYS  39           1HZ      LYS  39  22.968   7.767   5.414
  267    HZ3  LYS  39           2HZ      LYS  39  21.912   8.905   4.743
  268    HA   PRO  40           HA       PRO  40  18.437   3.045   1.329
  269    HB2  PRO  40           1HB      PRO  40  20.467   3.494  -0.417
  270    HB3  PRO  40           2HB      PRO  40  18.766   3.701  -0.848
  271    HG2  PRO  40           1HG      PRO  40  20.784   5.766  -0.060
  272    HG3  PRO  40           2HG      PRO  40  19.572   5.823  -1.353
  273    HD2  PRO  40           1HD      PRO  40  19.218   7.057   1.031
  274    HD3  PRO  40           2HD      PRO  40  17.869   6.381   0.096
  275    H    SER  41           H        SER  41  19.605   1.691   2.529
  276    HA   SER  41           HA       SER  41  21.951   2.680   3.941
  277    HB2  SER  41           1HB      SER  41  20.138   0.319   4.232
  278    HB3  SER  41           2HB      SER  41  21.763   0.228   4.910
  279    HG   SER  41           HG       SER  41  20.572   1.091   6.511
  280    H    GLY  42           H        GLY  42  23.831   1.122   4.165
  281    HA2  GLY  42           1HA      GLY  42  24.514   0.131   1.476
  282    HA3  GLY  42           2HA      GLY  42  25.675   0.672   2.678
  283    HA   PRO  43           HA       PRO  43  26.331  -3.455   3.985
  284    HB2  PRO  43           1HB      PRO  43  26.737  -3.151   6.652
  285    HB3  PRO  43           2HB      PRO  43  27.913  -2.637   5.437
  286    HG2  PRO  43           1HG      PRO  43  25.892  -1.006   6.925
  287    HG3  PRO  43           2HG      PRO  43  27.586  -0.627   6.559
  288    HD2  PRO  43           1HD      PRO  43  25.523   0.395   5.134
  289    HD3  PRO  43           2HD      PRO  43  27.102   0.038   4.406
  290    H    SER  44           H        SER  44  23.792  -1.613   5.498
  291    HA   SER  44           HA       SER  44  22.641  -3.870   6.874
  292    HB2  SER  44           1HB      SER  44  22.464  -1.456   7.641
  293    HB3  SER  44           2HB      SER  44  21.319  -1.209   6.323
  294    HG   SER  44           HG       SER  44  20.014  -2.838   7.260
  295    H    SER  45           H        SER  45  22.271  -5.383   5.232
  296    HA   SER  45           HA       SER  45  20.533  -4.675   3.018
  297    HB2  SER  45           1HB      SER  45  21.064  -6.770   2.095
  298    HB3  SER  45           2HB      SER  45  22.546  -6.297   2.924
  299    HG   SER  45           HG       SER  45  21.452  -8.527   3.247
  300    H    GLY  46           H        GLY  46  18.401  -5.032   2.915
  301    HA2  GLY  46           1HA      GLY  46  16.783  -6.961   3.696
  302    HA3  GLY  46           2HA      GLY  46  17.108  -6.217   5.255
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1 -13.795 -26.357   1.283
    2    HA2  GLY   1           1HA      GLY   1 -12.977 -25.346   3.356
    3    HA3  GLY   1           2HA      GLY   1 -11.514 -24.915   2.484
    4    H    SER   2           H        SER   2 -11.467 -22.758   2.447
    5    HA   SER   2           HA       SER   2 -13.929 -21.327   1.702
    6    HB2  SER   2           1HB      SER   2 -12.777 -20.822   3.935
    7    HB3  SER   2           2HB      SER   2 -11.499 -20.075   2.977
    8    HG   SER   2           HG       SER   2 -12.760 -18.432   2.578
    9    H    SER   3           H        SER   3 -13.590 -21.712  -0.544
   10    HA   SER   3           HA       SER   3 -11.200 -20.704  -1.813
   11    HB2  SER   3           1HB      SER   3 -12.169 -22.632  -2.833
   12    HB3  SER   3           2HB      SER   3 -13.766 -21.885  -2.885
   13    HG   SER   3           HG       SER   3 -11.479 -21.029  -4.336
   14    H    GLY   4           H        GLY   4 -14.669 -19.937  -2.201
   15    HA2  GLY   4           1HA      GLY   4 -13.939 -17.309  -3.248
   16    HA3  GLY   4           2HA      GLY   4 -15.543 -18.027  -3.268
   17    H    SER   5           H        SER   5 -16.654 -16.352  -2.357
   18    HA   SER   5           HA       SER   5 -17.236 -14.747  -0.809
   19    HB2  SER   5           1HB      SER   5 -16.785 -17.150   0.979
   20    HB3  SER   5           2HB      SER   5 -17.778 -15.747   1.372
   21    HG   SER   5           HG       SER   5 -18.226 -17.418  -0.875
   22    H    SER   6           H        SER   6 -14.542 -14.466  -1.429
   23    HA   SER   6           HA       SER   6 -13.269 -13.953   1.173
   24    HB2  SER   6           1HB      SER   6 -12.087 -14.271  -1.593
   25    HB3  SER   6           2HB      SER   6 -11.156 -13.748  -0.190
   26    HG   SER   6           HG       SER   6 -12.662 -16.136  -0.158
   27    H    GLY   7           H        GLY   7 -12.542 -11.930   1.718
   28    HA2  GLY   7           1HA      GLY   7 -11.877  -9.683   1.008
   29    HA3  GLY   7           2HA      GLY   7 -13.161  -9.761  -0.189
   30    H    SER   8           H        SER   8 -12.707  -9.995   3.337
   31    HA   SER   8           HA       SER   8 -15.390  -8.994   3.790
   32    HB2  SER   8           1HB      SER   8 -14.389 -10.788   5.216
   33    HB3  SER   8           2HB      SER   8 -13.228  -9.606   5.819
   34    HG   SER   8           HG       SER   8 -15.238  -8.356   6.365
   35    H    GLY   9           H        GLY   9 -12.053  -7.928   4.366
   36    HA2  GLY   9           1HA      GLY   9 -13.090  -5.246   5.016
   37    HA3  GLY   9           2HA      GLY   9 -11.512  -5.858   5.487
   38    H    GLU  10           H        GLU  10 -10.260  -6.664   3.366
   39    HA   GLU  10           HA       GLU  10  -8.883  -5.677   1.789
   40    HB2  GLU  10           1HB      GLU  10 -10.853  -6.908   0.659
   41    HB3  GLU  10           2HB      GLU  10 -11.459  -5.300   0.288
   42    HG2  GLU  10           1HG      GLU  10  -8.650  -5.941  -0.425
   43    HG3  GLU  10           2HG      GLU  10  -9.944  -6.635  -1.399
   44    H    LYS  11           H        LYS  11  -9.526  -3.752   3.695
   45    HA   LYS  11           HA       LYS  11 -10.689  -1.414   3.097
   46    HB2  LYS  11           1HB      LYS  11  -7.937  -1.826   4.267
   47    HB3  LYS  11           2HB      LYS  11  -8.742  -0.263   4.235
   48    HG2  LYS  11           1HG      LYS  11 -10.632  -1.326   5.503
   49    HG3  LYS  11           2HG      LYS  11  -9.600  -2.745   5.697
   50    HD2  LYS  11           1HD      LYS  11  -7.873  -0.990   6.590
   51    HD3  LYS  11           2HD      LYS  11  -9.316  -0.011   6.864
   52    HE2  LYS  11           1HE      LYS  11 -10.280  -1.925   8.141
   53    HE3  LYS  11           2HE      LYS  11  -8.731  -2.750   7.979
   54    HZ1  LYS  11           3HZ      LYS  11  -8.495  -0.075   8.999
   55    HZ2  LYS  11           1HZ      LYS  11  -7.835  -1.518   9.587
   56    HZ3  LYS  11           2HZ      LYS  11  -9.417  -1.083   9.997
   57    HA   PRO  12           HA       PRO  12  -9.029  -0.043  -0.767
   58    HB2  PRO  12           1HB      PRO  12 -10.028   2.481  -0.699
   59    HB3  PRO  12           2HB      PRO  12 -11.024   1.062  -1.046
   60    HG2  PRO  12           1HG      PRO  12 -10.700   2.567   1.521
   61    HG3  PRO  12           2HG      PRO  12 -12.178   1.933   0.775
   62    HD2  PRO  12           1HD      PRO  12 -10.911   0.665   2.805
   63    HD3  PRO  12           2HD      PRO  12 -11.793  -0.209   1.536
   64    H    PHE  13           H        PHE  13  -8.566   1.749   2.228
   65    HA   PHE  13           HA       PHE  13  -6.401   3.324   1.117
   66    HB2  PHE  13           1HB      PHE  13  -7.261   3.141   4.008
   67    HB3  PHE  13           2HB      PHE  13  -6.312   4.417   3.253
   68    HD1  PHE  13           HD1      PHE  13  -7.576   5.479   1.113
   69    HD2  PHE  13           HD2      PHE  13  -9.441   3.641   4.469
   70    HE1  PHE  13           HE1      PHE  13  -9.638   6.740   0.653
   71    HE2  PHE  13           HE2      PHE  13 -11.506   4.898   4.014
   72    HZ   PHE  13           HZ       PHE  13 -11.607   6.449   2.104
   73    H    GLN  14           H        GLN  14  -4.521   2.331   0.782
   74    HA   GLN  14           HA       GLN  14  -3.308   0.865   2.997
   75    HB2  GLN  14           1HB      GLN  14  -3.368  -0.237   0.185
   76    HB3  GLN  14           2HB      GLN  14  -2.625  -0.986   1.592
   77    HG2  GLN  14           1HG      GLN  14  -4.840  -1.209   2.624
   78    HG3  GLN  14           2HG      GLN  14  -5.567  -0.501   1.182
   79   HE21  GLN  14          1HE2      GLN  14  -2.959  -2.865   1.525
   80   HE22  GLN  14          2HE2      GLN  14  -3.740  -4.119   0.631
   81    H    CYS  15           H        CYS  15  -1.189   1.284   3.237
   82    HA   CYS  15           HA       CYS  15   0.036   3.405   1.924
   83    HB2  CYS  15           1HB      CYS  15   0.627   2.125   4.156
   84    HB3  CYS  15           2HB      CYS  15   1.720   1.233   3.103
   85    H    GLU  16           H        GLU  16   2.329   3.091   0.881
   86    HA   GLU  16           HA       GLU  16   2.030   1.113  -1.284
   87    HB2  GLU  16           1HB      GLU  16   1.940   3.734  -1.689
   88    HB3  GLU  16           2HB      GLU  16   3.689   3.563  -1.655
   89    HG2  GLU  16           1HG      GLU  16   3.448   1.786  -3.411
   90    HG3  GLU  16           2HG      GLU  16   1.752   2.250  -3.538
   91    H    GLU  17           H        GLU  17   4.080   2.419   1.168
   92    HA   GLU  17           HA       GLU  17   6.409   0.959   0.170
   93    HB2  GLU  17           1HB      GLU  17   6.098   2.880   2.483
   94    HB3  GLU  17           2HB      GLU  17   7.604   2.085   2.047
   95    HG2  GLU  17           1HG      GLU  17   7.778   3.271   0.033
   96    HG3  GLU  17           2HG      GLU  17   6.096   3.795   0.101
   97    H    CYS  18           H        CYS  18   3.899   0.736   2.509
   98    HA   CYS  18           HA       CYS  18   5.126  -1.718   3.562
   99    HB2  CYS  18           1HB      CYS  18   4.435  -1.206   5.806
  100    HB3  CYS  18           2HB      CYS  18   5.354   0.168   5.199
  101    H    GLY  19           H        GLY  19   2.654  -0.427   1.881
  102    HA2  GLY  19           1HA      GLY  19   0.400  -0.948   1.604
  103    HA3  GLY  19           2HA      GLY  19   1.097  -2.557   1.491
  104    H    LYS  20           H        LYS  20  -0.056  -0.199   3.890
  105    HA   LYS  20           HA       LYS  20  -0.753  -2.410   5.680
  106    HB2  LYS  20           1HB      LYS  20  -0.148   0.465   6.032
  107    HB3  LYS  20           2HB      LYS  20  -1.387  -0.193   7.094
  108    HG2  LYS  20           1HG      LYS  20   0.436  -2.084   7.436
  109    HG3  LYS  20           2HG      LYS  20   1.518  -0.767   6.977
  110    HD2  LYS  20           1HD      LYS  20   0.218   0.607   8.737
  111    HD3  LYS  20           2HD      LYS  20  -0.329  -0.963   9.331
  112    HE2  LYS  20           1HE      LYS  20   2.080  -1.640   9.477
  113    HE3  LYS  20           2HE      LYS  20   2.508   0.029   9.103
  114    HZ1  LYS  20           3HZ      LYS  20   0.708  -0.591  11.356
  115    HZ2  LYS  20           1HZ      LYS  20   1.670   0.779  11.109
  116    HZ3  LYS  20           2HZ      LYS  20   2.386  -0.689  11.545
  117    H    ARG  21           H        ARG  21  -2.830  -1.540   7.091
  118    HA   ARG  21           HA       ARG  21  -4.949  -1.007   5.115
  119    HB2  ARG  21           1HB      ARG  21  -4.856  -3.031   7.337
  120    HB3  ARG  21           2HB      ARG  21  -6.389  -2.442   6.709
  121    HG2  ARG  21           1HG      ARG  21  -6.123  -3.485   4.688
  122    HG3  ARG  21           2HG      ARG  21  -4.361  -3.479   4.795
  123    HD2  ARG  21           1HD      ARG  21  -5.026  -5.727   5.082
  124    HD3  ARG  21           2HD      ARG  21  -4.597  -5.136   6.686
  125    HE   ARG  21           HE       ARG  21  -7.306  -4.720   6.438
  126   HH11  ARG  21          1HH1      ARG  21  -5.147  -7.448   6.309
  127   HH12  ARG  21          2HH1      ARG  21  -6.323  -8.573   6.904
  128   HH21  ARG  21          1HH2      ARG  21  -8.863  -6.191   7.222
  129   HH22  ARG  21          2HH2      ARG  21  -8.436  -7.857   7.422
  130    H    PHE  22           H        PHE  22  -6.290   0.619   5.582
  131    HA   PHE  22           HA       PHE  22  -6.544   1.518   8.359
  132    HB2  PHE  22           1HB      PHE  22  -6.007   3.410   6.062
  133    HB3  PHE  22           2HB      PHE  22  -6.195   3.838   7.760
  134    HD1  PHE  22           HD1      PHE  22  -4.423   3.416   9.355
  135    HD2  PHE  22           HD2      PHE  22  -3.969   2.417   5.242
  136    HE1  PHE  22           HE1      PHE  22  -1.997   3.175   9.685
  137    HE2  PHE  22           HE2      PHE  22  -1.542   2.173   5.566
  138    HZ   PHE  22           HZ       PHE  22  -0.553   2.551   7.790
  139    H    THR  23           H        THR  23  -8.476   2.593   8.840
  140    HA   THR  23           HA       THR  23 -10.634   2.024   6.962
  141    HB   THR  23           HB       THR  23 -12.152   2.485   8.819
  142    HG1  THR  23           HG1      THR  23  -9.778   3.409  10.018
  143   HG21  THR  23          3HG2      THR  23 -11.816   0.481   9.822
  144   HG22  THR  23          1HG2      THR  23 -10.130   0.831  10.200
  145   HG23  THR  23          2HG2      THR  23 -10.580   0.310   8.577
  146    H    GLN  24           H        GLN  24  -9.038   4.737   8.508
  147    HA   GLN  24           HA       GLN  24 -10.838   6.583   7.092
  148    HB2  GLN  24           1HB      GLN  24  -9.101   6.951   9.528
  149    HB3  GLN  24           2HB      GLN  24  -9.820   8.305   8.667
  150    HG2  GLN  24           1HG      GLN  24 -11.287   6.056  10.025
  151    HG3  GLN  24           2HG      GLN  24 -11.173   7.729  10.571
  152   HE21  GLN  24          1HE2      GLN  24 -13.059   5.539   8.978
  153   HE22  GLN  24          2HE2      GLN  24 -14.093   6.626   8.122
  154    H    ASN  25           H        ASN  25 -10.076   7.880   5.528
  155    HA   ASN  25           HA       ASN  25  -7.667   7.381   4.246
  156    HB2  ASN  25           1HB      ASN  25  -8.097   9.774   3.268
  157    HB3  ASN  25           2HB      ASN  25  -9.218   8.465   2.904
  158   HD21  ASN  25          1HD2      ASN  25 -11.230   8.411   3.951
  159   HD22  ASN  25          2HD2      ASN  25 -11.908   9.829   4.668
  160    H    SER  26           H        SER  26  -8.451   9.758   6.725
  161    HA   SER  26           HA       SER  26  -6.116  11.291   6.610
  162    HB2  SER  26           1HB      SER  26  -8.130  11.924   7.906
  163    HB3  SER  26           2HB      SER  26  -7.774  10.638   9.059
  164    HG   SER  26           HG       SER  26  -5.595  11.854   9.084
  165    H    HIS  27           H        HIS  27  -6.862   8.411   8.552
  166    HA   HIS  27           HA       HIS  27  -4.584   8.201  10.063
  167    HB2  HIS  27           1HB      HIS  27  -6.485   6.224   8.909
  168    HB3  HIS  27           2HB      HIS  27  -4.973   5.602   9.565
  169    HD1  HIS  27           HD1      HIS  27  -8.012   5.343  10.722
  170    HD2  HIS  27           HD2      HIS  27  -4.893   7.653  12.204
  171    HE1  HIS  27           HE1      HIS  27  -8.553   5.725  13.148
  172    H    LEU  28           H        LEU  28  -5.058   6.972   6.759
  173    HA   LEU  28           HA       LEU  28  -2.478   5.892   6.454
  174    HB2  LEU  28           1HB      LEU  28  -4.120   5.177   4.937
  175    HB3  LEU  28           2HB      LEU  28  -4.566   6.829   4.513
  176    HG   LEU  28           HG       LEU  28  -2.316   7.042   3.407
  177   HD11  LEU  28          1HD1      LEU  28  -2.188   4.067   3.355
  178   HD12  LEU  28          2HD1      LEU  28  -1.515   4.933   4.736
  179   HD13  LEU  28          3HD1      LEU  28  -0.909   5.257   3.112
  180   HD21  LEU  28          3HD2      LEU  28  -4.127   4.888   2.322
  181   HD22  LEU  28          1HD2      LEU  28  -3.006   5.888   1.398
  182   HD23  LEU  28          2HD2      LEU  28  -4.410   6.623   2.173
  183    H    HIS  29           H        HIS  29  -3.774   8.888   5.009
  184    HA   HIS  29           HA       HIS  29  -1.501   9.952   3.963
  185    HB2  HIS  29           1HB      HIS  29  -3.728  11.397   5.407
  186    HB3  HIS  29           2HB      HIS  29  -2.494  12.210   4.449
  187    HD1  HIS  29           HD1      HIS  29  -4.235  13.083   2.761
  188    HD2  HIS  29           HD2      HIS  29  -4.094   8.941   3.053
  189    HE1  HIS  29           HE1      HIS  29  -5.553  12.226   0.798
  190    H    SER  30           H        SER  30  -2.609  10.395   7.318
  191    HA   SER  30           HA       SER  30  -0.288  11.847   8.109
  192    HB2  SER  30           1HB      SER  30  -2.348  10.409   9.801
  193    HB3  SER  30           2HB      SER  30  -1.157  11.563  10.400
  194    HG   SER  30           HG       SER  30  -2.266  12.895   8.558
  195    H    HIS  31           H        HIS  31  -1.043   8.504   7.794
  196    HA   HIS  31           HA       HIS  31   0.918   7.520   9.630
  197    HB2  HIS  31           1HB      HIS  31  -0.663   5.898   9.282
  198    HB3  HIS  31           2HB      HIS  31  -0.902   6.341   7.595
  199    HD1  HIS  31           HD1      HIS  31   1.118   4.136   9.807
  200    HD2  HIS  31           HD2      HIS  31   0.864   5.103   5.774
  201    HE1  HIS  31           HE1      HIS  31   2.473   2.388   8.609
  202    H    GLN  32           H        GLN  32   0.794   7.991   6.121
  203    HA   GLN  32           HA       GLN  32   3.140   6.815   5.334
  204    HB2  GLN  32           1HB      GLN  32   1.858   9.370   4.371
  205    HB3  GLN  32           2HB      GLN  32   3.239   8.632   3.570
  206    HG2  GLN  32           1HG      GLN  32   1.721   6.514   3.527
  207    HG3  GLN  32           2HG      GLN  32   0.421   7.685   3.746
  208   HE21  GLN  32          1HE2      GLN  32  -0.524   7.635   1.796
  209   HE22  GLN  32          2HE2      GLN  32   0.266   8.026   0.310
  210    H    ARG  33           H        ARG  33   2.757   9.512   7.397
  211    HA   ARG  33           HA       ARG  33   5.106  10.945   6.966
  212    HB2  ARG  33           1HB      ARG  33   3.624  10.445   9.554
  213    HB3  ARG  33           2HB      ARG  33   4.877  11.660   9.337
  214    HG2  ARG  33           1HG      ARG  33   3.450  12.676   7.545
  215    HG3  ARG  33           2HG      ARG  33   2.171  11.561   8.031
  216    HD2  ARG  33           1HD      ARG  33   1.922  12.563  10.117
  217    HD3  ARG  33           2HD      ARG  33   3.513  13.321  10.048
  218    HE   ARG  33           HE       ARG  33   2.108  14.450   7.990
  219   HH11  ARG  33          1HH1      ARG  33   1.659  14.145  11.429
  220   HH12  ARG  33          2HH1      ARG  33   0.780  15.630  11.577
  221   HH21  ARG  33          1HH2      ARG  33   0.951  16.408   8.173
  222   HH22  ARG  33          2HH2      ARG  33   0.377  16.916   9.725
  223    H    VAL  34           H        VAL  34   4.547   7.944   8.685
  224    HA   VAL  34           HA       VAL  34   6.913   7.754  10.143
  225    HB   VAL  34           HB       VAL  34   6.565   5.371  10.211
  226   HG11  VAL  34          1HG1      VAL  34   4.176   5.293  10.892
  227   HG12  VAL  34          2HG1      VAL  34   5.066   6.651  11.583
  228   HG13  VAL  34          3HG1      VAL  34   3.974   6.912  10.222
  229   HG21  VAL  34          3HG2      VAL  34   5.378   4.131   8.696
  230   HG22  VAL  34          1HG2      VAL  34   4.321   5.474   8.261
  231   HG23  VAL  34          2HG2      VAL  34   5.971   5.414   7.641
  232    H    HIS  35           H        HIS  35   6.414   7.638   6.763
  233    HA   HIS  35           HA       HIS  35   9.000   6.340   6.293
  234    HB2  HIS  35           1HB      HIS  35   6.943   7.174   4.242
  235    HB3  HIS  35           2HB      HIS  35   8.322   6.107   3.994
  236    HD1  HIS  35           HD1      HIS  35   8.134   3.942   5.881
  237    HD2  HIS  35           HD2      HIS  35   4.685   5.723   4.402
  238    HE1  HIS  35           HE1      HIS  35   6.305   2.251   6.223
  239    H    THR  36           H        THR  36   8.513   9.146   7.301
  240    HA   THR  36           HA       THR  36   8.875  11.219   5.679
  241    HB   THR  36           HB       THR  36  10.871  11.886   7.322
  242    HG1  THR  36           HG1      THR  36   9.480  10.006   8.916
  243   HG21  THR  36          3HG2      THR  36   8.484  11.807   8.929
  244   HG22  THR  36          1HG2      THR  36   8.087  12.228   7.264
  245   HG23  THR  36          2HG2      THR  36   9.265  13.188   8.159
  246    H    GLY  37           H        GLY  37  11.854   9.652   6.843
  247    HA2  GLY  37           1HA      GLY  37  13.190   8.683   4.842
  248    HA3  GLY  37           2HA      GLY  37  13.110  10.345   4.277
  249    H    GLU  38           H        GLU  38  13.453   9.461   7.652
  250    HA   GLU  38           HA       GLU  38  16.002  10.882   7.712
  251    HB2  GLU  38           1HB      GLU  38  13.944  11.137   9.361
  252    HB3  GLU  38           2HB      GLU  38  14.721   9.784  10.173
  253    HG2  GLU  38           1HG      GLU  38  16.614  11.018  10.695
  254    HG3  GLU  38           2HG      GLU  38  16.280  12.234   9.463
  255    H    LYS  39           H        LYS  39  15.705   8.152   6.603
  256    HA   LYS  39           HA       LYS  39  16.817   6.281   8.426
  257    HB2  LYS  39           1HB      LYS  39  16.971   4.802   6.594
  258    HB3  LYS  39           2HB      LYS  39  15.547   5.783   6.273
  259    HG2  LYS  39           1HG      LYS  39  17.318   7.251   4.957
  260    HG3  LYS  39           2HG      LYS  39  18.154   5.699   4.868
  261    HD2  LYS  39           1HD      LYS  39  15.942   4.740   4.043
  262    HD3  LYS  39           2HD      LYS  39  15.421   6.413   3.833
  263    HE2  LYS  39           1HE      LYS  39  17.720   6.592   2.544
  264    HE3  LYS  39           2HE      LYS  39  17.481   4.856   2.353
  265    HZ1  LYS  39           3HZ      LYS  39  15.859   5.175   0.875
  266    HZ2  LYS  39           1HZ      LYS  39  16.437   6.760   0.746
  267    HZ3  LYS  39           2HZ      LYS  39  15.135   6.415   1.769
  268    HA   PRO  40           HA       PRO  40  21.052   7.496   8.406
  269    HB2  PRO  40           1HB      PRO  40  22.160   5.142   9.184
  270    HB3  PRO  40           2HB      PRO  40  21.273   6.198  10.290
  271    HG2  PRO  40           1HG      PRO  40  20.339   3.738   8.863
  272    HG3  PRO  40           2HG      PRO  40  20.055   4.233  10.542
  273    HD2  PRO  40           1HD      PRO  40  18.202   4.556   8.594
  274    HD3  PRO  40           2HD      PRO  40  18.358   5.680   9.960
  275    H    SER  41           H        SER  41  19.675   5.407   6.197
  276    HA   SER  41           HA       SER  41  22.173   4.663   4.894
  277    HB2  SER  41           1HB      SER  41  20.110   3.132   5.120
  278    HB3  SER  41           2HB      SER  41  19.410   4.108   3.829
  279    HG   SER  41           HG       SER  41  20.776   3.269   2.431
  280    H    GLY  42           H        GLY  42  22.734   6.931   4.477
  281    HA2  GLY  42           1HA      GLY  42  22.918   7.866   2.088
  282    HA3  GLY  42           2HA      GLY  42  21.191   8.130   2.274
  283    HA   PRO  43           HA       PRO  43  23.976  11.521   4.303
  284    HB2  PRO  43           1HB      PRO  43  24.601  13.104   2.188
  285    HB3  PRO  43           2HB      PRO  43  25.646  11.793   2.749
  286    HG2  PRO  43           1HG      PRO  43  23.702  11.825   0.473
  287    HG3  PRO  43           2HG      PRO  43  25.340  11.150   0.535
  288    HD2  PRO  43           1HD      PRO  43  23.123   9.615   0.776
  289    HD3  PRO  43           2HD      PRO  43  24.645   9.231   1.605
  290    H    SER  44           H        SER  44  22.810  13.142   5.134
  291    HA   SER  44           HA       SER  44  20.186  13.683   4.346
  292    HB2  SER  44           1HB      SER  44  20.260  15.538   5.935
  293    HB3  SER  44           2HB      SER  44  21.074  14.129   6.615
  294    HG   SER  44           HG       SER  44  23.051  15.076   6.110
  295    H    SER  45           H        SER  45  19.546  16.162   4.034
  296    HA   SER  45           HA       SER  45  19.344  17.850   2.522
  297    HB2  SER  45           1HB      SER  45  21.457  18.593   3.536
  298    HB3  SER  45           2HB      SER  45  22.360  17.599   2.394
  299    HG   SER  45           HG       SER  45  21.775  18.927   0.758
  300    H    GLY  46           H        GLY  46  18.869  15.319   1.504
  301    HA2  GLY  46           1HA      GLY  46  20.297  14.916  -0.956
  302    HA3  GLY  46           2HA      GLY  46  18.854  14.059  -0.434
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1  -7.912 -17.108 -11.832
    2    HA2  GLY   1           1HA      GLY   1 -10.332 -17.265 -10.276
    3    HA3  GLY   1           2HA      GLY   1  -9.907 -18.784 -11.051
    4    H    SER   2           H        SER   2  -9.487 -19.880  -9.153
    5    HA   SER   2           HA       SER   2  -8.416 -20.445  -7.202
    6    HB2  SER   2           1HB      SER   2  -6.028 -20.734  -7.487
    7    HB3  SER   2           2HB      SER   2  -6.828 -21.100  -9.016
    8    HG   SER   2           HG       SER   2  -6.127 -19.195  -9.848
    9    H    SER   3           H        SER   3  -9.460 -17.883  -6.992
   10    HA   SER   3           HA       SER   3  -7.486 -16.031  -6.057
   11    HB2  SER   3           1HB      SER   3  -9.586 -15.213  -6.989
   12    HB3  SER   3           2HB      SER   3 -10.497 -16.048  -5.732
   13    HG   SER   3           HG       SER   3  -8.703 -13.875  -5.416
   14    H    GLY   4           H        GLY   4  -7.328 -15.220  -3.870
   15    HA2  GLY   4           1HA      GLY   4  -8.486 -16.191  -1.592
   16    HA3  GLY   4           2HA      GLY   4  -7.223 -17.358  -1.957
   17    H    SER   5           H        SER   5  -5.284 -15.611  -2.989
   18    HA   SER   5           HA       SER   5  -3.811 -14.916  -0.812
   19    HB2  SER   5           1HB      SER   5  -2.637 -13.262  -2.312
   20    HB3  SER   5           2HB      SER   5  -2.803 -14.882  -2.991
   21    HG   SER   5           HG       SER   5  -3.617 -13.804  -4.614
   22    H    SER   6           H        SER   6  -6.083 -12.809  -2.543
   23    HA   SER   6           HA       SER   6  -5.695 -10.653  -0.658
   24    HB2  SER   6           1HB      SER   6  -6.112 -10.105  -2.996
   25    HB3  SER   6           2HB      SER   6  -7.648 -10.970  -2.951
   26    HG   SER   6           HG       SER   6  -6.944  -8.526  -1.754
   27    H    GLY   7           H        GLY   7  -6.663 -10.581   1.252
   28    HA2  GLY   7           1HA      GLY   7  -9.390 -10.762   1.705
   29    HA3  GLY   7           2HA      GLY   7  -8.746 -12.371   1.993
   30    H    SER   8           H        SER   8  -6.312 -11.788   3.151
   31    HA   SER   8           HA       SER   8  -6.733 -11.672   5.789
   32    HB2  SER   8           1HB      SER   8  -4.446 -10.321   4.338
   33    HB3  SER   8           2HB      SER   8  -4.460 -10.689   6.062
   34    HG   SER   8           HG       SER   8  -4.307 -12.801   5.633
   35    H    GLY   9           H        GLY   9  -6.318  -8.789   3.749
   36    HA2  GLY   9           1HA      GLY   9  -7.142  -7.107   6.008
   37    HA3  GLY   9           2HA      GLY   9  -6.399  -6.539   4.520
   38    H    GLU  10           H        GLU  10  -8.805  -5.563   5.825
   39    HA   GLU  10           HA       GLU  10 -10.663  -5.950   3.582
   40    HB2  GLU  10           1HB      GLU  10 -11.275  -7.199   5.772
   41    HB3  GLU  10           2HB      GLU  10 -11.680  -5.602   6.386
   42    HG2  GLU  10           1HG      GLU  10 -13.702  -6.431   5.616
   43    HG3  GLU  10           2HG      GLU  10 -13.155  -5.381   4.309
   44    H    LYS  11           H        LYS  11  -8.873  -3.875   3.715
   45    HA   LYS  11           HA       LYS  11 -10.666  -1.594   4.170
   46    HB2  LYS  11           1HB      LYS  11  -7.866  -1.964   5.171
   47    HB3  LYS  11           2HB      LYS  11  -8.447  -0.349   4.787
   48    HG2  LYS  11           1HG      LYS  11  -9.913  -0.307   6.532
   49    HG3  LYS  11           2HG      LYS  11 -10.124  -2.059   6.542
   50    HD2  LYS  11           1HD      LYS  11  -7.491  -0.839   7.285
   51    HD3  LYS  11           2HD      LYS  11  -8.800  -0.930   8.465
   52    HE2  LYS  11           1HE      LYS  11  -7.970  -3.353   6.913
   53    HE3  LYS  11           2HE      LYS  11  -7.068  -2.853   8.343
   54    HZ1  LYS  11           3HZ      LYS  11  -8.704  -4.426   9.007
   55    HZ2  LYS  11           1HZ      LYS  11  -9.939  -3.590   8.206
   56    HZ3  LYS  11           2HZ      LYS  11  -9.207  -2.913   9.573
   57    HA   PRO  12           HA       PRO  12  -9.550  -0.603   0.018
   58    HB2  PRO  12           1HB      PRO  12 -10.409   1.972  -0.007
   59    HB3  PRO  12           2HB      PRO  12 -11.511   0.591  -0.056
   60    HG2  PRO  12           1HG      PRO  12 -10.714   2.297   2.272
   61    HG3  PRO  12           2HG      PRO  12 -12.320   1.688   1.829
   62    HD2  PRO  12           1HD      PRO  12 -10.803   0.532   3.751
   63    HD3  PRO  12           2HD      PRO  12 -11.915  -0.396   2.726
   64    H    PHE  13           H        PHE  13  -8.848   1.955   2.411
   65    HA   PHE  13           HA       PHE  13  -6.706   3.062   0.912
   66    HB2  PHE  13           1HB      PHE  13  -7.249   3.339   3.874
   67    HB3  PHE  13           2HB      PHE  13  -6.258   4.407   2.886
   68    HD1  PHE  13           HD1      PHE  13  -7.290   5.936   1.289
   69    HD2  PHE  13           HD2      PHE  13  -9.638   3.472   3.845
   70    HE1  PHE  13           HE1      PHE  13  -9.264   7.326   0.810
   71    HE2  PHE  13           HE2      PHE  13 -11.615   4.857   3.370
   72    HZ   PHE  13           HZ       PHE  13 -11.430   6.786   1.850
   73    H    GLN  14           H        GLN  14  -4.660   2.428   0.743
   74    HA   GLN  14           HA       GLN  14  -3.442   0.855   2.881
   75    HB2  GLN  14           1HB      GLN  14  -3.633  -0.035   0.002
   76    HB3  GLN  14           2HB      GLN  14  -2.499  -0.726   1.156
   77    HG2  GLN  14           1HG      GLN  14  -4.677  -1.088   2.580
   78    HG3  GLN  14           2HG      GLN  14  -5.452  -0.999   0.999
   79   HE21  GLN  14          1HE2      GLN  14  -2.739  -2.579   2.643
   80   HE22  GLN  14          2HE2      GLN  14  -2.910  -4.097   1.838
   81    H    CYS  15           H        CYS  15  -1.168   0.929   2.920
   82    HA   CYS  15           HA       CYS  15  -0.051   3.351   1.938
   83    HB2  CYS  15           1HB      CYS  15   0.555   1.866   4.041
   84    HB3  CYS  15           2HB      CYS  15   1.685   1.123   2.913
   85    H    GLU  16           H        GLU  16   2.323   3.094   0.951
   86    HA   GLU  16           HA       GLU  16   2.040   1.382  -1.431
   87    HB2  GLU  16           1HB      GLU  16   1.976   4.027  -1.562
   88    HB3  GLU  16           2HB      GLU  16   3.723   3.845  -1.496
   89    HG2  GLU  16           1HG      GLU  16   3.342   2.130  -3.415
   90    HG3  GLU  16           2HG      GLU  16   1.807   2.974  -3.607
   91    H    GLU  17           H        GLU  17   4.113   2.508   1.122
   92    HA   GLU  17           HA       GLU  17   6.409   1.060   0.043
   93    HB2  GLU  17           1HB      GLU  17   6.162   2.771   2.524
   94    HB3  GLU  17           2HB      GLU  17   7.652   2.058   1.922
   95    HG2  GLU  17           1HG      GLU  17   7.638   3.433  -0.006
   96    HG3  GLU  17           2HG      GLU  17   5.994   3.981   0.318
   97    H    CYS  18           H        CYS  18   3.917   0.760   2.410
   98    HA   CYS  18           HA       CYS  18   5.068  -1.808   3.255
   99    HB2  CYS  18           1HB      CYS  18   4.471  -1.431   5.547
  100    HB3  CYS  18           2HB      CYS  18   5.412  -0.044   5.009
  101    H    GLY  19           H        GLY  19   2.673  -0.415   1.636
  102    HA2  GLY  19           1HA      GLY  19   0.419  -0.843   1.290
  103    HA3  GLY  19           2HA      GLY  19   1.007  -2.499   1.302
  104    H    LYS  20           H        LYS  20   0.606  -0.096   3.896
  105    HA   LYS  20           HA       LYS  20  -0.419  -2.045   5.704
  106    HB2  LYS  20           1HB      LYS  20   0.080   0.885   5.760
  107    HB3  LYS  20           2HB      LYS  20  -1.076   0.248   6.923
  108    HG2  LYS  20           1HG      LYS  20   1.546  -1.122   6.670
  109    HG3  LYS  20           2HG      LYS  20   1.494   0.448   7.476
  110    HD2  LYS  20           1HD      LYS  20  -0.419  -1.741   8.218
  111    HD3  LYS  20           2HD      LYS  20   1.207  -1.680   8.903
  112    HE2  LYS  20           1HE      LYS  20  -0.510   0.761   8.968
  113    HE3  LYS  20           2HE      LYS  20  -0.801  -0.532  10.130
  114    HZ1  LYS  20           3HZ      LYS  20   1.475  -0.349  10.877
  115    HZ2  LYS  20           1HZ      LYS  20   0.713   1.157  10.992
  116    HZ3  LYS  20           2HZ      LYS  20   1.795   0.853   9.729
  117    H    ARG  21           H        ARG  21  -2.518  -1.071   7.005
  118    HA   ARG  21           HA       ARG  21  -4.622  -0.584   5.016
  119    HB2  ARG  21           1HB      ARG  21  -4.598  -2.735   7.132
  120    HB3  ARG  21           2HB      ARG  21  -6.071  -2.194   6.337
  121    HG2  ARG  21           1HG      ARG  21  -5.537  -3.187   4.360
  122    HG3  ARG  21           2HG      ARG  21  -3.799  -3.029   4.622
  123    HD2  ARG  21           1HD      ARG  21  -4.189  -4.735   6.535
  124    HD3  ARG  21           2HD      ARG  21  -5.698  -5.081   5.691
  125    HE   ARG  21           HE       ARG  21  -3.708  -5.208   3.785
  126   HH11  ARG  21          1HH1      ARG  21  -4.491  -6.839   6.760
  127   HH12  ARG  21          2HH1      ARG  21  -3.760  -8.335   6.284
  128   HH21  ARG  21          1HH2      ARG  21  -2.742  -7.173   3.147
  129   HH22  ARG  21          2HH2      ARG  21  -2.764  -8.525   4.229
  130    H    PHE  22           H        PHE  22  -6.261   0.737   5.674
  131    HA   PHE  22           HA       PHE  22  -6.530   1.447   8.477
  132    HB2  PHE  22           1HB      PHE  22  -6.040   3.633   6.454
  133    HB3  PHE  22           2HB      PHE  22  -6.141   3.784   8.205
  134    HD1  PHE  22           HD2      PHE  22  -4.082   2.437   5.446
  135    HD2  PHE  22           HD1      PHE  22  -4.240   3.526   9.558
  136    HE1  PHE  22           HE2      PHE  22  -1.640   2.186   5.603
  137    HE2  PHE  22           HE1      PHE  22  -1.797   3.279   9.720
  138    HZ   PHE  22           HZ       PHE  22  -0.494   2.607   7.742
  139    H    THR  23           H        THR  23  -8.466   2.630   8.938
  140    HA   THR  23           HA       THR  23 -10.593   2.003   7.064
  141    HB   THR  23           HB       THR  23 -10.758   3.204   9.835
  142    HG1  THR  23           HG1      THR  23 -11.679   0.853  10.011
  143   HG21  THR  23          3HG2      THR  23 -12.914   1.974   8.115
  144   HG22  THR  23          1HG2      THR  23 -12.713   3.700   8.412
  145   HG23  THR  23          2HG2      THR  23 -13.115   2.616   9.744
  146    H    GLN  24           H        GLN  24  -9.340   4.878   8.743
  147    HA   GLN  24           HA       GLN  24 -10.953   6.586   7.002
  148    HB2  GLN  24           1HB      GLN  24 -10.611   6.818   9.615
  149    HB3  GLN  24           2HB      GLN  24  -9.162   7.684   9.123
  150    HG2  GLN  24           1HG      GLN  24 -10.894   9.275   9.468
  151    HG3  GLN  24           2HG      GLN  24 -10.592   9.165   7.734
  152   HE21  GLN  24          1HE2      GLN  24 -12.848   8.671  10.280
  153   HE22  GLN  24          2HE2      GLN  24 -14.199   8.235   9.295
  154    H    ASN  25           H        ASN  25 -10.123   7.716   5.358
  155    HA   ASN  25           HA       ASN  25  -7.682   7.199   4.216
  156    HB2  ASN  25           1HB      ASN  25  -9.507   8.341   3.038
  157    HB3  ASN  25           2HB      ASN  25  -9.263   9.774   4.031
  158   HD21  ASN  25          1HD2      ASN  25  -9.148   9.611   1.185
  159   HD22  ASN  25          2HD2      ASN  25  -7.550  10.065   0.710
  160    H    SER  26           H        SER  26  -8.499   9.783   6.493
  161    HA   SER  26           HA       SER  26  -6.165  11.247   6.460
  162    HB2  SER  26           1HB      SER  26  -8.203  11.835   7.761
  163    HB3  SER  26           2HB      SER  26  -7.788  10.578   8.927
  164    HG   SER  26           HG       SER  26  -5.791  12.407   8.344
  165    H    HIS  27           H        HIS  27  -6.889   8.370   8.418
  166    HA   HIS  27           HA       HIS  27  -4.623   8.164   9.930
  167    HB2  HIS  27           1HB      HIS  27  -6.724   6.573   9.627
  168    HB3  HIS  27           2HB      HIS  27  -5.602   5.671   8.613
  169    HD1  HIS  27           HD1      HIS  27  -6.284   3.991  10.787
  170    HD2  HIS  27           HD2      HIS  27  -3.502   7.022  11.366
  171    HE1  HIS  27           HE1      HIS  27  -4.987   3.331  12.838
  172    H    LEU  28           H        LEU  28  -5.025   7.189   6.552
  173    HA   LEU  28           HA       LEU  28  -2.430   6.075   6.269
  174    HB2  LEU  28           1HB      LEU  28  -4.049   5.382   4.714
  175    HB3  LEU  28           2HB      LEU  28  -4.502   7.040   4.324
  176    HG   LEU  28           HG       LEU  28  -2.337   7.337   3.183
  177   HD11  LEU  28          1HD1      LEU  28  -0.718   5.953   3.885
  178   HD12  LEU  28          2HD1      LEU  28  -1.372   4.855   2.670
  179   HD13  LEU  28          3HD1      LEU  28  -1.857   4.691   4.357
  180   HD21  LEU  28          3HD2      LEU  28  -4.273   6.696   1.882
  181   HD22  LEU  28          1HD2      LEU  28  -3.991   4.994   2.249
  182   HD23  LEU  28          2HD2      LEU  28  -2.838   5.884   1.254
  183    H    HIS  29           H        HIS  29  -3.714   9.027   4.731
  184    HA   HIS  29           HA       HIS  29  -1.506  10.187   3.769
  185    HB2  HIS  29           1HB      HIS  29  -3.861  11.374   5.181
  186    HB3  HIS  29           2HB      HIS  29  -2.532  12.427   4.705
  187    HD1  HIS  29           HD1      HIS  29  -4.035  13.634   2.978
  188    HD2  HIS  29           HD2      HIS  29  -3.554   9.568   2.271
  189    HE1  HIS  29           HE1      HIS  29  -4.886  13.252   0.642
  190    H    SER  30           H        SER  30  -2.417  10.200   7.190
  191    HA   SER  30           HA       SER  30  -0.120  11.726   7.987
  192    HB2  SER  30           1HB      SER  30  -2.075  11.929   9.352
  193    HB3  SER  30           2HB      SER  30  -2.197  10.181   9.547
  194    HG   SER  30           HG       SER  30  -1.034  11.786  11.180
  195    H    HIS  31           H        HIS  31  -1.087   8.318   8.218
  196    HA   HIS  31           HA       HIS  31   1.055   7.301   9.625
  197    HB2  HIS  31           1HB      HIS  31  -0.581   5.720   9.234
  198    HB3  HIS  31           2HB      HIS  31  -0.767   6.175   7.543
  199    HD1  HIS  31           HD1      HIS  31   1.410   4.120   9.816
  200    HD2  HIS  31           HD2      HIS  31   0.820   4.776   5.756
  201    HE1  HIS  31           HE1      HIS  31   2.740   2.335   8.646
  202    H    GLN  32           H        GLN  32   0.828   7.993   6.165
  203    HA   GLN  32           HA       GLN  32   3.141   6.855   5.227
  204    HB2  GLN  32           1HB      GLN  32   1.627   9.317   4.473
  205    HB3  GLN  32           2HB      GLN  32   3.187   9.020   3.718
  206    HG2  GLN  32           1HG      GLN  32   2.450   7.047   2.702
  207    HG3  GLN  32           2HG      GLN  32   1.032   6.940   3.744
  208   HE21  GLN  32          1HE2      GLN  32   1.349   6.998   0.791
  209   HE22  GLN  32          2HE2      GLN  32   0.319   8.277   0.254
  210    H    ARG  33           H        ARG  33   2.807   9.553   7.357
  211    HA   ARG  33           HA       ARG  33   5.291  10.806   6.940
  212    HB2  ARG  33           1HB      ARG  33   4.834  12.048   8.846
  213    HB3  ARG  33           2HB      ARG  33   3.225  11.575   8.319
  214    HG2  ARG  33           1HG      ARG  33   3.289   9.710   9.946
  215    HG3  ARG  33           2HG      ARG  33   4.843  10.315  10.521
  216    HD2  ARG  33           1HD      ARG  33   2.916  11.040  11.908
  217    HD3  ARG  33           2HD      ARG  33   3.844  12.378  11.230
  218    HE   ARG  33           HE       ARG  33   1.119  11.636  10.584
  219   HH11  ARG  33          1HH1      ARG  33   3.937  13.480   9.702
  220   HH12  ARG  33          2HH1      ARG  33   3.056  14.601   8.717
  221   HH21  ARG  33          1HH2      ARG  33  -0.052  13.104   9.290
  222   HH22  ARG  33          2HH2      ARG  33   0.787  14.386   8.484
  223    H    VAL  34           H        VAL  34   4.328   8.064   8.918
  224    HA   VAL  34           HA       VAL  34   6.485   7.754  10.586
  225    HB   VAL  34           HB       VAL  34   6.008   5.402  10.677
  226   HG11  VAL  34          1HG1      VAL  34   3.293   5.744  10.442
  227   HG12  VAL  34          2HG1      VAL  34   4.262   6.142  11.862
  228   HG13  VAL  34          3HG1      VAL  34   3.877   7.391  10.677
  229   HG21  VAL  34          3HG2      VAL  34   5.461   5.701   7.925
  230   HG22  VAL  34          1HG2      VAL  34   5.482   4.215   8.876
  231   HG23  VAL  34          2HG2      VAL  34   3.980   5.119   8.685
  232    H    HIS  35           H        HIS  35   6.367   7.359   7.151
  233    HA   HIS  35           HA       HIS  35   8.927   5.970   7.064
  234    HB2  HIS  35           1HB      HIS  35   7.135   6.901   4.810
  235    HB3  HIS  35           2HB      HIS  35   8.566   5.890   4.636
  236    HD1  HIS  35           HD1      HIS  35   8.321   3.587   6.278
  237    HD2  HIS  35           HD2      HIS  35   4.890   5.416   4.816
  238    HE1  HIS  35           HE1      HIS  35   6.521   1.836   6.404
  239    H    THR  36           H        THR  36   8.537   8.814   7.996
  240    HA   THR  36           HA       THR  36   9.272  10.845   6.461
  241    HB   THR  36           HB       THR  36  10.963  11.533   8.271
  242    HG1  THR  36           HG1      THR  36   9.898   9.168   9.459
  243   HG21  THR  36          3HG2      THR  36   8.324  11.853   8.118
  244   HG22  THR  36          1HG2      THR  36   9.254  12.395   9.515
  245   HG23  THR  36          2HG2      THR  36   8.381  10.863   9.576
  246    H    GLY  37           H        GLY  37  11.599   8.371   7.538
  247    HA2  GLY  37           1HA      GLY  37  13.956   9.192   6.565
  248    HA3  GLY  37           2HA      GLY  37  13.423   7.529   6.370
  249    H    GLU  38           H        GLU  38  12.253   6.976   4.408
  250    HA   GLU  38           HA       GLU  38  13.525   7.967   2.101
  251    HB2  GLU  38           1HB      GLU  38  11.154   6.179   2.553
  252    HB3  GLU  38           2HB      GLU  38  11.611   6.672   0.928
  253    HG2  GLU  38           1HG      GLU  38  13.955   5.799   1.586
  254    HG3  GLU  38           2HG      GLU  38  13.091   4.947   2.864
  255    H    LYS  39           H        LYS  39  13.112  10.279   2.437
  256    HA   LYS  39           HA       LYS  39  10.941  11.163   0.788
  257    HB2  LYS  39           1HB      LYS  39  10.111  10.860   3.284
  258    HB3  LYS  39           2HB      LYS  39  10.906  12.414   3.499
  259    HG2  LYS  39           1HG      LYS  39   8.648  12.891   3.047
  260    HG3  LYS  39           2HG      LYS  39   9.526  13.251   1.559
  261    HD2  LYS  39           1HD      LYS  39   8.839  11.136   0.602
  262    HD3  LYS  39           2HD      LYS  39   8.052  10.676   2.114
  263    HE2  LYS  39           1HE      LYS  39   6.592  12.706   1.844
  264    HE3  LYS  39           2HE      LYS  39   7.274  12.893   0.229
  265    HZ1  LYS  39           3HZ      LYS  39   6.512  10.524  -0.152
  266    HZ2  LYS  39           1HZ      LYS  39   5.301  11.702  -0.063
  267    HZ3  LYS  39           2HZ      LYS  39   5.593  10.688   1.259
  268    HA   PRO  40           HA       PRO  40  14.130  14.129  -0.008
  269    HB2  PRO  40           1HB      PRO  40  12.702  15.717  -1.684
  270    HB3  PRO  40           2HB      PRO  40  13.349  14.146  -2.169
  271    HG2  PRO  40           1HG      PRO  40  10.576  14.865  -1.301
  272    HG3  PRO  40           2HG      PRO  40  11.095  13.815  -2.633
  273    HD2  PRO  40           1HD      PRO  40  10.248  12.839  -0.253
  274    HD3  PRO  40           2HD      PRO  40  11.480  12.022  -1.236
  275    H    SER  41           H        SER  41  11.264  14.669   1.693
  276    HA   SER  41           HA       SER  41  11.937  17.482   2.215
  277    HB2  SER  41           1HB      SER  41   9.405  15.914   2.300
  278    HB3  SER  41           2HB      SER  41   9.582  17.240   3.450
  279    HG   SER  41           HG       SER  41  10.200  18.511   1.510
  280    H    GLY  42           H        GLY  42  13.085  17.874   3.981
  281    HA2  GLY  42           1HA      GLY  42  13.000  15.929   6.185
  282    HA3  GLY  42           2HA      GLY  42  14.290  17.086   5.894
  283    HA   PRO  43           HA       PRO  43  12.522  19.629   9.010
  284    HB2  PRO  43           1HB      PRO  43  13.618  22.010   8.305
  285    HB3  PRO  43           2HB      PRO  43  14.547  20.714   9.066
  286    HG2  PRO  43           1HG      PRO  43  14.369  21.471   6.175
  287    HG3  PRO  43           2HG      PRO  43  15.795  21.024   7.128
  288    HD2  PRO  43           1HD      PRO  43  14.551  19.287   5.465
  289    HD3  PRO  43           2HD      PRO  43  15.355  18.767   6.960
  290    H    SER  44           H        SER  44  12.092  20.327   5.624
  291    HA   SER  44           HA       SER  44  10.633  21.735   4.514
  292    HB2  SER  44           1HB      SER  44   8.885  20.180   6.429
  293    HB3  SER  44           2HB      SER  44   8.250  21.133   5.088
  294    HG   SER  44           HG       SER  44  10.273  19.346   4.462
  295    H    SER  45           H        SER  45  11.893  23.295   6.333
  296    HA   SER  45           HA       SER  45   9.725  25.055   7.251
  297    HB2  SER  45           1HB      SER  45  10.549  23.972   9.247
  298    HB3  SER  45           2HB      SER  45  12.219  24.315   8.797
  299    HG   SER  45           HG       SER  45  12.001  26.163   9.746
  300    H    GLY  46           H        GLY  46   9.866  26.958   6.277
  301    HA2  GLY  46           1HA      GLY  46  12.263  28.476   6.176
  302    HA3  GLY  46           2HA      GLY  46  11.927  27.768   4.603
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -13.541 -33.135   8.585
    2    HA2  GLY   1           1HA      GLY   1 -15.156 -31.096   9.189
    3    HA3  GLY   1           2HA      GLY   1 -14.027 -31.031  10.534
    4    H    SER   2           H        SER   2 -13.598 -28.862   9.661
    5    HA   SER   2           HA       SER   2 -11.370 -28.981   7.781
    6    HB2  SER   2           1HB      SER   2 -12.274 -26.978   6.553
    7    HB3  SER   2           2HB      SER   2 -13.192 -28.461   6.299
    8    HG   SER   2           HG       SER   2 -14.179 -26.212   7.037
    9    H    SER   3           H        SER   3  -9.717 -27.955   8.668
   10    HA   SER   3           HA       SER   3 -10.247 -25.592  10.342
   11    HB2  SER   3           1HB      SER   3  -8.527 -27.981  10.936
   12    HB3  SER   3           2HB      SER   3  -8.130 -26.410  11.632
   13    HG   SER   3           HG       SER   3 -10.693 -26.726  12.020
   14    H    GLY   4           H        GLY   4  -8.820 -23.897  10.157
   15    HA2  GLY   4           1HA      GLY   4  -6.275 -23.800   9.206
   16    HA3  GLY   4           2HA      GLY   4  -7.248 -23.841   7.743
   17    H    SER   5           H        SER   5  -5.936 -21.708   7.664
   18    HA   SER   5           HA       SER   5  -6.567 -19.510   9.240
   19    HB2  SER   5           1HB      SER   5  -4.731 -19.330   7.729
   20    HB3  SER   5           2HB      SER   5  -5.751 -19.699   6.338
   21    HG   SER   5           HG       SER   5  -6.445 -17.484   7.876
   22    H    SER   6           H        SER   6  -8.092 -17.888   9.131
   23    HA   SER   6           HA       SER   6 -10.128 -17.889   7.088
   24    HB2  SER   6           1HB      SER   6 -12.013 -18.323   8.536
   25    HB3  SER   6           2HB      SER   6 -10.886 -19.671   8.677
   26    HG   SER   6           HG       SER   6 -10.640 -19.212  10.708
   27    H    GLY   7           H        GLY   7 -11.420 -16.009   7.107
   28    HA2  GLY   7           1HA      GLY   7 -12.118 -13.912   7.927
   29    HA3  GLY   7           2HA      GLY   7 -10.890 -14.018   9.180
   30    H    SER   8           H        SER   8 -11.472 -13.312   5.787
   31    HA   SER   8           HA       SER   8  -8.768 -12.331   5.407
   32    HB2  SER   8           1HB      SER   8 -11.133 -12.804   3.653
   33    HB3  SER   8           2HB      SER   8  -9.948 -11.607   3.130
   34    HG   SER   8           HG       SER   8  -8.498 -13.595   3.863
   35    H    GLY   9           H        GLY   9  -8.149 -10.311   5.783
   36    HA2  GLY   9           1HA      GLY   9 -10.246  -8.246   6.036
   37    HA3  GLY   9           2HA      GLY   9  -8.753  -8.252   6.962
   38    H    GLU  10           H        GLU  10 -10.230  -6.612   4.648
   39    HA   GLU  10           HA       GLU  10  -7.719  -5.678   3.515
   40    HB2  GLU  10           1HB      GLU  10  -8.855  -7.514   2.038
   41    HB3  GLU  10           2HB      GLU  10  -9.960  -6.219   1.602
   42    HG2  GLU  10           1HG      GLU  10  -7.856  -4.877   1.029
   43    HG3  GLU  10           2HG      GLU  10  -7.020  -6.428   1.083
   44    H    LYS  11           H        LYS  11  -7.754  -3.540   2.893
   45    HA   LYS  11           HA       LYS  11 -10.311  -2.112   3.168
   46    HB2  LYS  11           1HB      LYS  11  -7.668  -1.451   4.454
   47    HB3  LYS  11           2HB      LYS  11  -8.914  -0.233   4.214
   48    HG2  LYS  11           1HG      LYS  11 -10.471  -1.619   5.540
   49    HG3  LYS  11           2HG      LYS  11  -9.152  -2.752   5.846
   50    HD2  LYS  11           1HD      LYS  11  -7.940  -1.153   7.094
   51    HD3  LYS  11           2HD      LYS  11  -8.960   0.172   6.529
   52    HE2  LYS  11           1HE      LYS  11  -9.619  -0.292   8.759
   53    HE3  LYS  11           2HE      LYS  11 -10.878  -0.948   7.714
   54    HZ1  LYS  11           3HZ      LYS  11 -10.597  -2.846   8.804
   55    HZ2  LYS  11           1HZ      LYS  11  -9.195  -2.297   9.576
   56    HZ3  LYS  11           2HZ      LYS  11  -9.095  -3.001   8.042
   57    HA   PRO  12           HA       PRO  12  -9.285  -0.071  -0.580
   58    HB2  PRO  12           1HB      PRO  12 -10.414   2.367  -0.190
   59    HB3  PRO  12           2HB      PRO  12 -11.363   0.905  -0.483
   60    HG2  PRO  12           1HG      PRO  12 -10.743   2.273   2.107
   61    HG3  PRO  12           2HG      PRO  12 -12.277   1.581   1.546
   62    HD2  PRO  12           1HD      PRO  12 -10.639   0.288   3.272
   63    HD3  PRO  12           2HD      PRO  12 -11.650  -0.569   2.090
   64    H    PHE  13           H        PHE  13  -8.621   1.768   2.379
   65    HA   PHE  13           HA       PHE  13  -6.586   3.344   1.023
   66    HB2  PHE  13           1HB      PHE  13  -7.185   3.438   3.970
   67    HB3  PHE  13           2HB      PHE  13  -6.531   4.708   2.941
   68    HD1  PHE  13           HD1      PHE  13  -8.084   5.636   1.112
   69    HD2  PHE  13           HD2      PHE  13  -9.447   3.382   4.455
   70    HE1  PHE  13           HE1      PHE  13 -10.346   6.554   0.804
   71    HE2  PHE  13           HE2      PHE  13 -11.711   4.295   4.152
   72    HZ   PHE  13           HZ       PHE  13 -12.163   5.883   2.325
   73    H    GLN  14           H        GLN  14  -4.776   2.207   0.632
   74    HA   GLN  14           HA       GLN  14  -3.489   0.897   2.932
   75    HB2  GLN  14           1HB      GLN  14  -3.649  -0.076   0.080
   76    HB3  GLN  14           2HB      GLN  14  -2.495  -0.711   1.245
   77    HG2  GLN  14           1HG      GLN  14  -4.173  -1.663   2.563
   78    HG3  GLN  14           2HG      GLN  14  -5.438  -0.701   1.801
   79   HE21  GLN  14          1HE2      GLN  14  -2.885  -2.954   0.784
   80   HE22  GLN  14          2HE2      GLN  14  -3.889  -3.881  -0.272
   81    H    CYS  15           H        CYS  15  -1.261   1.100   3.095
   82    HA   CYS  15           HA       CYS  15  -0.136   3.468   2.054
   83    HB2  CYS  15           1HB      CYS  15   0.460   2.050   4.189
   84    HB3  CYS  15           2HB      CYS  15   1.587   1.253   3.096
   85    H    GLU  16           H        GLU  16   2.218   3.275   1.067
   86    HA   GLU  16           HA       GLU  16   2.012   1.496  -1.273
   87    HB2  GLU  16           1HB      GLU  16   1.869   4.143  -1.451
   88    HB3  GLU  16           2HB      GLU  16   3.620   4.002  -1.397
   89    HG2  GLU  16           1HG      GLU  16   2.153   2.263  -3.296
   90    HG3  GLU  16           2HG      GLU  16   2.271   3.982  -3.669
   91    H    GLU  17           H        GLU  17   3.980   2.654   1.321
   92    HA   GLU  17           HA       GLU  17   6.363   1.331   0.266
   93    HB2  GLU  17           1HB      GLU  17   5.937   3.070   2.699
   94    HB3  GLU  17           2HB      GLU  17   7.471   2.315   2.290
   95    HG2  GLU  17           1HG      GLU  17   7.683   3.605   0.316
   96    HG3  GLU  17           2HG      GLU  17   6.022   4.185   0.439
   97    H    CYS  18           H        CYS  18   3.838   0.898   2.579
   98    HA   CYS  18           HA       CYS  18   5.078  -1.633   3.416
   99    HB2  CYS  18           1HB      CYS  18   4.345  -1.315   5.695
  100    HB3  CYS  18           2HB      CYS  18   5.308   0.078   5.215
  101    H    GLY  19           H        GLY  19   2.532  -0.130   1.953
  102    HA2  GLY  19           1HA      GLY  19   0.318  -0.683   1.566
  103    HA3  GLY  19           2HA      GLY  19   1.010  -2.286   1.372
  104    H    LYS  20           H        LYS  20   0.169  -0.109   4.071
  105    HA   LYS  20           HA       LYS  20  -0.691  -2.407   5.639
  106    HB2  LYS  20           1HB      LYS  20   0.040   0.403   6.202
  107    HB3  LYS  20           2HB      LYS  20  -1.213  -0.279   7.230
  108    HG2  LYS  20           1HG      LYS  20   0.531  -2.268   7.394
  109    HG3  LYS  20           2HG      LYS  20   1.662  -0.964   7.027
  110    HD2  LYS  20           1HD      LYS  20   1.586  -0.941   9.347
  111    HD3  LYS  20           2HD      LYS  20   0.426   0.315   8.907
  112    HE2  LYS  20           1HE      LYS  20  -1.390  -1.366   9.130
  113    HE3  LYS  20           2HE      LYS  20  -0.194  -2.528   9.702
  114    HZ1  LYS  20           3HZ      LYS  20  -1.234  -1.567  11.588
  115    HZ2  LYS  20           1HZ      LYS  20  -1.003   0.007  11.012
  116    HZ3  LYS  20           2HZ      LYS  20   0.325  -0.916  11.507
  117    H    ARG  21           H        ARG  21  -2.707  -1.566   7.156
  118    HA   ARG  21           HA       ARG  21  -4.846  -0.898   5.241
  119    HB2  ARG  21           1HB      ARG  21  -4.958  -2.743   7.633
  120    HB3  ARG  21           2HB      ARG  21  -6.345  -2.287   6.653
  121    HG2  ARG  21           1HG      ARG  21  -5.681  -3.567   4.868
  122    HG3  ARG  21           2HG      ARG  21  -3.978  -3.514   5.328
  123    HD2  ARG  21           1HD      ARG  21  -6.048  -4.943   6.974
  124    HD3  ARG  21           2HD      ARG  21  -5.198  -5.727   5.643
  125    HE   ARG  21           HE       ARG  21  -3.170  -4.766   7.109
  126   HH11  ARG  21          1HH1      ARG  21  -6.006  -6.591   7.976
  127   HH12  ARG  21          2HH1      ARG  21  -5.244  -7.387   9.313
  128   HH21  ARG  21          1HH2      ARG  21  -2.157  -5.808   8.867
  129   HH22  ARG  21          2HH2      ARG  21  -3.055  -6.941   9.820
  130    H    PHE  22           H        PHE  22  -6.278   0.664   5.784
  131    HA   PHE  22           HA       PHE  22  -6.342   1.674   8.521
  132    HB2  PHE  22           1HB      PHE  22  -5.855   3.519   6.176
  133    HB3  PHE  22           2HB      PHE  22  -5.934   3.964   7.877
  134    HD1  PHE  22           HD2      PHE  22  -3.951   2.113   5.369
  135    HD2  PHE  22           HD1      PHE  22  -4.037   3.839   9.259
  136    HE1  PHE  22           HE2      PHE  22  -1.519   1.794   5.561
  137    HE2  PHE  22           HE1      PHE  22  -1.605   3.523   9.457
  138    HZ   PHE  22           HZ       PHE  22  -0.343   2.498   7.607
  139    H    THR  23           H        THR  23  -8.370   2.029   9.122
  140    HA   THR  23           HA       THR  23 -10.577   1.590   7.482
  141    HB   THR  23           HB       THR  23 -10.607   3.276   9.988
  142    HG1  THR  23           HG1      THR  23 -11.079   0.502   9.995
  143   HG21  THR  23          3HG2      THR  23 -12.793   1.415   9.532
  144   HG22  THR  23          1HG2      THR  23 -12.640   2.599   8.235
  145   HG23  THR  23          2HG2      THR  23 -12.838   3.139   9.902
  146    H    GLN  24           H        GLN  24  -9.261   4.687   8.655
  147    HA   GLN  24           HA       GLN  24 -10.926   6.086   6.687
  148    HB2  GLN  24           1HB      GLN  24  -9.438   7.050   9.128
  149    HB3  GLN  24           2HB      GLN  24 -10.185   8.141   7.970
  150    HG2  GLN  24           1HG      GLN  24 -11.857   5.985   9.135
  151    HG3  GLN  24           2HG      GLN  24 -11.429   7.357  10.157
  152   HE21  GLN  24          1HE2      GLN  24 -13.011   6.393   7.183
  153   HE22  GLN  24          2HE2      GLN  24 -14.008   7.796   7.035
  154    H    ASN  25           H        ASN  25  -9.983   7.792   5.403
  155    HA   ASN  25           HA       ASN  25  -7.511   7.000   4.219
  156    HB2  ASN  25           1HB      ASN  25  -9.399   8.018   2.948
  157    HB3  ASN  25           2HB      ASN  25  -9.082   9.546   3.765
  158   HD21  ASN  25          1HD2      ASN  25  -8.548  10.681   1.954
  159   HD22  ASN  25          2HD2      ASN  25  -7.122  10.378   1.026
  160    H    SER  26           H        SER  26  -8.527   9.741   6.224
  161    HA   SER  26           HA       SER  26  -6.243  11.273   6.191
  162    HB2  SER  26           1HB      SER  26  -8.226  12.048   7.329
  163    HB3  SER  26           2HB      SER  26  -8.129  10.729   8.494
  164    HG   SER  26           HG       SER  26  -6.043  11.663   9.096
  165    H    HIS  27           H        HIS  27  -6.962   8.515   8.312
  166    HA   HIS  27           HA       HIS  27  -4.704   8.549   9.902
  167    HB2  HIS  27           1HB      HIS  27  -6.565   6.420   8.973
  168    HB3  HIS  27           2HB      HIS  27  -5.057   5.908   9.725
  169    HD1  HIS  27           HD1      HIS  27  -5.886   5.115  11.948
  170    HD2  HIS  27           HD2      HIS  27  -7.288   8.907  10.992
  171    HE1  HIS  27           HE1      HIS  27  -7.041   5.948  14.022
  172    H    LEU  28           H        LEU  28  -5.100   7.288   6.637
  173    HA   LEU  28           HA       LEU  28  -2.559   6.030   6.484
  174    HB2  LEU  28           1HB      LEU  28  -4.182   5.294   4.957
  175    HB3  LEU  28           2HB      LEU  28  -4.561   6.936   4.442
  176    HG   LEU  28           HG       LEU  28  -2.304   7.035   3.370
  177   HD11  LEU  28          1HD1      LEU  28  -0.821   5.364   3.476
  178   HD12  LEU  28          2HD1      LEU  28  -2.059   4.123   3.285
  179   HD13  LEU  28          3HD1      LEU  28  -1.753   4.825   4.873
  180   HD21  LEU  28          3HD2      LEU  28  -3.144   6.237   1.424
  181   HD22  LEU  28          1HD2      LEU  28  -4.625   6.149   2.378
  182   HD23  LEU  28          2HD2      LEU  28  -3.644   4.703   2.138
  183    H    HIS  29           H        HIS  29  -3.731   9.014   4.913
  184    HA   HIS  29           HA       HIS  29  -1.451   9.976   3.823
  185    HB2  HIS  29           1HB      HIS  29  -3.691  11.410   5.222
  186    HB3  HIS  29           2HB      HIS  29  -2.343  12.308   4.530
  187    HD1  HIS  29           HD1      HIS  29  -2.458  12.800   2.084
  188    HD2  HIS  29           HD2      HIS  29  -5.172   9.873   3.237
  189    HE1  HIS  29           HE1      HIS  29  -3.879  12.363   0.055
  190    H    SER  30           H        SER  30  -2.414  10.428   7.216
  191    HA   SER  30           HA       SER  30  -0.040  11.822   7.938
  192    HB2  SER  30           1HB      SER  30  -2.137  12.050   9.211
  193    HB3  SER  30           2HB      SER  30  -2.023  10.360   9.700
  194    HG   SER  30           HG       SER  30  -1.172  11.614  11.334
  195    H    HIS  31           H        HIS  31  -1.074   8.453   8.145
  196    HA   HIS  31           HA       HIS  31   1.041   7.455   9.675
  197    HB2  HIS  31           1HB      HIS  31  -0.611   5.881   9.443
  198    HB3  HIS  31           2HB      HIS  31  -0.915   6.291   7.757
  199    HD1  HIS  31           HD1      HIS  31   1.094   4.048   9.927
  200    HD2  HIS  31           HD2      HIS  31   0.774   4.986   5.893
  201    HE1  HIS  31           HE1      HIS  31   2.352   2.239   8.715
  202    H    GLN  32           H        GLN  32   0.851   8.303   6.299
  203    HA   GLN  32           HA       GLN  32   3.045   6.904   5.298
  204    HB2  GLN  32           1HB      GLN  32   1.963   9.613   4.511
  205    HB3  GLN  32           2HB      GLN  32   3.154   8.715   3.580
  206    HG2  GLN  32           1HG      GLN  32   1.533   6.887   3.308
  207    HG3  GLN  32           2HG      GLN  32   0.339   7.840   4.188
  208   HE21  GLN  32          1HE2      GLN  32  -0.745   7.320   2.044
  209   HE22  GLN  32          2HE2      GLN  32  -0.569   8.501   0.796
  210    H    ARG  33           H        ARG  33   2.924   9.520   7.497
  211    HA   ARG  33           HA       ARG  33   5.437  10.706   6.979
  212    HB2  ARG  33           1HB      ARG  33   3.805  10.586   9.520
  213    HB3  ARG  33           2HB      ARG  33   5.227  11.597   9.300
  214    HG2  ARG  33           1HG      ARG  33   4.069  12.735   7.429
  215    HG3  ARG  33           2HG      ARG  33   2.628  11.785   7.794
  216    HD2  ARG  33           1HD      ARG  33   2.159  13.665   8.999
  217    HD3  ARG  33           2HD      ARG  33   3.043  12.748  10.219
  218    HE   ARG  33           HE       ARG  33   4.784  14.254  10.064
  219   HH11  ARG  33          1HH1      ARG  33   2.463  14.836   7.535
  220   HH12  ARG  33          2HH1      ARG  33   3.152  16.358   7.074
  221   HH21  ARG  33          1HH2      ARG  33   5.699  16.256   9.467
  222   HH22  ARG  33          2HH2      ARG  33   4.993  17.164   8.174
  223    H    VAL  34           H        VAL  34   4.524   7.762   8.491
  224    HA   VAL  34           HA       VAL  34   6.730   7.398  10.217
  225    HB   VAL  34           HB       VAL  34   6.141   5.045  10.247
  226   HG11  VAL  34          1HG1      VAL  34   4.176   7.175  10.597
  227   HG12  VAL  34          2HG1      VAL  34   3.458   5.577  10.390
  228   HG13  VAL  34          3HG1      VAL  34   4.627   5.859  11.680
  229   HG21  VAL  34          3HG2      VAL  34   3.928   4.709   8.670
  230   HG22  VAL  34          1HG2      VAL  34   4.974   5.697   7.649
  231   HG23  VAL  34          2HG2      VAL  34   5.555   4.154   8.276
  232    H    HIS  35           H        HIS  35   6.620   7.587   6.888
  233    HA   HIS  35           HA       HIS  35   9.091   6.004   6.617
  234    HB2  HIS  35           1HB      HIS  35   7.211   6.704   4.363
  235    HB3  HIS  35           2HB      HIS  35   8.524   5.530   4.349
  236    HD1  HIS  35           HD1      HIS  35   8.103   3.414   6.044
  237    HD2  HIS  35           HD2      HIS  35   4.781   5.624   4.885
  238    HE1  HIS  35           HE1      HIS  35   6.119   1.942   6.513
  239    H    THR  36           H        THR  36   8.178   9.028   7.069
  240    HA   THR  36           HA       THR  36   8.921  10.755   5.178
  241    HB   THR  36           HB       THR  36  10.234  12.022   7.055
  242    HG1  THR  36           HG1      THR  36   8.919   9.974   8.544
  243   HG21  THR  36          3HG2      THR  36   7.961  12.570   6.297
  244   HG22  THR  36          1HG2      THR  36   8.128  12.759   8.042
  245   HG23  THR  36          2HG2      THR  36   7.309  11.344   7.382
  246    H    GLY  37           H        GLY  37  10.380  10.107   3.640
  247    HA2  GLY  37           1HA      GLY  37  12.637  10.511   2.918
  248    HA3  GLY  37           2HA      GLY  37  13.188  10.050   4.522
  249    H    GLU  38           H        GLU  38  12.762   9.032   1.354
  250    HA   GLU  38           HA       GLU  38  12.678   6.194   2.045
  251    HB2  GLU  38           1HB      GLU  38  12.420   5.810  -0.357
  252    HB3  GLU  38           2HB      GLU  38  11.225   6.958   0.229
  253    HG2  GLU  38           1HG      GLU  38  12.163   8.721  -0.888
  254    HG3  GLU  38           2HG      GLU  38  13.770   7.997  -0.905
  255    H    LYS  39           H        LYS  39  14.214   4.718   0.986
  256    HA   LYS  39           HA       LYS  39  16.845   5.954   0.525
  257    HB2  LYS  39           1HB      LYS  39  17.871   4.025   1.716
  258    HB3  LYS  39           2HB      LYS  39  16.898   5.053   2.759
  259    HG2  LYS  39           1HG      LYS  39  15.670   2.637   1.513
  260    HG3  LYS  39           2HG      LYS  39  16.714   2.466   2.927
  261    HD2  LYS  39           1HD      LYS  39  15.253   3.574   4.308
  262    HD3  LYS  39           2HD      LYS  39  14.550   4.514   2.990
  263    HE2  LYS  39           1HE      LYS  39  13.554   2.347   2.151
  264    HE3  LYS  39           2HE      LYS  39  14.054   1.625   3.680
  265    HZ1  LYS  39           3HZ      LYS  39  11.746   3.102   3.151
  266    HZ2  LYS  39           1HZ      LYS  39  12.689   4.016   4.217
  267    HZ3  LYS  39           2HZ      LYS  39  12.242   2.437   4.625
  268    HA   PRO  40           HA       PRO  40  16.744   3.561  -3.188
  269    HB2  PRO  40           1HB      PRO  40  19.363   3.815  -3.856
  270    HB3  PRO  40           2HB      PRO  40  18.192   5.126  -4.044
  271    HG2  PRO  40           1HG      PRO  40  20.187   4.667  -1.859
  272    HG3  PRO  40           2HG      PRO  40  19.762   6.176  -2.688
  273    HD2  PRO  40           1HD      PRO  40  18.796   5.536  -0.241
  274    HD3  PRO  40           2HD      PRO  40  17.866   6.488  -1.415
  275    H    SER  41           H        SER  41  19.603   3.031  -1.113
  276    HA   SER  41           HA       SER  41  19.152   0.139  -1.357
  277    HB2  SER  41           1HB      SER  41  21.811   1.547  -1.692
  278    HB3  SER  41           2HB      SER  41  21.609  -0.201  -1.564
  279    HG   SER  41           HG       SER  41  20.122   0.102  -3.436
  280    H    GLY  42           H        GLY  42  18.402   1.818   0.783
  281    HA2  GLY  42           1HA      GLY  42  18.679   2.135   3.054
  282    HA3  GLY  42           2HA      GLY  42  19.127   0.437   3.006
  283    HA   PRO  43           HA       PRO  43  22.727   2.682   4.781
  284    HB2  PRO  43           1HB      PRO  43  23.320   0.741   6.584
  285    HB3  PRO  43           2HB      PRO  43  22.126   2.007   6.893
  286    HG2  PRO  43           1HG      PRO  43  21.703  -0.822   6.011
  287    HG3  PRO  43           2HG      PRO  43  20.809   0.118   7.220
  288    HD2  PRO  43           1HD      PRO  43  19.886  -0.271   4.704
  289    HD3  PRO  43           2HD      PRO  43  19.551   1.208   5.625
  290    H    SER  44           H        SER  44  23.928   2.395   2.869
  291    HA   SER  44           HA       SER  44  25.641   0.017   2.899
  292    HB2  SER  44           1HB      SER  44  25.401  -0.402   0.576
  293    HB3  SER  44           2HB      SER  44  23.758  -0.187   1.180
  294    HG   SER  44           HG       SER  44  23.797   1.108  -0.544
  295    H    SER  45           H        SER  45  27.424   0.401   1.085
  296    HA   SER  45           HA       SER  45  28.463   3.118   1.547
  297    HB2  SER  45           1HB      SER  45  29.798   1.332   2.604
  298    HB3  SER  45           2HB      SER  45  30.013   0.567   1.030
  299    HG   SER  45           HG       SER  45  31.739   1.790   1.013
  300    H    GLY  46           H        GLY  46  28.796   0.447  -0.803
  301    HA2  GLY  46           1HA      GLY  46  29.645   2.162  -2.910
  302    HA3  GLY  46           2HA      GLY  46  29.138   0.488  -3.078
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1 -15.129 -23.421  -9.406
    2    HA2  GLY   1           1HA      GLY   1 -16.207 -21.507  -8.740
    3    HA3  GLY   1           2HA      GLY   1 -17.276 -22.559  -7.823
    4    H    SER   2           H        SER   2 -14.728 -20.294  -7.682
    5    HA   SER   2           HA       SER   2 -13.776 -20.922  -5.066
    6    HB2  SER   2           1HB      SER   2 -13.539 -18.444  -6.780
    7    HB3  SER   2           2HB      SER   2 -12.781 -18.597  -5.195
    8    HG   SER   2           HG       SER   2 -11.822 -19.410  -7.490
    9    H    SER   3           H        SER   3 -15.480 -21.057  -3.642
   10    HA   SER   3           HA       SER   3 -17.098 -18.630  -3.262
   11    HB2  SER   3           1HB      SER   3 -17.594 -21.503  -2.461
   12    HB3  SER   3           2HB      SER   3 -18.601 -20.158  -1.925
   13    HG   SER   3           HG       SER   3 -18.093 -20.465  -4.663
   14    H    GLY   4           H        GLY   4 -15.462 -17.522  -2.089
   15    HA2  GLY   4           1HA      GLY   4 -15.554 -18.058   0.737
   16    HA3  GLY   4           2HA      GLY   4 -13.968 -18.347   0.036
   17    H    SER   5           H        SER   5 -16.271 -15.977   1.029
   18    HA   SER   5           HA       SER   5 -14.880 -13.733  -0.111
   19    HB2  SER   5           1HB      SER   5 -16.458 -12.388   1.289
   20    HB3  SER   5           2HB      SER   5 -17.266 -13.547   0.234
   21    HG   SER   5           HG       SER   5 -17.553 -13.319   2.816
   22    H    SER   6           H        SER   6 -13.973 -11.985   1.202
   23    HA   SER   6           HA       SER   6 -12.616 -13.032   3.600
   24    HB2  SER   6           1HB      SER   6 -11.638 -11.388   1.311
   25    HB3  SER   6           2HB      SER   6 -10.951 -11.074   2.905
   26    HG   SER   6           HG       SER   6 -10.651 -13.260   1.243
   27    H    GLY   7           H        GLY   7 -13.506 -12.189   5.367
   28    HA2  GLY   7           1HA      GLY   7 -14.810  -9.604   5.302
   29    HA3  GLY   7           2HA      GLY   7 -14.729 -10.700   6.673
   30    H    SER   8           H        SER   8 -12.196 -11.016   7.279
   31    HA   SER   8           HA       SER   8 -11.445  -8.491   8.369
   32    HB2  SER   8           1HB      SER   8 -11.071 -10.754   9.451
   33    HB3  SER   8           2HB      SER   8  -9.752 -10.994   8.305
   34    HG   SER   8           HG       SER   8  -9.982  -8.999  10.302
   35    H    GLY   9           H        GLY   9 -10.348  -6.940   7.379
   36    HA2  GLY   9           1HA      GLY   9  -8.384  -6.126   6.307
   37    HA3  GLY   9           2HA      GLY   9  -8.209  -7.683   5.511
   38    H    GLU  10           H        GLU  10  -7.961  -6.650   3.491
   39    HA   GLU  10           HA       GLU  10  -8.725  -6.017   1.440
   40    HB2  GLU  10           1HB      GLU  10 -10.715  -7.539   2.302
   41    HB3  GLU  10           2HB      GLU  10 -11.569  -6.003   2.344
   42    HG2  GLU  10           1HG      GLU  10 -10.081  -6.774  -0.117
   43    HG3  GLU  10           2HG      GLU  10 -11.644  -7.515   0.221
   44    H    LYS  11           H        LYS  11  -8.178  -4.124   3.612
   45    HA   LYS  11           HA       LYS  11 -10.029  -1.979   3.520
   46    HB2  LYS  11           1HB      LYS  11  -7.995  -2.541   5.150
   47    HB3  LYS  11           2HB      LYS  11  -7.148  -1.449   4.062
   48    HG2  LYS  11           1HG      LYS  11  -7.941  -0.161   5.886
   49    HG3  LYS  11           2HG      LYS  11  -8.947   0.236   4.491
   50    HD2  LYS  11           1HD      LYS  11 -10.539  -0.037   6.135
   51    HD3  LYS  11           2HD      LYS  11 -10.488  -1.655   5.432
   52    HE2  LYS  11           1HE      LYS  11  -8.665  -2.073   7.255
   53    HE3  LYS  11           2HE      LYS  11  -9.405  -0.679   8.040
   54    HZ1  LYS  11           3HZ      LYS  11 -10.240  -3.218   8.322
   55    HZ2  LYS  11           1HZ      LYS  11 -11.287  -2.660   7.116
   56    HZ3  LYS  11           2HZ      LYS  11 -11.203  -1.857   8.602
   57    HA   PRO  12           HA       PRO  12  -9.026  -0.423  -0.511
   58    HB2  PRO  12           1HB      PRO  12 -10.469   1.870  -0.330
   59    HB3  PRO  12           2HB      PRO  12 -11.209   0.288  -0.603
   60    HG2  PRO  12           1HG      PRO  12 -10.946   1.843   1.942
   61    HG3  PRO  12           2HG      PRO  12 -12.340   0.938   1.322
   62    HD2  PRO  12           1HD      PRO  12 -10.683  -0.057   3.219
   63    HD3  PRO  12           2HD      PRO  12 -11.495  -1.089   2.024
   64    H    PHE  13           H        PHE  13  -8.510   1.298   2.485
   65    HA   PHE  13           HA       PHE  13  -6.716   3.196   1.155
   66    HB2  PHE  13           1HB      PHE  13  -7.683   3.160   4.022
   67    HB3  PHE  13           2HB      PHE  13  -6.750   4.442   3.257
   68    HD1  PHE  13           HD1      PHE  13  -7.784   5.821   1.475
   69    HD2  PHE  13           HD2      PHE  13 -10.028   3.017   3.759
   70    HE1  PHE  13           HE1      PHE  13  -9.870   6.922   0.772
   71    HE2  PHE  13           HE2      PHE  13 -12.116   4.113   3.059
   72    HZ   PHE  13           HZ       PHE  13 -12.039   6.067   1.563
   73    H    GLN  14           H        GLN  14  -5.006   1.747   0.741
   74    HA   GLN  14           HA       GLN  14  -3.568   0.821   3.139
   75    HB2  GLN  14           1HB      GLN  14  -3.133  -0.257   0.364
   76    HB3  GLN  14           2HB      GLN  14  -2.684  -0.983   1.902
   77    HG2  GLN  14           1HG      GLN  14  -5.143  -1.192   2.393
   78    HG3  GLN  14           2HG      GLN  14  -5.431  -0.730   0.716
   79   HE21  GLN  14          1HE2      GLN  14  -3.118  -2.880   2.339
   80   HE22  GLN  14          2HE2      GLN  14  -3.462  -4.265   1.365
   81    H    CYS  15           H        CYS  15  -1.280   1.026   3.178
   82    HA   CYS  15           HA       CYS  15  -0.327   3.494   2.186
   83    HB2  CYS  15           1HB      CYS  15   0.436   1.993   4.229
   84    HB3  CYS  15           2HB      CYS  15   1.577   1.360   3.047
   85    H    GLU  16           H        GLU  16   2.033   3.398   1.127
   86    HA   GLU  16           HA       GLU  16   1.749   1.774  -1.315
   87    HB2  GLU  16           1HB      GLU  16   1.655   4.429  -1.296
   88    HB3  GLU  16           2HB      GLU  16   3.404   4.252  -1.303
   89    HG2  GLU  16           1HG      GLU  16   3.397   3.157  -3.375
   90    HG3  GLU  16           2HG      GLU  16   1.662   2.852  -3.300
   91    H    GLU  17           H        GLU  17   3.753   2.602   1.347
   92    HA   GLU  17           HA       GLU  17   6.069   1.271   0.125
   93    HB2  GLU  17           1HB      GLU  17   5.882   2.971   2.618
   94    HB3  GLU  17           2HB      GLU  17   7.355   2.221   2.018
   95    HG2  GLU  17           1HG      GLU  17   5.726   4.238   0.492
   96    HG3  GLU  17           2HG      GLU  17   7.150   4.621   1.458
   97    H    CYS  18           H        CYS  18   3.610   0.906   2.497
   98    HA   CYS  18           HA       CYS  18   4.827  -1.635   3.342
   99    HB2  CYS  18           1HB      CYS  18   4.115  -1.296   5.617
  100    HB3  CYS  18           2HB      CYS  18   5.056   0.107   5.122
  101    H    GLY  19           H        GLY  19   2.287  -0.123   1.871
  102    HA2  GLY  19           1HA      GLY  19   0.131  -0.726   1.348
  103    HA3  GLY  19           2HA      GLY  19   0.755  -2.366   1.433
  104    H    LYS  20           H        LYS  20   0.736  -0.276   4.222
  105    HA   LYS  20           HA       LYS  20  -0.491  -2.080   5.918
  106    HB2  LYS  20           1HB      LYS  20   0.006   0.846   5.976
  107    HB3  LYS  20           2HB      LYS  20  -1.175   0.222   7.121
  108    HG2  LYS  20           1HG      LYS  20   1.437  -1.171   6.927
  109    HG3  LYS  20           2HG      LYS  20   1.392   0.409   7.712
  110    HD2  LYS  20           1HD      LYS  20  -0.041  -0.333   9.393
  111    HD3  LYS  20           2HD      LYS  20  -0.574  -1.729   8.454
  112    HE2  LYS  20           1HE      LYS  20   1.985  -2.369   8.633
  113    HE3  LYS  20           2HE      LYS  20   1.900  -1.341  10.062
  114    HZ1  LYS  20           3HZ      LYS  20   1.239  -3.969   9.968
  115    HZ2  LYS  20           1HZ      LYS  20  -0.271  -3.210   9.883
  116    HZ3  LYS  20           2HZ      LYS  20   0.768  -2.884  11.177
  117    H    ARG  21           H        ARG  21  -2.605  -1.154   7.206
  118    HA   ARG  21           HA       ARG  21  -4.704  -0.762   5.180
  119    HB2  ARG  21           1HB      ARG  21  -4.715  -2.686   7.509
  120    HB3  ARG  21           2HB      ARG  21  -6.156  -2.255   6.598
  121    HG2  ARG  21           1HG      ARG  21  -5.533  -3.456   4.769
  122    HG3  ARG  21           2HG      ARG  21  -3.809  -3.247   5.082
  123    HD2  ARG  21           1HD      ARG  21  -5.476  -4.870   6.956
  124    HD3  ARG  21           2HD      ARG  21  -4.933  -5.575   5.433
  125    HE   ARG  21           HE       ARG  21  -2.833  -4.345   6.970
  126   HH11  ARG  21          1HH1      ARG  21  -4.665  -7.253   6.418
  127   HH12  ARG  21          2HH1      ARG  21  -3.437  -8.302   7.047
  128   HH21  ARG  21          1HH2      ARG  21  -1.209  -5.714   7.800
  129   HH22  ARG  21          2HH2      ARG  21  -1.472  -7.425   7.834
  130    H    PHE  22           H        PHE  22  -6.265   0.687   5.672
  131    HA   PHE  22           HA       PHE  22  -6.547   1.641   8.411
  132    HB2  PHE  22           1HB      PHE  22  -5.961   3.519   6.113
  133    HB3  PHE  22           2HB      PHE  22  -6.301   3.988   7.775
  134    HD1  PHE  22           HD1      PHE  22  -4.669   3.454   9.563
  135    HD2  PHE  22           HD2      PHE  22  -3.802   2.830   5.443
  136    HE1  PHE  22           HE1      PHE  22  -2.269   3.328  10.090
  137    HE2  PHE  22           HE2      PHE  22  -1.401   2.703   5.964
  138    HZ   PHE  22           HZ       PHE  22  -0.632   2.951   8.290
  139    H    THR  23           H        THR  23  -8.572   2.368   8.895
  140    HA   THR  23           HA       THR  23 -10.651   1.764   6.997
  141    HB   THR  23           HB       THR  23 -12.170   2.564   8.879
  142    HG1  THR  23           HG1      THR  23 -10.049   3.634   9.812
  143   HG21  THR  23          3HG2      THR  23 -10.367   0.443   9.942
  144   HG22  THR  23          1HG2      THR  23 -11.183   0.160   8.405
  145   HG23  THR  23          2HG2      THR  23 -12.127   0.488   9.859
  146    H    GLN  24           H        GLN  24  -8.823   4.500   7.745
  147    HA   GLN  24           HA       GLN  24 -10.621   6.169   6.165
  148    HB2  GLN  24           1HB      GLN  24  -9.872   6.635   9.004
  149    HB3  GLN  24           2HB      GLN  24  -9.906   8.034   7.940
  150    HG2  GLN  24           1HG      GLN  24 -12.043   8.080   8.697
  151    HG3  GLN  24           2HG      GLN  24 -12.257   7.052   7.281
  152   HE21  GLN  24          1HE2      GLN  24 -13.623   5.485   7.707
  153   HE22  GLN  24          2HE2      GLN  24 -13.704   4.567   9.168
  154    H    ASN  25           H        ASN  25  -9.533   7.251   4.659
  155    HA   ASN  25           HA       ASN  25  -6.913   6.959   4.037
  156    HB2  ASN  25           1HB      ASN  25  -7.154   8.690   2.502
  157    HB3  ASN  25           2HB      ASN  25  -8.827   8.219   2.788
  158   HD21  ASN  25          1HD2      ASN  25  -9.897   9.442   4.615
  159   HD22  ASN  25          2HD2      ASN  25  -9.602  11.144   4.676
  160    H    SER  26           H        SER  26  -8.224   9.703   5.898
  161    HA   SER  26           HA       SER  26  -6.087  11.218   6.422
  162    HB2  SER  26           1HB      SER  26  -8.454  11.289   7.479
  163    HB3  SER  26           2HB      SER  26  -7.743  10.316   8.767
  164    HG   SER  26           HG       SER  26  -6.125  12.374   8.216
  165    H    HIS  27           H        HIS  27  -6.842   8.366   8.431
  166    HA   HIS  27           HA       HIS  27  -4.595   8.335  10.010
  167    HB2  HIS  27           1HB      HIS  27  -6.457   6.236   9.019
  168    HB3  HIS  27           2HB      HIS  27  -4.955   5.697   9.764
  169    HD1  HIS  27           HD1      HIS  27  -8.228   5.984  10.720
  170    HD2  HIS  27           HD2      HIS  27  -4.735   7.535  12.347
  171    HE1  HIS  27           HE1      HIS  27  -8.770   6.481  13.125
  172    H    LEU  28           H        LEU  28  -4.970   7.073   6.734
  173    HA   LEU  28           HA       LEU  28  -2.384   5.887   6.605
  174    HB2  LEU  28           1HB      LEU  28  -3.898   4.999   5.092
  175    HB3  LEU  28           2HB      LEU  28  -4.499   6.584   4.612
  176    HG   LEU  28           HG       LEU  28  -2.349   6.972   3.419
  177   HD11  LEU  28          1HD1      LEU  28  -0.694   5.402   3.247
  178   HD12  LEU  28          2HD1      LEU  28  -1.780   4.055   3.582
  179   HD13  LEU  28          3HD1      LEU  28  -1.243   5.101   4.895
  180   HD21  LEU  28          3HD2      LEU  28  -2.830   5.243   1.612
  181   HD22  LEU  28          1HD2      LEU  28  -4.153   6.316   2.068
  182   HD23  LEU  28          2HD2      LEU  28  -4.114   4.659   2.670
  183    H    HIS  29           H        HIS  29  -3.733   8.911   5.298
  184    HA   HIS  29           HA       HIS  29  -1.506   9.906   4.023
  185    HB2  HIS  29           1HB      HIS  29  -3.840  11.174   5.386
  186    HB3  HIS  29           2HB      HIS  29  -2.502  12.206   4.889
  187    HD1  HIS  29           HD1      HIS  29  -4.063  13.348   3.141
  188    HD2  HIS  29           HD2      HIS  29  -3.433   9.291   2.507
  189    HE1  HIS  29           HE1      HIS  29  -4.874  12.899   0.804
  190    H    SER  30           H        SER  30  -2.411  10.373   7.434
  191    HA   SER  30           HA       SER  30  -0.064  11.839   8.089
  192    HB2  SER  30           1HB      SER  30  -0.771  11.368  10.464
  193    HB3  SER  30           2HB      SER  30  -2.010  12.129   9.466
  194    HG   SER  30           HG       SER  30  -3.081  10.492  10.374
  195    H    HIS  31           H        HIS  31  -0.950   8.440   8.217
  196    HA   HIS  31           HA       HIS  31   1.236   7.531   9.747
  197    HB2  HIS  31           1HB      HIS  31  -0.427   5.939   9.592
  198    HB3  HIS  31           2HB      HIS  31  -0.723   6.259   7.886
  199    HD1  HIS  31           HD1      HIS  31   1.566   4.352  10.172
  200    HD2  HIS  31           HD2      HIS  31   0.764   4.727   6.112
  201    HE1  HIS  31           HE1      HIS  31   2.816   2.473   9.063
  202    H    GLN  32           H        GLN  32   0.876   8.297   6.361
  203    HA   GLN  32           HA       GLN  32   3.003   6.953   5.230
  204    HB2  GLN  32           1HB      GLN  32   1.680   9.570   4.641
  205    HB3  GLN  32           2HB      GLN  32   3.141   9.135   3.765
  206    HG2  GLN  32           1HG      GLN  32   0.852   7.223   3.918
  207    HG3  GLN  32           2HG      GLN  32   0.829   8.558   2.767
  208   HE21  GLN  32          1HE2      GLN  32   0.697   6.381   1.495
  209   HE22  GLN  32          2HE2      GLN  32   2.207   5.827   0.865
  210    H    ARG  33           H        ARG  33   3.018   9.987   7.039
  211    HA   ARG  33           HA       ARG  33   5.619  10.815   6.595
  212    HB2  ARG  33           1HB      ARG  33   3.855  11.056   9.027
  213    HB3  ARG  33           2HB      ARG  33   5.443  11.806   8.941
  214    HG2  ARG  33           1HG      ARG  33   4.789  13.290   7.274
  215    HG3  ARG  33           2HG      ARG  33   3.384  12.319   6.832
  216    HD2  ARG  33           1HD      ARG  33   2.492  12.823   9.155
  217    HD3  ARG  33           2HD      ARG  33   3.774  14.027   9.275
  218    HE   ARG  33           HE       ARG  33   2.586  14.722   6.981
  219   HH11  ARG  33          1HH1      ARG  33   1.286  13.963  10.120
  220   HH12  ARG  33          2HH1      ARG  33  -0.087  15.005   9.948
  221   HH21  ARG  33          1HH2      ARG  33   0.783  16.099   6.742
  222   HH22  ARG  33          2HH2      ARG  33  -0.373  16.219   8.026
  223    H    VAL  34           H        VAL  34   4.433   8.211   8.580
  224    HA   VAL  34           HA       VAL  34   6.537   7.780  10.316
  225    HB   VAL  34           HB       VAL  34   4.290   6.487  10.020
  226   HG11  VAL  34          1HG1      VAL  34   4.387   4.432   8.847
  227   HG12  VAL  34          2HG1      VAL  34   4.986   5.664   7.735
  228   HG13  VAL  34          3HG1      VAL  34   6.120   4.595   8.562
  229   HG21  VAL  34          3HG2      VAL  34   6.339   6.179  11.663
  230   HG22  VAL  34          1HG2      VAL  34   5.011   5.019  11.615
  231   HG23  VAL  34          2HG2      VAL  34   6.519   4.668  10.771
  232    H    HIS  35           H        HIS  35   6.473   7.452   6.901
  233    HA   HIS  35           HA       HIS  35   8.907   5.824   6.880
  234    HB2  HIS  35           1HB      HIS  35   7.240   6.765   4.539
  235    HB3  HIS  35           2HB      HIS  35   8.534   5.571   4.496
  236    HD1  HIS  35           HD1      HIS  35   8.015   3.292   5.839
  237    HD2  HIS  35           HD2      HIS  35   4.760   5.748   5.043
  238    HE1  HIS  35           HE1      HIS  35   5.986   1.841   6.153
  239    H    THR  36           H        THR  36   8.683   8.729   7.669
  240    HA   THR  36           HA       THR  36   9.534  10.634   6.034
  241    HB   THR  36           HB       THR  36  11.277  11.295   7.822
  242    HG1  THR  36           HG1      THR  36  11.703   9.664   9.113
  243   HG21  THR  36          3HG2      THR  36   9.628  12.399   8.920
  244   HG22  THR  36          1HG2      THR  36   8.668  10.941   9.169
  245   HG23  THR  36          2HG2      THR  36   8.636  11.763   7.608
  246    H    GLY  37           H        GLY  37  11.105  11.028   4.599
  247    HA2  GLY  37           1HA      GLY  37  13.632   9.562   4.787
  248    HA3  GLY  37           2HA      GLY  37  12.684   9.359   3.321
  249    H    GLU  38           H        GLU  38  11.787  11.815   2.730
  250    HA   GLU  38           HA       GLU  38  14.253  13.201   2.037
  251    HB2  GLU  38           1HB      GLU  38  11.464  13.175   0.998
  252    HB3  GLU  38           2HB      GLU  38  12.401  14.645   0.770
  253    HG2  GLU  38           1HG      GLU  38  13.397  11.936  -0.056
  254    HG3  GLU  38           2HG      GLU  38  12.454  12.980  -1.118
  255    H    LYS  39           H        LYS  39  14.161  15.647   2.035
  256    HA   LYS  39           HA       LYS  39  12.549  16.822   4.145
  257    HB2  LYS  39           1HB      LYS  39  14.516  17.729   5.336
  258    HB3  LYS  39           2HB      LYS  39  14.437  15.974   5.409
  259    HG2  LYS  39           1HG      LYS  39  16.648  16.263   4.946
  260    HG3  LYS  39           2HG      LYS  39  16.003  16.137   3.307
  261    HD2  LYS  39           1HD      LYS  39  16.265  18.387   2.888
  262    HD3  LYS  39           2HD      LYS  39  16.182  18.823   4.596
  263    HE2  LYS  39           1HE      LYS  39  18.394  18.055   4.986
  264    HE3  LYS  39           2HE      LYS  39  18.471  17.270   3.410
  265    HZ1  LYS  39           3HZ      LYS  39  19.406  19.127   2.676
  266    HZ2  LYS  39           1HZ      LYS  39  19.071  19.961   4.110
  267    HZ3  LYS  39           2HZ      LYS  39  17.916  19.904   2.876
  268    HA   PRO  40           HA       PRO  40  12.727  20.303   1.465
  269    HB2  PRO  40           1HB      PRO  40  12.162  22.282   3.235
  270    HB3  PRO  40           2HB      PRO  40  10.948  21.135   2.657
  271    HG2  PRO  40           1HG      PRO  40  12.494  21.126   5.221
  272    HG3  PRO  40           2HG      PRO  40  10.774  20.789   4.950
  273    HD2  PRO  40           1HD      PRO  40  12.609  18.825   5.286
  274    HD3  PRO  40           2HD      PRO  40  11.178  18.629   4.252
  275    H    SER  41           H        SER  41  14.535  21.132   0.644
  276    HA   SER  41           HA       SER  41  16.991  21.357   1.786
  277    HB2  SER  41           1HB      SER  41  17.561  22.981   0.045
  278    HB3  SER  41           2HB      SER  41  16.545  21.702  -0.620
  279    HG   SER  41           HG       SER  41  15.743  23.651  -1.332
  280    H    GLY  42           H        GLY  42  18.129  22.818   2.994
  281    HA2  GLY  42           1HA      GLY  42  16.535  24.710   4.520
  282    HA3  GLY  42           2HA      GLY  42  18.200  24.248   4.841
  283    HA   PRO  43           HA       PRO  43  17.879  28.490   2.760
  284    HB2  PRO  43           1HB      PRO  43  18.679  29.981   4.883
  285    HB3  PRO  43           2HB      PRO  43  16.983  29.596   4.564
  286    HG2  PRO  43           1HG      PRO  43  18.893  28.302   6.472
  287    HG3  PRO  43           2HG      PRO  43  17.194  28.745   6.718
  288    HD2  PRO  43           1HD      PRO  43  17.973  26.212   6.166
  289    HD3  PRO  43           2HD      PRO  43  16.416  26.871   5.625
  290    H    SER  44           H        SER  44  19.703  27.489   1.646
  291    HA   SER  44           HA       SER  44  21.942  27.069   1.251
  292    HB2  SER  44           1HB      SER  44  23.234  29.236   1.260
  293    HB3  SER  44           2HB      SER  44  21.698  29.300   0.397
  294    HG   SER  44           HG       SER  44  20.853  30.532   1.950
  295    H    SER  45           H        SER  45  21.335  26.138   3.791
  296    HA   SER  45           HA       SER  45  23.157  27.161   5.745
  297    HB2  SER  45           1HB      SER  45  20.940  25.757   6.033
  298    HB3  SER  45           2HB      SER  45  22.045  24.388   5.918
  299    HG   SER  45           HG       SER  45  22.774  26.456   7.629
  300    H    GLY  46           H        GLY  46  25.284  27.013   5.411
  301    HA2  GLY  46           1HA      GLY  46  27.356  26.106   5.023
  302    HA3  GLY  46           2HA      GLY  46  26.641  24.565   5.471
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1   5.873 -17.160  12.068
    2    HA2  GLY   1           1HA      GLY   1   5.580 -14.948  11.467
    3    HA3  GLY   1           2HA      GLY   1   4.084 -15.408  10.667
    4    H    SER   2           H        SER   2   2.979 -13.607  11.465
    5    HA   SER   2           HA       SER   2   2.239 -13.833  14.301
    6    HB2  SER   2           1HB      SER   2   3.123 -11.381  12.807
    7    HB3  SER   2           2HB      SER   2   2.024 -11.240  14.179
    8    HG   SER   2           HG       SER   2   3.786 -11.303  15.319
    9    H    SER   3           H        SER   3   0.202 -14.540  14.196
   10    HA   SER   3           HA       SER   3  -1.792 -12.865  12.940
   11    HB2  SER   3           1HB      SER   3  -2.803 -14.698  11.632
   12    HB3  SER   3           2HB      SER   3  -1.170 -14.332  11.077
   13    HG   SER   3           HG       SER   3  -0.714 -16.124  12.794
   14    H    GLY   4           H        GLY   4  -3.705 -12.933  14.004
   15    HA2  GLY   4           1HA      GLY   4  -4.197 -15.161  15.856
   16    HA3  GLY   4           2HA      GLY   4  -4.186 -13.520  16.486
   17    H    SER   5           H        SER   5  -5.558 -15.001  13.549
   18    HA   SER   5           HA       SER   5  -8.251 -14.650  14.448
   19    HB2  SER   5           1HB      SER   5  -8.962 -12.893  13.028
   20    HB3  SER   5           2HB      SER   5  -7.474 -12.305  13.769
   21    HG   SER   5           HG       SER   5  -7.398 -11.913  11.562
   22    H    SER   6           H        SER   6  -9.832 -15.299  12.787
   23    HA   SER   6           HA       SER   6  -8.616 -17.069  10.767
   24    HB2  SER   6           1HB      SER   6  -9.721 -18.192  12.793
   25    HB3  SER   6           2HB      SER   6 -11.252 -17.628  12.123
   26    HG   SER   6           HG       SER   6  -9.363 -19.322  10.848
   27    H    GLY   7           H        GLY   7  -9.245 -14.449  10.150
   28    HA2  GLY   7           1HA      GLY   7 -11.438 -14.872   8.242
   29    HA3  GLY   7           2HA      GLY   7 -11.485 -13.456   9.282
   30    H    SER   8           H        SER   8 -11.234 -11.854   7.815
   31    HA   SER   8           HA       SER   8  -8.625 -11.689   6.507
   32    HB2  SER   8           1HB      SER   8 -11.281 -11.675   5.120
   33    HB3  SER   8           2HB      SER   8  -9.964 -10.695   4.475
   34    HG   SER   8           HG       SER   8 -10.230 -13.005   3.749
   35    H    GLY   9           H        GLY   9  -8.406  -9.425   5.450
   36    HA2  GLY   9           1HA      GLY   9  -9.920  -7.359   6.842
   37    HA3  GLY   9           2HA      GLY   9  -8.205  -7.450   7.216
   38    H    GLU  10           H        GLU  10 -10.406  -7.275   4.421
   39    HA   GLU  10           HA       GLU  10  -8.356  -6.093   2.770
   40    HB2  GLU  10           1HB      GLU  10 -11.170  -6.980   2.387
   41    HB3  GLU  10           2HB      GLU  10 -10.548  -5.762   1.283
   42    HG2  GLU  10           1HG      GLU  10  -9.534  -8.551   1.725
   43    HG3  GLU  10           2HG      GLU  10 -10.199  -7.850   0.251
   44    H    LYS  11           H        LYS  11  -7.807  -4.033   2.965
   45    HA   LYS  11           HA       LYS  11  -9.904  -2.074   3.638
   46    HB2  LYS  11           1HB      LYS  11  -7.827  -2.559   5.213
   47    HB3  LYS  11           2HB      LYS  11  -7.017  -1.468   4.096
   48    HG2  LYS  11           1HG      LYS  11  -7.783  -0.160   5.911
   49    HG3  LYS  11           2HG      LYS  11  -8.844   0.192   4.544
   50    HD2  LYS  11           1HD      LYS  11 -10.330  -0.071   6.315
   51    HD3  LYS  11           2HD      LYS  11 -10.354  -1.654   5.535
   52    HE2  LYS  11           1HE      LYS  11  -8.944  -2.589   7.197
   53    HE3  LYS  11           2HE      LYS  11  -8.557  -1.002   7.860
   54    HZ1  LYS  11           3HZ      LYS  11 -11.080  -0.882   8.291
   55    HZ2  LYS  11           1HZ      LYS  11 -10.118  -1.807   9.331
   56    HZ3  LYS  11           2HZ      LYS  11 -11.038  -2.566   8.131
   57    HA   PRO  12           HA       PRO  12  -9.122  -0.365  -0.368
   58    HB2  PRO  12           1HB      PRO  12 -10.490   1.955  -0.023
   59    HB3  PRO  12           2HB      PRO  12 -11.287   0.399  -0.285
   60    HG2  PRO  12           1HG      PRO  12 -10.808   1.874   2.275
   61    HG3  PRO  12           2HG      PRO  12 -12.264   1.020   1.732
   62    HD2  PRO  12           1HD      PRO  12 -10.504  -0.068   3.479
   63    HD3  PRO  12           2HD      PRO  12 -11.424  -1.045   2.317
   64    H    PHE  13           H        PHE  13  -8.530   1.456   2.596
   65    HA   PHE  13           HA       PHE  13  -6.667   3.216   1.183
   66    HB2  PHE  13           1HB      PHE  13  -7.384   3.392   4.103
   67    HB3  PHE  13           2HB      PHE  13  -6.765   4.660   3.051
   68    HD1  PHE  13           HD1      PHE  13  -8.243   5.673   1.341
   69    HD2  PHE  13           HD2      PHE  13  -9.700   2.940   4.261
   70    HE1  PHE  13           HE1      PHE  13 -10.542   6.426   0.893
   71    HE2  PHE  13           HE2      PHE  13 -12.002   3.688   3.817
   72    HZ   PHE  13           HZ       PHE  13 -12.425   5.433   2.131
   73    H    GLN  14           H        GLN  14  -4.943   1.816   0.823
   74    HA   GLN  14           HA       GLN  14  -3.530   0.919   3.248
   75    HB2  GLN  14           1HB      GLN  14  -3.412  -0.310   0.488
   76    HB3  GLN  14           2HB      GLN  14  -2.557  -0.883   1.914
   77    HG2  GLN  14           1HG      GLN  14  -4.989  -1.011   2.908
   78    HG3  GLN  14           2HG      GLN  14  -5.431  -1.108   1.204
   79   HE21  GLN  14          1HE2      GLN  14  -2.746  -2.421   3.116
   80   HE22  GLN  14          2HE2      GLN  14  -2.990  -4.065   2.646
   81    H    CYS  15           H        CYS  15  -1.277   1.157   3.320
   82    HA   CYS  15           HA       CYS  15  -0.255   3.513   2.203
   83    HB2  CYS  15           1HB      CYS  15   0.522   2.074   4.263
   84    HB3  CYS  15           2HB      CYS  15   1.581   1.316   3.078
   85    H    GLU  16           H        GLU  16   1.976   3.442   1.009
   86    HA   GLU  16           HA       GLU  16   1.638   1.696  -1.340
   87    HB2  GLU  16           1HB      GLU  16   2.388   4.560  -1.052
   88    HB3  GLU  16           2HB      GLU  16   3.172   3.646  -2.333
   89    HG2  GLU  16           1HG      GLU  16   0.211   4.021  -1.955
   90    HG3  GLU  16           2HG      GLU  16   1.222   4.776  -3.187
   91    H    GLU  17           H        GLU  17   3.746   2.703   1.183
   92    HA   GLU  17           HA       GLU  17   6.063   1.445  -0.090
   93    HB2  GLU  17           1HB      GLU  17   6.086   3.741   1.144
   94    HB3  GLU  17           2HB      GLU  17   6.120   2.762   2.604
   95    HG2  GLU  17           1HG      GLU  17   8.355   3.236   2.164
   96    HG3  GLU  17           2HG      GLU  17   8.132   1.590   1.575
   97    H    CYS  18           H        CYS  18   3.741   0.989   2.445
   98    HA   CYS  18           HA       CYS  18   4.984  -1.601   3.064
   99    HB2  CYS  18           1HB      CYS  18   4.618  -1.346   5.402
  100    HB3  CYS  18           2HB      CYS  18   5.412   0.130   4.863
  101    H    GLY  19           H        GLY  19   2.449  -0.168   1.710
  102    HA2  GLY  19           1HA      GLY  19   0.171  -0.606   1.551
  103    HA3  GLY  19           2HA      GLY  19   0.789  -2.241   1.371
  104    H    LYS  20           H        LYS  20   0.150   0.084   3.999
  105    HA   LYS  20           HA       LYS  20  -0.503  -2.067   5.816
  106    HB2  LYS  20           1HB      LYS  20  -0.171   0.883   6.013
  107    HB3  LYS  20           2HB      LYS  20  -1.198   0.106   7.211
  108    HG2  LYS  20           1HG      LYS  20   1.477  -1.074   6.694
  109    HG3  LYS  20           2HG      LYS  20   1.389   0.441   7.596
  110    HD2  LYS  20           1HD      LYS  20  -0.282  -0.669   9.107
  111    HD3  LYS  20           2HD      LYS  20   0.083  -2.187   8.283
  112    HE2  LYS  20           1HE      LYS  20   1.520  -2.312  10.067
  113    HE3  LYS  20           2HE      LYS  20   2.558  -1.548   8.864
  114    HZ1  LYS  20           3HZ      LYS  20   2.272  -0.589  11.297
  115    HZ2  LYS  20           1HZ      LYS  20   0.977   0.217  10.566
  116    HZ3  LYS  20           2HZ      LYS  20   2.545   0.414   9.963
  117    H    ARG  21           H        ARG  21  -2.563  -1.323   7.292
  118    HA   ARG  21           HA       ARG  21  -4.813  -1.067   5.404
  119    HB2  ARG  21           1HB      ARG  21  -4.624  -2.757   7.903
  120    HB3  ARG  21           2HB      ARG  21  -6.101  -2.511   6.979
  121    HG2  ARG  21           1HG      ARG  21  -5.428  -3.859   5.273
  122    HG3  ARG  21           2HG      ARG  21  -3.716  -3.520   5.533
  123    HD2  ARG  21           1HD      ARG  21  -5.449  -5.208   7.334
  124    HD3  ARG  21           2HD      ARG  21  -4.332  -5.835   6.122
  125    HE   ARG  21           HE       ARG  21  -3.122  -4.075   8.056
  126   HH11  ARG  21          1HH1      ARG  21  -3.995  -7.356   7.289
  127   HH12  ARG  21          2HH1      ARG  21  -2.813  -8.056   8.346
  128   HH21  ARG  21          1HH2      ARG  21  -1.563  -4.983   9.451
  129   HH22  ARG  21          2HH2      ARG  21  -1.431  -6.705   9.576
  130    H    PHE  22           H        PHE  22  -6.066   0.640   5.732
  131    HA   PHE  22           HA       PHE  22  -6.425   1.665   8.451
  132    HB2  PHE  22           1HB      PHE  22  -5.859   3.509   6.130
  133    HB3  PHE  22           2HB      PHE  22  -5.971   3.928   7.836
  134    HD1  PHE  22           HD1      PHE  22  -4.203   3.035   9.408
  135    HD2  PHE  22           HD2      PHE  22  -3.820   2.903   5.171
  136    HE1  PHE  22           HE1      PHE  22  -1.771   2.742   9.641
  137    HE2  PHE  22           HE2      PHE  22  -1.388   2.607   5.397
  138    HZ   PHE  22           HZ       PHE  22  -0.360   2.526   7.633
  139    H    THR  23           H        THR  23  -8.446   2.384   8.883
  140    HA   THR  23           HA       THR  23 -10.509   1.807   6.976
  141    HB   THR  23           HB       THR  23 -10.706   3.094   9.707
  142    HG1  THR  23           HG1      THR  23 -11.623   0.791  10.001
  143   HG21  THR  23          3HG2      THR  23 -12.614   3.366   7.938
  144   HG22  THR  23          1HG2      THR  23 -13.008   2.907   9.594
  145   HG23  THR  23          2HG2      THR  23 -12.951   1.680   8.329
  146    H    GLN  24           H        GLN  24  -9.142   4.739   8.410
  147    HA   GLN  24           HA       GLN  24 -10.818   6.364   6.629
  148    HB2  GLN  24           1HB      GLN  24 -10.547   6.730   9.221
  149    HB3  GLN  24           2HB      GLN  24  -9.063   7.545   8.744
  150    HG2  GLN  24           1HG      GLN  24 -10.840   9.148   8.986
  151    HG3  GLN  24           2HG      GLN  24 -10.363   9.035   7.293
  152   HE21  GLN  24          1HE2      GLN  24 -11.912   8.768   5.849
  153   HE22  GLN  24          2HE2      GLN  24 -13.529   8.260   6.182
  154    H    ASN  25           H        ASN  25  -9.907   7.957   5.297
  155    HA   ASN  25           HA       ASN  25  -7.498   7.247   4.028
  156    HB2  ASN  25           1HB      ASN  25  -7.770   9.623   3.004
  157    HB3  ASN  25           2HB      ASN  25  -8.988   8.400   2.654
  158   HD21  ASN  25          1HD2      ASN  25 -10.882   9.359   2.547
  159   HD22  ASN  25          2HD2      ASN  25 -11.499  10.519   3.670
  160    H    SER  26           H        SER  26  -8.271   9.830   6.330
  161    HA   SER  26           HA       SER  26  -5.857  11.182   6.342
  162    HB2  SER  26           1HB      SER  26  -7.782  12.039   7.541
  163    HB3  SER  26           2HB      SER  26  -7.756  10.661   8.641
  164    HG   SER  26           HG       SER  26  -5.717  11.396   9.379
  165    H    HIS  27           H        HIS  27  -6.814   8.353   8.261
  166    HA   HIS  27           HA       HIS  27  -4.598   8.072   9.869
  167    HB2  HIS  27           1HB      HIS  27  -6.540   6.143   8.679
  168    HB3  HIS  27           2HB      HIS  27  -5.109   5.498   9.477
  169    HD1  HIS  27           HD1      HIS  27  -6.711   4.479  11.293
  170    HD2  HIS  27           HD2      HIS  27  -6.660   8.630  11.124
  171    HE1  HIS  27           HE1      HIS  27  -7.796   5.252  13.426
  172    H    LEU  28           H        LEU  28  -5.003   7.091   6.503
  173    HA   LEU  28           HA       LEU  28  -2.449   5.802   6.340
  174    HB2  LEU  28           1HB      LEU  28  -4.058   4.999   4.844
  175    HB3  LEU  28           2HB      LEU  28  -4.524   6.621   4.338
  176    HG   LEU  28           HG       LEU  28  -2.275   6.811   3.228
  177   HD11  LEU  28          1HD1      LEU  28  -1.626   4.608   4.675
  178   HD12  LEU  28          2HD1      LEU  28  -0.769   5.152   3.233
  179   HD13  LEU  28          3HD1      LEU  28  -2.000   3.895   3.105
  180   HD21  LEU  28          3HD2      LEU  28  -4.633   5.449   2.406
  181   HD22  LEU  28          1HD2      LEU  28  -3.239   4.627   1.706
  182   HD23  LEU  28          2HD2      LEU  28  -3.478   6.351   1.424
  183    H    HIS  29           H        HIS  29  -3.722   8.732   4.744
  184    HA   HIS  29           HA       HIS  29  -1.431   9.720   3.650
  185    HB2  HIS  29           1HB      HIS  29  -3.691  11.223   4.973
  186    HB3  HIS  29           2HB      HIS  29  -2.421  12.016   4.046
  187    HD1  HIS  29           HD1      HIS  29  -4.256  12.830   2.364
  188    HD2  HIS  29           HD2      HIS  29  -3.786   8.708   2.572
  189    HE1  HIS  29           HE1      HIS  29  -5.446  11.915   0.346
  190    H    SER  30           H        SER  30  -2.515  10.162   6.998
  191    HA   SER  30           HA       SER  30  -0.255  11.743   7.744
  192    HB2  SER  30           1HB      SER  30  -1.097  11.496  10.033
  193    HB3  SER  30           2HB      SER  30  -2.412  11.901   8.931
  194    HG   SER  30           HG       SER  30  -3.308  10.035   9.321
  195    H    HIS  31           H        HIS  31  -1.060   8.331   7.854
  196    HA   HIS  31           HA       HIS  31   0.985   7.462   9.568
  197    HB2  HIS  31           1HB      HIS  31  -0.570   5.804   9.199
  198    HB3  HIS  31           2HB      HIS  31  -0.719   6.176   7.484
  199    HD1  HIS  31           HD1      HIS  31   1.299   4.174   9.906
  200    HD2  HIS  31           HD2      HIS  31   1.112   4.866   5.813
  201    HE1  HIS  31           HE1      HIS  31   2.752   2.409   8.859
  202    H    GLN  32           H        GLN  32   1.002   8.362   6.208
  203    HA   GLN  32           HA       GLN  32   3.269   7.103   5.264
  204    HB2  GLN  32           1HB      GLN  32   1.966   9.722   4.653
  205    HB3  GLN  32           2HB      GLN  32   3.532   9.365   3.937
  206    HG2  GLN  32           1HG      GLN  32   2.678   7.467   2.803
  207    HG3  GLN  32           2HG      GLN  32   1.163   7.532   3.702
  208   HE21  GLN  32          1HE2      GLN  32  -0.145   7.708   1.929
  209   HE22  GLN  32          2HE2      GLN  32  -0.186   9.106   0.915
  210    H    ARG  33           H        ARG  33   3.000   9.811   7.449
  211    HA   ARG  33           HA       ARG  33   5.533  10.911   7.301
  212    HB2  ARG  33           1HB      ARG  33   3.603  10.581   9.582
  213    HB3  ARG  33           2HB      ARG  33   5.166  11.349   9.826
  214    HG2  ARG  33           1HG      ARG  33   4.459  12.843   7.826
  215    HG3  ARG  33           2HG      ARG  33   2.832  12.283   8.219
  216    HD2  ARG  33           1HD      ARG  33   2.913  14.140   9.538
  217    HD3  ARG  33           2HD      ARG  33   3.584  12.961  10.663
  218    HE   ARG  33           HE       ARG  33   5.605  14.222   9.091
  219   HH11  ARG  33          1HH1      ARG  33   3.554  14.620  11.877
  220   HH12  ARG  33          2HH1      ARG  33   4.626  15.727  12.670
  221   HH21  ARG  33          1HH2      ARG  33   7.024  15.679  10.125
  222   HH22  ARG  33          2HH2      ARG  33   6.598  16.329  11.672
  223    H    VAL  34           H        VAL  34   4.466   7.980   8.923
  224    HA   VAL  34           HA       VAL  34   6.626   7.420  10.543
  225    HB   VAL  34           HB       VAL  34   6.021   5.114  10.449
  226   HG11  VAL  34          1HG1      VAL  34   4.156   5.584  11.555
  227   HG12  VAL  34          2HG1      VAL  34   4.113   7.179  10.801
  228   HG13  VAL  34          3HG1      VAL  34   3.297   5.817  10.033
  229   HG21  VAL  34          3HG2      VAL  34   4.159   4.577   8.623
  230   HG22  VAL  34          1HG2      VAL  34   5.039   5.828   7.745
  231   HG23  VAL  34          2HG2      VAL  34   5.881   4.381   8.300
  232    H    HIS  35           H        HIS  35   6.387   7.234   7.071
  233    HA   HIS  35           HA       HIS  35   8.913   5.815   6.824
  234    HB2  HIS  35           1HB      HIS  35   7.068   6.937   4.704
  235    HB3  HIS  35           2HB      HIS  35   8.490   5.944   4.395
  236    HD1  HIS  35           HD1      HIS  35   8.348   3.440   5.419
  237    HD2  HIS  35           HD2      HIS  35   4.772   5.533   5.107
  238    HE1  HIS  35           HE1      HIS  35   6.536   1.703   5.578
  239    H    THR  36           H        THR  36   8.610   8.610   7.945
  240    HA   THR  36           HA       THR  36   9.392  10.700   6.496
  241    HB   THR  36           HB       THR  36  11.065  11.278   8.355
  242    HG1  THR  36           HG1      THR  36  10.730   9.874  10.236
  243   HG21  THR  36          3HG2      THR  36   8.302  11.392   8.227
  244   HG22  THR  36          1HG2      THR  36   9.327  12.247   9.379
  245   HG23  THR  36          2HG2      THR  36   8.619  10.692   9.813
  246    H    GLY  37           H        GLY  37  11.856   8.443   7.768
  247    HA2  GLY  37           1HA      GLY  37  13.317   7.589   5.815
  248    HA3  GLY  37           2HA      GLY  37  13.635   9.303   5.588
  249    H    GLU  38           H        GLU  38  13.370   7.388   8.569
  250    HA   GLU  38           HA       GLU  38  15.652   8.641   9.714
  251    HB2  GLU  38           1HB      GLU  38  13.870   7.839  11.139
  252    HB3  GLU  38           2HB      GLU  38  14.087   6.197  10.552
  253    HG2  GLU  38           1HG      GLU  38  16.403   7.548  11.824
  254    HG3  GLU  38           2HG      GLU  38  15.085   6.993  12.854
  255    H    LYS  39           H        LYS  39  17.659   7.699  10.276
  256    HA   LYS  39           HA       LYS  39  18.769   6.049   8.226
  257    HB2  LYS  39           1HB      LYS  39  19.905   7.918   9.622
  258    HB3  LYS  39           2HB      LYS  39  20.145   6.659  10.826
  259    HG2  LYS  39           1HG      LYS  39  22.108   6.478   9.706
  260    HG3  LYS  39           2HG      LYS  39  21.135   5.360   8.748
  261    HD2  LYS  39           1HD      LYS  39  22.239   6.717   7.175
  262    HD3  LYS  39           2HD      LYS  39  20.596   7.357   7.261
  263    HE2  LYS  39           1HE      LYS  39  22.694   8.504   9.042
  264    HE3  LYS  39           2HE      LYS  39  22.682   8.955   7.338
  265    HZ1  LYS  39           3HZ      LYS  39  20.796   9.628   9.448
  266    HZ2  LYS  39           1HZ      LYS  39  20.127   9.305   7.929
  267    HZ3  LYS  39           2HZ      LYS  39  21.281  10.529   8.101
  268    HA   PRO  40           HA       PRO  40  17.773   2.156  10.122
  269    HB2  PRO  40           1HB      PRO  40  19.158   0.609   8.373
  270    HB3  PRO  40           2HB      PRO  40  17.597   1.341   7.982
  271    HG2  PRO  40           1HG      PRO  40  20.354   2.261   7.264
  272    HG3  PRO  40           2HG      PRO  40  18.895   2.207   6.258
  273    HD2  PRO  40           1HD      PRO  40  19.782   4.488   7.416
  274    HD3  PRO  40           2HD      PRO  40  18.058   4.162   7.145
  275    H    SER  41           H        SER  41  20.851   3.600   9.835
  276    HA   SER  41           HA       SER  41  21.871   1.937  11.988
  277    HB2  SER  41           1HB      SER  41  22.548   1.024   9.616
  278    HB3  SER  41           2HB      SER  41  23.709   2.351   9.657
  279    HG   SER  41           HG       SER  41  23.446   0.418  11.716
  280    H    GLY  42           H        GLY  42  22.385   3.408  13.467
  281    HA2  GLY  42           1HA      GLY  42  24.323   5.457  12.843
  282    HA3  GLY  42           2HA      GLY  42  22.730   6.084  13.240
  283    HA   PRO  43           HA       PRO  43  25.344   5.294  17.101
  284    HB2  PRO  43           1HB      PRO  43  25.646   7.889  17.842
  285    HB3  PRO  43           2HB      PRO  43  26.789   7.053  16.784
  286    HG2  PRO  43           1HG      PRO  43  24.564   8.923  16.068
  287    HG3  PRO  43           2HG      PRO  43  26.214   8.848  15.422
  288    HD2  PRO  43           1HD      PRO  43  24.087   7.801  14.112
  289    HD3  PRO  43           2HD      PRO  43  25.714   7.099  14.006
  290    H    SER  44           H        SER  44  22.373   6.368  16.176
  291    HA   SER  44           HA       SER  44  21.084   7.717  18.077
  292    HB2  SER  44           1HB      SER  44  19.095   6.437  17.640
  293    HB3  SER  44           2HB      SER  44  20.022   6.508  16.142
  294    HG   SER  44           HG       SER  44  19.640   4.411  16.263
  295    H    SER  45           H        SER  45  21.762   7.704  20.158
  296    HA   SER  45           HA       SER  45  22.461   5.407  21.633
  297    HB2  SER  45           1HB      SER  45  21.498   8.067  22.711
  298    HB3  SER  45           2HB      SER  45  22.441   6.859  23.584
  299    HG   SER  45           HG       SER  45  23.929   8.273  22.865
  300    H    GLY  46           H        GLY  46  19.478   7.353  21.613
  301    HA2  GLY  46           1HA      GLY  46  17.825   5.076  22.036
  302    HA3  GLY  46           2HA      GLY  46  18.038   5.972  23.533
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1  -5.835 -20.405   7.826
    2    HA2  GLY   1           1HA      GLY   1  -4.165 -21.622   6.565
    3    HA3  GLY   1           2HA      GLY   1  -4.860 -23.113   7.182
    4    H    SER   2           H        SER   2  -4.836 -20.872   4.642
    5    HA   SER   2           HA       SER   2  -7.060 -22.303   3.354
    6    HB2  SER   2           1HB      SER   2  -7.664 -19.949   4.140
    7    HB3  SER   2           2HB      SER   2  -6.539 -19.362   2.916
    8    HG   SER   2           HG       SER   2  -8.419 -21.230   2.087
    9    H    SER   3           H        SER   3  -7.014 -22.102   0.956
   10    HA   SER   3           HA       SER   3  -4.592 -22.972  -0.092
   11    HB2  SER   3           1HB      SER   3  -6.841 -23.318  -1.133
   12    HB3  SER   3           2HB      SER   3  -6.815 -21.632  -1.650
   13    HG   SER   3           HG       SER   3  -6.019 -23.385  -3.149
   14    H    GLY   4           H        GLY   4  -2.836 -22.002  -0.932
   15    HA2  GLY   4           1HA      GLY   4  -1.334 -20.333  -1.410
   16    HA3  GLY   4           2HA      GLY   4  -2.698 -19.512  -2.156
   17    H    SER   5           H        SER   5  -0.590 -19.663   0.559
   18    HA   SER   5           HA       SER   5  -2.119 -17.734   2.103
   19    HB2  SER   5           1HB      SER   5   0.455 -19.224   2.576
   20    HB3  SER   5           2HB      SER   5  -0.042 -17.896   3.625
   21    HG   SER   5           HG       SER   5  -1.277 -19.280   4.586
   22    H    SER   6           H        SER   6  -1.991 -15.640   1.690
   23    HA   SER   6           HA       SER   6   0.553 -14.349   1.304
   24    HB2  SER   6           1HB      SER   6  -0.049 -15.135  -0.999
   25    HB3  SER   6           2HB      SER   6  -1.499 -14.135  -0.910
   26    HG   SER   6           HG       SER   6   1.031 -13.005  -0.423
   27    H    GLY   7           H        GLY   7   0.483 -12.129   1.688
   28    HA2  GLY   7           1HA      GLY   7  -1.205 -11.103   3.526
   29    HA3  GLY   7           2HA      GLY   7  -0.431 -10.095   2.312
   30    H    SER   8           H        SER   8  -3.118  -9.986   3.636
   31    HA   SER   8           HA       SER   8  -4.684  -9.761   1.159
   32    HB2  SER   8           1HB      SER   8  -6.687 -10.569   2.363
   33    HB3  SER   8           2HB      SER   8  -5.425 -11.799   2.292
   34    HG   SER   8           HG       SER   8  -4.875 -10.639   4.471
   35    H    GLY   9           H        GLY   9  -5.520  -7.798   0.892
   36    HA2  GLY   9           1HA      GLY   9  -5.594  -6.000   3.223
   37    HA3  GLY   9           2HA      GLY   9  -5.461  -5.484   1.549
   38    H    GLU  10           H        GLU  10  -7.469  -5.347   4.033
   39    HA   GLU  10           HA       GLU  10  -9.918  -5.957   2.555
   40    HB2  GLU  10           1HB      GLU  10  -9.297  -5.427   5.441
   41    HB3  GLU  10           2HB      GLU  10 -10.942  -5.249   4.847
   42    HG2  GLU  10           1HG      GLU  10 -10.987  -7.410   5.567
   43    HG3  GLU  10           2HG      GLU  10 -10.529  -7.644   3.880
   44    H    LYS  11           H        LYS  11  -8.509  -3.272   4.424
   45    HA   LYS  11           HA       LYS  11 -10.465  -1.379   3.625
   46    HB2  LYS  11           1HB      LYS  11  -7.871  -1.311   5.063
   47    HB3  LYS  11           2HB      LYS  11  -8.399   0.196   4.325
   48    HG2  LYS  11           1HG      LYS  11  -9.370   0.445   6.353
   49    HG3  LYS  11           2HG      LYS  11 -10.665  -0.446   5.550
   50    HD2  LYS  11           1HD      LYS  11  -8.533  -2.007   6.912
   51    HD3  LYS  11           2HD      LYS  11  -9.720  -1.173   7.919
   52    HE2  LYS  11           1HE      LYS  11 -10.432  -3.037   5.660
   53    HE3  LYS  11           2HE      LYS  11 -10.309  -3.536   7.346
   54    HZ1  LYS  11           3HZ      LYS  11 -12.179  -1.500   6.261
   55    HZ2  LYS  11           1HZ      LYS  11 -12.039  -1.921   7.894
   56    HZ3  LYS  11           2HZ      LYS  11 -12.589  -3.060   6.771
   57    HA   PRO  12           HA       PRO  12  -9.081  -0.313  -0.414
   58    HB2  PRO  12           1HB      PRO  12 -10.106   2.195  -0.579
   59    HB3  PRO  12           2HB      PRO  12 -11.107   0.741  -0.669
   60    HG2  PRO  12           1HG      PRO  12 -10.604   2.554   1.660
   61    HG3  PRO  12           2HG      PRO  12 -12.127   1.825   1.117
   62    HD2  PRO  12           1HD      PRO  12 -10.688   0.824   3.180
   63    HD3  PRO  12           2HD      PRO  12 -11.654  -0.204   2.103
   64    H    PHE  13           H        PHE  13  -8.505   1.982   2.219
   65    HA   PHE  13           HA       PHE  13  -6.432   3.371   0.779
   66    HB2  PHE  13           1HB      PHE  13  -7.014   3.542   3.736
   67    HB3  PHE  13           2HB      PHE  13  -6.212   4.739   2.725
   68    HD1  PHE  13           HD1      PHE  13  -7.743   5.457   0.614
   69    HD2  PHE  13           HD2      PHE  13  -9.156   4.025   4.365
   70    HE1  PHE  13           HE1      PHE  13  -9.901   6.571   0.223
   71    HE2  PHE  13           HE2      PHE  13 -11.316   5.137   3.979
   72    HZ   PHE  13           HZ       PHE  13 -11.692   6.411   1.906
   73    H    GLN  14           H        GLN  14  -4.839   1.886   0.289
   74    HA   GLN  14           HA       GLN  14  -3.449   0.673   2.584
   75    HB2  GLN  14           1HB      GLN  14  -3.624  -0.224  -0.293
   76    HB3  GLN  14           2HB      GLN  14  -2.510  -0.924   0.874
   77    HG2  GLN  14           1HG      GLN  14  -4.521  -1.458   2.294
   78    HG3  GLN  14           2HG      GLN  14  -5.511  -1.006   0.907
   79   HE21  GLN  14          1HE2      GLN  14  -2.600  -2.953   1.508
   80   HE22  GLN  14          2HE2      GLN  14  -3.118  -4.319   0.586
   81    H    CYS  15           H        CYS  15  -1.277   0.977   2.834
   82    HA   CYS  15           HA       CYS  15  -0.119   3.291   1.712
   83    HB2  CYS  15           1HB      CYS  15   0.399   2.007   3.942
   84    HB3  CYS  15           2HB      CYS  15   1.558   1.136   2.943
   85    H    GLU  16           H        GLU  16   2.256   3.079   0.810
   86    HA   GLU  16           HA       GLU  16   2.159   1.157  -1.422
   87    HB2  GLU  16           1HB      GLU  16   2.837   4.051  -1.322
   88    HB3  GLU  16           2HB      GLU  16   3.763   3.044  -2.425
   89    HG2  GLU  16           1HG      GLU  16   2.079   3.701  -3.803
   90    HG3  GLU  16           2HG      GLU  16   1.383   2.216  -3.157
   91    H    GLU  17           H        GLU  17   4.007   2.490   1.171
   92    HA   GLU  17           HA       GLU  17   6.463   1.191   0.270
   93    HB2  GLU  17           1HB      GLU  17   6.525   3.501   1.213
   94    HB3  GLU  17           2HB      GLU  17   5.990   2.846   2.754
   95    HG2  GLU  17           1HG      GLU  17   7.997   1.748   3.131
   96    HG3  GLU  17           2HG      GLU  17   8.455   1.796   1.430
   97    H    CYS  18           H        CYS  18   3.903   0.839   2.598
   98    HA   CYS  18           HA       CYS  18   5.101  -1.700   3.465
   99    HB2  CYS  18           1HB      CYS  18   4.498  -1.314   5.755
  100    HB3  CYS  18           2HB      CYS  18   5.422   0.080   5.205
  101    H    GLY  19           H        GLY  19   2.596  -0.219   1.975
  102    HA2  GLY  19           1HA      GLY  19   0.327  -0.676   1.733
  103    HA3  GLY  19           2HA      GLY  19   0.979  -2.289   1.487
  104    H    LYS  20           H        LYS  20  -0.308  -0.078   3.919
  105    HA   LYS  20           HA       LYS  20  -0.930  -2.397   5.621
  106    HB2  LYS  20           1HB      LYS  20  -0.247   0.437   6.192
  107    HB3  LYS  20           2HB      LYS  20  -1.424  -0.326   7.253
  108    HG2  LYS  20           1HG      LYS  20   0.453  -2.234   7.244
  109    HG3  LYS  20           2HG      LYS  20   1.470  -0.820   6.959
  110    HD2  LYS  20           1HD      LYS  20  -0.500  -1.137   9.224
  111    HD3  LYS  20           2HD      LYS  20   1.250  -1.329   9.352
  112    HE2  LYS  20           1HE      LYS  20   1.235   1.090   8.292
  113    HE3  LYS  20           2HE      LYS  20  -0.379   1.137   9.000
  114    HZ1  LYS  20           3HZ      LYS  20   1.383   2.002  10.477
  115    HZ2  LYS  20           1HZ      LYS  20   2.085   0.464  10.512
  116    HZ3  LYS  20           2HZ      LYS  20   0.537   0.701  11.149
  117    H    ARG  21           H        ARG  21  -2.935  -1.548   7.153
  118    HA   ARG  21           HA       ARG  21  -5.081  -0.854   5.255
  119    HB2  ARG  21           1HB      ARG  21  -5.217  -2.725   7.627
  120    HB3  ARG  21           2HB      ARG  21  -6.580  -2.275   6.611
  121    HG2  ARG  21           1HG      ARG  21  -5.902  -3.584   4.875
  122    HG3  ARG  21           2HG      ARG  21  -4.193  -3.450   5.297
  123    HD2  ARG  21           1HD      ARG  21  -5.014  -5.708   5.698
  124    HD3  ARG  21           2HD      ARG  21  -4.548  -4.930   7.209
  125    HE   ARG  21           HE       ARG  21  -7.350  -4.715   6.538
  126   HH11  ARG  21          1HH1      ARG  21  -4.889  -6.539   8.192
  127   HH12  ARG  21          2HH1      ARG  21  -6.002  -7.303   9.278
  128   HH21  ARG  21          1HH2      ARG  21  -8.825  -5.715   7.962
  129   HH22  ARG  21          2HH2      ARG  21  -8.241  -6.834   9.145
  130    H    PHE  22           H        PHE  22  -6.499   0.707   5.830
  131    HA   PHE  22           HA       PHE  22  -6.596   1.645   8.585
  132    HB2  PHE  22           1HB      PHE  22  -6.069   3.620   6.368
  133    HB3  PHE  22           2HB      PHE  22  -6.021   3.899   8.106
  134    HD1  PHE  22           HD2      PHE  22  -4.314   2.103   5.350
  135    HD2  PHE  22           HD1      PHE  22  -4.030   3.667   9.298
  136    HE1  PHE  22           HE2      PHE  22  -1.895   1.657   5.349
  137    HE2  PHE  22           HE1      PHE  22  -1.610   3.225   9.303
  138    HZ   PHE  22           HZ       PHE  22  -0.539   2.218   7.327
  139    H    THR  23           H        THR  23  -8.671   1.783   9.082
  140    HA   THR  23           HA       THR  23 -10.800   1.574   7.335
  141    HB   THR  23           HB       THR  23 -12.211   2.515   9.178
  142    HG1  THR  23           HG1      THR  23 -10.747   2.690  11.204
  143   HG21  THR  23          3HG2      THR  23 -11.232   0.095   9.002
  144   HG22  THR  23          1HG2      THR  23 -12.053   0.609  10.475
  145   HG23  THR  23          2HG2      THR  23 -10.291   0.584  10.411
  146    H    GLN  24           H        GLN  24  -9.314   4.509   8.656
  147    HA   GLN  24           HA       GLN  24 -10.954   6.106   6.809
  148    HB2  GLN  24           1HB      GLN  24  -9.584   6.789   9.400
  149    HB3  GLN  24           2HB      GLN  24 -10.122   8.037   8.285
  150    HG2  GLN  24           1HG      GLN  24 -11.892   7.885   9.744
  151    HG3  GLN  24           2HG      GLN  24 -12.407   6.837   8.424
  152   HE21  GLN  24          1HE2      GLN  24 -11.020   6.893  11.646
  153   HE22  GLN  24          2HE2      GLN  24 -11.510   5.296  12.089
  154    H    ASN  25           H        ASN  25 -10.000   7.594   5.431
  155    HA   ASN  25           HA       ASN  25  -7.453   6.918   4.418
  156    HB2  ASN  25           1HB      ASN  25  -9.038   7.851   2.903
  157    HB3  ASN  25           2HB      ASN  25  -9.281   9.268   3.921
  158   HD21  ASN  25          1HD2      ASN  25  -7.078   7.646   1.749
  159   HD22  ASN  25          2HD2      ASN  25  -6.125   9.036   1.368
  160    H    SER  26           H        SER  26  -8.584   9.618   6.414
  161    HA   SER  26           HA       SER  26  -6.413  11.247   6.513
  162    HB2  SER  26           1HB      SER  26  -7.129  11.966   8.687
  163    HB3  SER  26           2HB      SER  26  -8.578  11.526   7.783
  164    HG   SER  26           HG       SER  26  -8.090  10.684  10.097
  165    H    HIS  27           H        HIS  27  -6.831   8.216   8.293
  166    HA   HIS  27           HA       HIS  27  -4.564   8.294   9.886
  167    HB2  HIS  27           1HB      HIS  27  -6.522   6.520   9.632
  168    HB3  HIS  27           2HB      HIS  27  -5.330   5.698   8.629
  169    HD1  HIS  27           HD1      HIS  27  -6.440   4.791  11.509
  170    HD2  HIS  27           HD2      HIS  27  -2.749   6.503  10.668
  171    HE1  HIS  27           HE1      HIS  27  -4.930   4.092  13.394
  172    H    LEU  28           H        LEU  28  -4.902   7.044   6.577
  173    HA   LEU  28           HA       LEU  28  -2.260   6.170   6.258
  174    HB2  LEU  28           1HB      LEU  28  -3.827   5.423   4.683
  175    HB3  LEU  28           2HB      LEU  28  -4.377   7.059   4.329
  176    HG   LEU  28           HG       LEU  28  -2.127   7.469   3.271
  177   HD11  LEU  28          1HD1      LEU  28  -0.629   5.904   3.951
  178   HD12  LEU  28          2HD1      LEU  28  -1.192   5.113   2.478
  179   HD13  LEU  28          3HD1      LEU  28  -1.837   4.622   4.044
  180   HD21  LEU  28          3HD2      LEU  28  -3.570   5.213   1.922
  181   HD22  LEU  28          1HD2      LEU  28  -2.812   6.636   1.205
  182   HD23  LEU  28          2HD2      LEU  28  -4.318   6.801   2.107
  183    H    HIS  29           H        HIS  29  -3.770   9.261   5.348
  184    HA   HIS  29           HA       HIS  29  -1.712  10.558   4.137
  185    HB2  HIS  29           1HB      HIS  29  -3.886  11.490   5.960
  186    HB3  HIS  29           2HB      HIS  29  -2.630  12.635   5.498
  187    HD1  HIS  29           HD1      HIS  29  -4.427  14.002   4.183
  188    HD2  HIS  29           HD2      HIS  29  -3.786  10.152   2.759
  189    HE1  HIS  29           HE1      HIS  29  -5.504  13.937   1.911
  190    H    SER  30           H        SER  30  -2.291  10.658   7.658
  191    HA   SER  30           HA       SER  30   0.200  11.901   8.227
  192    HB2  SER  30           1HB      SER  30  -1.928  11.883   9.668
  193    HB3  SER  30           2HB      SER  30  -1.403  10.289  10.208
  194    HG   SER  30           HG       SER  30  -0.390  11.504  11.632
  195    H    HIS  31           H        HIS  31  -0.948   8.554   8.405
  196    HA   HIS  31           HA       HIS  31   1.223   7.344   9.598
  197    HB2  HIS  31           1HB      HIS  31  -0.510   5.866   9.261
  198    HB3  HIS  31           2HB      HIS  31  -0.826   6.443   7.627
  199    HD1  HIS  31           HD1      HIS  31   1.610   4.257   9.524
  200    HD2  HIS  31           HD2      HIS  31   0.326   4.959   5.635
  201    HE1  HIS  31           HE1      HIS  31   2.675   2.456   8.129
  202    H    GLN  32           H        GLN  32   0.852   8.432   6.282
  203    HA   GLN  32           HA       GLN  32   2.964   7.155   5.047
  204    HB2  GLN  32           1HB      GLN  32   1.752   9.877   4.653
  205    HB3  GLN  32           2HB      GLN  32   3.105   9.338   3.667
  206    HG2  GLN  32           1HG      GLN  32   0.726   7.573   3.907
  207    HG3  GLN  32           2HG      GLN  32   0.625   9.006   2.885
  208   HE21  GLN  32          1HE2      GLN  32   0.508   6.236   2.095
  209   HE22  GLN  32          2HE2      GLN  32   1.818   5.976   0.999
  210    H    ARG  33           H        ARG  33   3.011  10.116   6.990
  211    HA   ARG  33           HA       ARG  33   5.651  10.872   6.603
  212    HB2  ARG  33           1HB      ARG  33   3.892  11.136   9.043
  213    HB3  ARG  33           2HB      ARG  33   5.463  11.912   8.890
  214    HG2  ARG  33           1HG      ARG  33   4.444  12.872   6.683
  215    HG3  ARG  33           2HG      ARG  33   2.911  12.502   7.476
  216    HD2  ARG  33           1HD      ARG  33   3.222  14.629   8.236
  217    HD3  ARG  33           2HD      ARG  33   4.071  13.741   9.501
  218    HE   ARG  33           HE       ARG  33   5.876  14.379   7.442
  219   HH11  ARG  33          1HH1      ARG  33   4.042  15.899   9.982
  220   HH12  ARG  33          2HH1      ARG  33   5.168  17.199  10.194
  221   HH21  ARG  33          1HH2      ARG  33   7.365  16.086   7.712
  222   HH22  ARG  33          2HH2      ARG  33   7.057  17.305   8.902
  223    H    VAL  34           H        VAL  34   4.350   8.225   8.406
  224    HA   VAL  34           HA       VAL  34   6.382   7.729  10.242
  225    HB   VAL  34           HB       VAL  34   4.761   5.658   8.755
  226   HG11  VAL  34          1HG1      VAL  34   5.282   4.883  11.407
  227   HG12  VAL  34          2HG1      VAL  34   5.919   4.167   9.925
  228   HG13  VAL  34          3HG1      VAL  34   6.813   5.450  10.742
  229   HG21  VAL  34          3HG2      VAL  34   4.095   6.747  11.464
  230   HG22  VAL  34          1HG2      VAL  34   3.547   7.570  10.004
  231   HG23  VAL  34          2HG2      VAL  34   3.056   5.905  10.315
  232    H    HIS  35           H        HIS  35   6.404   7.465   6.825
  233    HA   HIS  35           HA       HIS  35   8.739   5.709   6.815
  234    HB2  HIS  35           1HB      HIS  35   7.154   6.875   4.517
  235    HB3  HIS  35           2HB      HIS  35   8.475   5.720   4.363
  236    HD1  HIS  35           HD1      HIS  35   7.947   3.406   5.883
  237    HD2  HIS  35           HD2      HIS  35   4.750   5.660   4.482
  238    HE1  HIS  35           HE1      HIS  35   5.963   1.861   5.931
  239    H    THR  36           H        THR  36   7.860   9.035   6.455
  240    HA   THR  36           HA       THR  36   9.047  10.877   5.706
  241    HB   THR  36           HB       THR  36  11.257  11.038   7.055
  242    HG1  THR  36           HG1      THR  36  11.246   8.661   7.380
  243   HG21  THR  36          3HG2      THR  36  10.071  12.000   8.737
  244   HG22  THR  36          1HG2      THR  36   9.010  10.605   8.933
  245   HG23  THR  36          2HG2      THR  36   8.731  11.748   7.619
  246    H    GLY  37           H        GLY  37   9.362   8.716   3.874
  247    HA2  GLY  37           1HA      GLY  37  11.898   7.980   3.143
  248    HA3  GLY  37           2HA      GLY  37  10.616   8.309   1.986
  249    H    GLU  38           H        GLU  38  10.288  11.046   2.369
  250    HA   GLU  38           HA       GLU  38  12.557  12.027   0.897
  251    HB2  GLU  38           1HB      GLU  38  11.277  14.139   0.789
  252    HB3  GLU  38           2HB      GLU  38  10.335  12.753   0.259
  253    HG2  GLU  38           1HG      GLU  38   8.789  13.764   1.567
  254    HG3  GLU  38           2HG      GLU  38   9.570  12.757   2.786
  255    H    LYS  39           H        LYS  39  13.446  11.245   3.359
  256    HA   LYS  39           HA       LYS  39  14.055  13.816   4.664
  257    HB2  LYS  39           1HB      LYS  39  12.597  12.121   5.958
  258    HB3  LYS  39           2HB      LYS  39  14.077  11.186   6.124
  259    HG2  LYS  39           1HG      LYS  39  15.102  13.315   7.094
  260    HG3  LYS  39           2HG      LYS  39  13.441  13.898   7.232
  261    HD2  LYS  39           1HD      LYS  39  12.931  11.778   8.505
  262    HD3  LYS  39           2HD      LYS  39  14.670  11.480   8.544
  263    HE2  LYS  39           1HE      LYS  39  14.386  12.568  10.541
  264    HE3  LYS  39           2HE      LYS  39  14.744  13.932   9.482
  265    HZ1  LYS  39           3HZ      LYS  39  12.577  13.715  11.096
  266    HZ2  LYS  39           1HZ      LYS  39  11.950  13.284   9.585
  267    HZ3  LYS  39           2HZ      LYS  39  12.720  14.776   9.786
  268    HA   PRO  40           HA       PRO  40  18.209  12.776   3.489
  269    HB2  PRO  40           1HB      PRO  40  19.413  14.847   4.766
  270    HB3  PRO  40           2HB      PRO  40  18.534  15.038   3.244
  271    HG2  PRO  40           1HG      PRO  40  17.626  15.603   6.040
  272    HG3  PRO  40           2HG      PRO  40  17.386  16.565   4.570
  273    HD2  PRO  40           1HD      PRO  40  15.457  14.965   5.595
  274    HD3  PRO  40           2HD      PRO  40  15.626  15.260   3.852
  275    H    SER  41           H        SER  41  17.580  13.802   6.848
  276    HA   SER  41           HA       SER  41  18.901  11.432   7.851
  277    HB2  SER  41           1HB      SER  41  20.434  12.785   9.325
  278    HB3  SER  41           2HB      SER  41  20.842  12.827   7.610
  279    HG   SER  41           HG       SER  41  19.484  14.832   7.629
  280    H    GLY  42           H        GLY  42  18.470  11.021  10.062
  281    HA2  GLY  42           1HA      GLY  42  16.287  12.689  11.153
  282    HA3  GLY  42           2HA      GLY  42  16.376  10.945  11.353
  283    HA   PRO  43           HA       PRO  43  18.096  12.936  15.170
  284    HB2  PRO  43           1HB      PRO  43  16.726  11.351  16.897
  285    HB3  PRO  43           2HB      PRO  43  16.058  12.844  16.227
  286    HG2  PRO  43           1HG      PRO  43  15.598  10.011  15.375
  287    HG3  PRO  43           2HG      PRO  43  14.426  11.330  15.554
  288    HD2  PRO  43           1HD      PRO  43  15.420  10.580  13.149
  289    HD3  PRO  43           2HD      PRO  43  14.970  12.258  13.516
  290    H    SER  44           H        SER  44  17.465   9.505  14.490
  291    HA   SER  44           HA       SER  44  18.667   7.614  14.905
  292    HB2  SER  44           1HB      SER  44  20.164   8.915  13.299
  293    HB3  SER  44           2HB      SER  44  21.114   9.372  14.713
  294    HG   SER  44           HG       SER  44  21.562   7.211  15.078
  295    H    SER  45           H        SER  45  17.737   8.845  17.209
  296    HA   SER  45           HA       SER  45  19.954   8.715  19.119
  297    HB2  SER  45           1HB      SER  45  18.351  10.653  19.174
  298    HB3  SER  45           2HB      SER  45  17.086   9.520  19.649
  299    HG   SER  45           HG       SER  45  19.407  10.277  21.070
  300    H    GLY  46           H        GLY  46  16.707   7.357  18.597
  301    HA2  GLY  46           1HA      GLY  46  16.930   4.782  18.938
  302    HA3  GLY  46           2HA      GLY  46  17.294   5.277  20.584
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1 -10.573 -23.747   7.764
    2    HA2  GLY   1           1HA      GLY   1  -8.921 -23.544   9.445
    3    HA3  GLY   1           2HA      GLY   1  -7.812 -24.457   8.431
    4    H    SER   2           H        SER   2  -7.272 -23.289   6.296
    5    HA   SER   2           HA       SER   2  -5.728 -21.111   6.741
    6    HB2  SER   2           1HB      SER   2  -6.127 -22.530   4.567
    7    HB3  SER   2           2HB      SER   2  -7.228 -21.218   4.147
    8    HG   SER   2           HG       SER   2  -4.584 -21.272   3.934
    9    H    SER   3           H        SER   3  -5.909 -18.869   6.545
   10    HA   SER   3           HA       SER   3  -8.373 -17.775   7.468
   11    HB2  SER   3           1HB      SER   3  -7.163 -15.576   7.215
   12    HB3  SER   3           2HB      SER   3  -6.334 -16.760   8.225
   13    HG   SER   3           HG       SER   3  -5.446 -15.548   6.025
   14    H    GLY   4           H        GLY   4 -10.075 -17.250   6.277
   15    HA2  GLY   4           1HA      GLY   4  -9.658 -16.086   3.620
   16    HA3  GLY   4           2HA      GLY   4 -10.656 -17.528   3.736
   17    H    SER   5           H        SER   5 -10.552 -14.138   4.018
   18    HA   SER   5           HA       SER   5 -13.103 -13.987   5.426
   19    HB2  SER   5           1HB      SER   5 -10.963 -12.037   4.709
   20    HB3  SER   5           2HB      SER   5 -12.603 -11.423   4.914
   21    HG   SER   5           HG       SER   5 -11.966 -11.383   6.940
   22    H    SER   6           H        SER   6 -14.959 -13.983   4.363
   23    HA   SER   6           HA       SER   6 -14.956 -13.194   1.526
   24    HB2  SER   6           1HB      SER   6 -16.539 -15.222   3.070
   25    HB3  SER   6           2HB      SER   6 -17.220 -14.516   1.604
   26    HG   SER   6           HG       SER   6 -14.955 -15.134   0.765
   27    H    GLY   7           H        GLY   7 -15.053 -11.186   3.441
   28    HA2  GLY   7           1HA      GLY   7 -17.889 -10.390   3.501
   29    HA3  GLY   7           2HA      GLY   7 -16.635  -9.744   4.548
   30    H    SER   8           H        SER   8 -15.575  -7.936   3.952
   31    HA   SER   8           HA       SER   8 -16.218  -6.840   1.294
   32    HB2  SER   8           1HB      SER   8 -15.827  -5.502   3.964
   33    HB3  SER   8           2HB      SER   8 -15.680  -4.599   2.456
   34    HG   SER   8           HG       SER   8 -17.835  -4.732   3.560
   35    H    GLY   9           H        GLY   9 -14.092  -8.589   1.501
   36    HA2  GLY   9           1HA      GLY   9 -11.843  -8.796   1.075
   37    HA3  GLY   9           2HA      GLY   9 -12.019  -7.246   0.265
   38    H    GLU  10           H        GLU  10 -10.577  -5.816   0.931
   39    HA   GLU  10           HA       GLU  10  -9.969  -5.666   3.803
   40    HB2  GLU  10           1HB      GLU  10  -7.978  -5.631   1.532
   41    HB3  GLU  10           2HB      GLU  10  -7.591  -5.143   3.176
   42    HG2  GLU  10           1HG      GLU  10  -7.806  -7.302   4.003
   43    HG3  GLU  10           2HG      GLU  10  -8.746  -7.843   2.614
   44    H    LYS  11           H        LYS  11  -8.858  -3.571   4.362
   45    HA   LYS  11           HA       LYS  11 -10.434  -1.399   3.698
   46    HB2  LYS  11           1HB      LYS  11  -7.556  -1.334   4.624
   47    HB3  LYS  11           2HB      LYS  11  -8.701  -0.004   4.728
   48    HG2  LYS  11           1HG      LYS  11  -8.988  -2.651   6.136
   49    HG3  LYS  11           2HG      LYS  11  -8.396  -1.159   6.871
   50    HD2  LYS  11           1HD      LYS  11 -10.590  -1.025   7.481
   51    HD3  LYS  11           2HD      LYS  11 -10.683  -0.220   5.913
   52    HE2  LYS  11           1HE      LYS  11 -12.393  -1.705   5.666
   53    HE3  LYS  11           2HE      LYS  11 -11.066  -2.704   5.077
   54    HZ1  LYS  11           3HZ      LYS  11 -12.566  -2.893   7.582
   55    HZ2  LYS  11           1HZ      LYS  11 -10.933  -3.338   7.606
   56    HZ3  LYS  11           2HZ      LYS  11 -12.009  -4.122   6.562
   57    HA   PRO  12           HA       PRO  12  -9.090  -0.206  -0.331
   58    HB2  PRO  12           1HB      PRO  12 -10.056   2.331  -0.329
   59    HB3  PRO  12           2HB      PRO  12 -11.092   0.909  -0.496
   60    HG2  PRO  12           1HG      PRO  12 -10.522   2.562   1.934
   61    HG3  PRO  12           2HG      PRO  12 -12.068   1.904   1.366
   62    HD2  PRO  12           1HD      PRO  12 -10.631   0.744   3.346
   63    HD3  PRO  12           2HD      PRO  12 -11.633  -0.192   2.219
   64    H    PHE  13           H        PHE  13  -8.620   2.229   2.236
   65    HA   PHE  13           HA       PHE  13  -6.386   3.422   0.887
   66    HB2  PHE  13           1HB      PHE  13  -7.155   3.817   3.778
   67    HB3  PHE  13           2HB      PHE  13  -6.269   4.924   2.734
   68    HD1  PHE  13           HD1      PHE  13  -7.474   6.046   0.849
   69    HD2  PHE  13           HD2      PHE  13  -9.501   3.847   3.877
   70    HE1  PHE  13           HE1      PHE  13  -9.580   7.167   0.248
   71    HE2  PHE  13           HE2      PHE  13 -11.611   4.963   3.280
   72    HZ   PHE  13           HZ       PHE  13 -11.652   6.625   1.463
   73    H    GLN  14           H        GLN  14  -4.696   2.045   0.640
   74    HA   GLN  14           HA       GLN  14  -3.519   0.945   3.107
   75    HB2  GLN  14           1HB      GLN  14  -3.541  -0.270   0.340
   76    HB3  GLN  14           2HB      GLN  14  -2.597  -0.889   1.688
   77    HG2  GLN  14           1HG      GLN  14  -4.847  -1.035   2.922
   78    HG3  GLN  14           2HG      GLN  14  -5.564  -0.878   1.319
   79   HE21  GLN  14          1HE2      GLN  14  -2.858  -2.663   2.773
   80   HE22  GLN  14          2HE2      GLN  14  -3.278  -4.193   2.090
   81    H    CYS  15           H        CYS  15  -1.354   1.218   3.423
   82    HA   CYS  15           HA       CYS  15  -0.048   3.380   2.294
   83    HB2  CYS  15           1HB      CYS  15   0.483   1.940   4.423
   84    HB3  CYS  15           2HB      CYS  15   1.538   1.057   3.324
   85    H    GLU  16           H        GLU  16   2.170   3.203   1.182
   86    HA   GLU  16           HA       GLU  16   1.913   1.345  -1.092
   87    HB2  GLU  16           1HB      GLU  16   2.653   4.223  -0.931
   88    HB3  GLU  16           2HB      GLU  16   3.479   3.241  -2.133
   89    HG2  GLU  16           1HG      GLU  16   0.529   3.746  -1.888
   90    HG3  GLU  16           2HG      GLU  16   1.610   4.251  -3.185
   91    H    GLU  17           H        GLU  17   3.912   2.480   1.461
   92    HA   GLU  17           HA       GLU  17   6.287   1.182   0.345
   93    HB2  GLU  17           1HB      GLU  17   5.950   2.897   2.812
   94    HB3  GLU  17           2HB      GLU  17   7.474   2.210   2.265
   95    HG2  GLU  17           1HG      GLU  17   5.798   4.279   0.870
   96    HG3  GLU  17           2HG      GLU  17   7.393   4.491   1.589
   97    H    CYS  18           H        CYS  18   3.819   0.765   2.721
   98    HA   CYS  18           HA       CYS  18   5.074  -1.762   3.540
   99    HB2  CYS  18           1HB      CYS  18   4.616  -1.418   5.828
  100    HB3  CYS  18           2HB      CYS  18   5.311   0.103   5.276
  101    H    GLY  19           H        GLY  19   2.654  -0.518   1.898
  102    HA2  GLY  19           1HA      GLY  19   0.394  -0.996   1.602
  103    HA3  GLY  19           2HA      GLY  19   1.048  -2.627   1.587
  104    H    LYS  20           H        LYS  20   0.007  -0.121   3.892
  105    HA   LYS  20           HA       LYS  20  -0.779  -2.201   5.782
  106    HB2  LYS  20           1HB      LYS  20  -0.262   0.722   5.938
  107    HB3  LYS  20           2HB      LYS  20  -1.435   0.056   7.066
  108    HG2  LYS  20           1HG      LYS  20   1.179  -1.323   6.801
  109    HG3  LYS  20           2HG      LYS  20   1.130   0.220   7.656
  110    HD2  LYS  20           1HD      LYS  20   0.811  -1.405   9.322
  111    HD3  LYS  20           2HD      LYS  20  -0.804  -0.774   8.991
  112    HE2  LYS  20           1HE      LYS  20  -1.395  -2.684   7.733
  113    HE3  LYS  20           2HE      LYS  20   0.277  -3.234   7.643
  114    HZ1  LYS  20           3HZ      LYS  20  -0.627  -4.576   9.268
  115    HZ2  LYS  20           1HZ      LYS  20  -1.586  -3.345   9.922
  116    HZ3  LYS  20           2HZ      LYS  20   0.083  -3.350  10.192
  117    H    ARG  21           H        ARG  21  -2.888  -1.262   7.086
  118    HA   ARG  21           HA       ARG  21  -4.966  -0.770   5.062
  119    HB2  ARG  21           1HB      ARG  21  -5.076  -2.769   7.327
  120    HB3  ARG  21           2HB      ARG  21  -6.452  -2.319   6.328
  121    HG2  ARG  21           1HG      ARG  21  -5.619  -3.395   4.461
  122    HG3  ARG  21           2HG      ARG  21  -3.959  -3.364   5.059
  123    HD2  ARG  21           1HD      ARG  21  -5.021  -4.859   6.974
  124    HD3  ARG  21           2HD      ARG  21  -6.184  -5.226   5.700
  125    HE   ARG  21           HE       ARG  21  -3.442  -5.493   4.880
  126   HH11  ARG  21          1HH1      ARG  21  -6.152  -7.081   6.380
  127   HH12  ARG  21          2HH1      ARG  21  -5.598  -8.676   5.995
  128   HH21  ARG  21          1HH2      ARG  21  -2.701  -7.588   4.367
  129   HH22  ARG  21          2HH2      ARG  21  -3.634  -8.964   4.851
  130    H    PHE  22           H        PHE  22  -6.514   0.674   5.610
  131    HA   PHE  22           HA       PHE  22  -6.870   1.472   8.380
  132    HB2  PHE  22           1HB      PHE  22  -6.184   3.569   6.321
  133    HB3  PHE  22           2HB      PHE  22  -6.367   3.784   8.059
  134    HD1  PHE  22           HD1      PHE  22  -4.657   2.847   9.598
  135    HD2  PHE  22           HD2      PHE  22  -4.132   2.891   5.375
  136    HE1  PHE  22           HE1      PHE  22  -2.240   2.493   9.898
  137    HE2  PHE  22           HE2      PHE  22  -1.715   2.536   5.668
  138    HZ   PHE  22           HZ       PHE  22  -0.766   2.336   7.932
  139    H    THR  23           H        THR  23  -8.915   2.086   8.801
  140    HA   THR  23           HA       THR  23 -10.973   1.605   6.991
  141    HB   THR  23           HB       THR  23 -11.109   3.420   9.406
  142    HG1  THR  23           HG1      THR  23 -11.754   0.655   9.301
  143   HG21  THR  23          3HG2      THR  23 -13.505   2.439   9.390
  144   HG22  THR  23          1HG2      THR  23 -13.171   2.069   7.698
  145   HG23  THR  23          2HG2      THR  23 -13.114   3.738   8.264
  146    H    GLN  24           H        GLN  24  -9.547   4.703   7.993
  147    HA   GLN  24           HA       GLN  24 -10.750   5.921   5.596
  148    HB2  GLN  24           1HB      GLN  24 -10.502   7.021   8.384
  149    HB3  GLN  24           2HB      GLN  24 -10.671   8.085   6.995
  150    HG2  GLN  24           1HG      GLN  24 -12.619   5.875   7.555
  151    HG3  GLN  24           2HG      GLN  24 -12.780   7.477   8.271
  152   HE21  GLN  24          1HE2      GLN  24 -14.073   5.699   6.010
  153   HE22  GLN  24          2HE2      GLN  24 -14.393   6.869   4.779
  154    H    ASN  25           H        ASN  25  -9.479   7.286   4.394
  155    HA   ASN  25           HA       ASN  25  -6.765   6.865   4.252
  156    HB2  ASN  25           1HB      ASN  25  -6.693   9.043   2.963
  157    HB3  ASN  25           2HB      ASN  25  -7.873   7.867   2.393
  158   HD21  ASN  25          1HD2      ASN  25  -7.420  11.028   2.993
  159   HD22  ASN  25          2HD2      ASN  25  -9.049  11.519   3.289
  160    H    SER  26           H        SER  26  -8.509   9.298   6.107
  161    HA   SER  26           HA       SER  26  -6.677  11.097   6.873
  162    HB2  SER  26           1HB      SER  26  -9.077  10.630   7.797
  163    HB3  SER  26           2HB      SER  26  -8.224   9.744   9.061
  164    HG   SER  26           HG       SER  26  -7.401  12.345   8.404
  165    H    HIS  27           H        HIS  27  -6.963   7.878   8.370
  166    HA   HIS  27           HA       HIS  27  -4.814   8.098  10.133
  167    HB2  HIS  27           1HB      HIS  27  -6.651   6.220   9.776
  168    HB3  HIS  27           2HB      HIS  27  -5.369   5.467   8.833
  169    HD1  HIS  27           HD1      HIS  27  -6.423   4.214  11.463
  170    HD2  HIS  27           HD2      HIS  27  -3.088   6.676  11.190
  171    HE1  HIS  27           HE1      HIS  27  -5.012   3.658  13.468
  172    H    LEU  28           H        LEU  28  -4.902   7.043   6.759
  173    HA   LEU  28           HA       LEU  28  -2.185   6.259   6.611
  174    HB2  LEU  28           1HB      LEU  28  -3.628   5.411   4.961
  175    HB3  LEU  28           2HB      LEU  28  -4.240   7.013   4.558
  176    HG   LEU  28           HG       LEU  28  -1.824   7.467   3.741
  177   HD11  LEU  28          1HD1      LEU  28  -1.442   4.781   2.870
  178   HD12  LEU  28          2HD1      LEU  28  -1.552   4.803   4.629
  179   HD13  LEU  28          3HD1      LEU  28  -0.359   5.809   3.808
  180   HD21  LEU  28          3HD2      LEU  28  -3.938   5.833   2.402
  181   HD22  LEU  28          1HD2      LEU  28  -2.423   6.176   1.565
  182   HD23  LEU  28          2HD2      LEU  28  -3.452   7.503   2.105
  183    H    HIS  29           H        HIS  29  -3.854   9.234   5.594
  184    HA   HIS  29           HA       HIS  29  -1.960  10.722   4.446
  185    HB2  HIS  29           1HB      HIS  29  -4.057  11.419   6.444
  186    HB3  HIS  29           2HB      HIS  29  -2.869  12.655   6.041
  187    HD1  HIS  29           HD1      HIS  29  -4.261  14.196   4.642
  188    HD2  HIS  29           HD2      HIS  29  -4.554  10.236   3.418
  189    HE1  HIS  29           HE1      HIS  29  -5.561  14.252   2.490
  190    H    SER  30           H        SER  30  -2.217  10.369   7.981
  191    HA   SER  30           HA       SER  30   0.238  11.770   8.453
  192    HB2  SER  30           1HB      SER  30  -0.088  10.985  10.814
  193    HB3  SER  30           2HB      SER  30  -1.472  11.856  10.153
  194    HG   SER  30           HG       SER  30  -2.533   9.921   9.867
  195    H    HIS  31           H        HIS  31  -0.718   8.388   9.082
  196    HA   HIS  31           HA       HIS  31   1.602   7.251   9.812
  197    HB2  HIS  31           1HB      HIS  31  -0.269   5.827   9.617
  198    HB3  HIS  31           2HB      HIS  31  -0.494   6.215   7.914
  199    HD1  HIS  31           HD1      HIS  31   1.556   4.085  10.208
  200    HD2  HIS  31           HD2      HIS  31   1.070   4.738   6.134
  201    HE1  HIS  31           HE1      HIS  31   2.785   2.207   9.075
  202    H    GLN  32           H        GLN  32   0.909   8.567   6.676
  203    HA   GLN  32           HA       GLN  32   2.857   7.318   5.126
  204    HB2  GLN  32           1HB      GLN  32   1.395   9.902   4.993
  205    HB3  GLN  32           2HB      GLN  32   2.828   9.738   3.988
  206    HG2  GLN  32           1HG      GLN  32   0.821   7.554   3.923
  207    HG3  GLN  32           2HG      GLN  32   0.428   9.074   3.123
  208   HE21  GLN  32          1HE2      GLN  32   0.722   6.628   1.795
  209   HE22  GLN  32          2HE2      GLN  32   2.090   6.738   0.746
  210    H    ARG  33           H        ARG  33   3.085  10.283   7.071
  211    HA   ARG  33           HA       ARG  33   5.661  11.051   6.462
  212    HB2  ARG  33           1HB      ARG  33   5.658  12.312   8.463
  213    HB3  ARG  33           2HB      ARG  33   3.979  12.241   7.945
  214    HG2  ARG  33           1HG      ARG  33   3.349  10.911   9.688
  215    HG3  ARG  33           2HG      ARG  33   4.947  10.180   9.851
  216    HD2  ARG  33           1HD      ARG  33   4.637  13.084  10.429
  217    HD3  ARG  33           2HD      ARG  33   4.044  11.920  11.614
  218    HE   ARG  33           HE       ARG  33   6.804  12.458  10.923
  219   HH11  ARG  33          1HH1      ARG  33   4.544  10.316  12.479
  220   HH12  ARG  33          2HH1      ARG  33   5.741   9.575  13.489
  221   HH21  ARG  33          1HH2      ARG  33   8.390  11.490  12.247
  222   HH22  ARG  33          2HH2      ARG  33   7.928  10.244  13.357
  223    H    VAL  34           H        VAL  34   4.627   8.247   8.114
  224    HA   VAL  34           HA       VAL  34   6.824   7.738   9.784
  225    HB   VAL  34           HB       VAL  34   5.054   5.746   8.360
  226   HG11  VAL  34          1HG1      VAL  34   6.759   5.362  10.817
  227   HG12  VAL  34          2HG1      VAL  34   5.763   4.145  10.017
  228   HG13  VAL  34          3HG1      VAL  34   7.184   4.799   9.201
  229   HG21  VAL  34          3HG2      VAL  34   3.652   5.773  10.257
  230   HG22  VAL  34          1HG2      VAL  34   4.819   6.699  11.202
  231   HG23  VAL  34          2HG2      VAL  34   3.955   7.467   9.870
  232    H    HIS  35           H        HIS  35   6.319   7.199   6.354
  233    HA   HIS  35           HA       HIS  35   8.969   5.950   6.148
  234    HB2  HIS  35           1HB      HIS  35   6.957   6.161   3.918
  235    HB3  HIS  35           2HB      HIS  35   8.300   5.034   4.075
  236    HD1  HIS  35           HD1      HIS  35   7.972   3.042   5.758
  237    HD2  HIS  35           HD2      HIS  35   4.589   5.363   5.100
  238    HE1  HIS  35           HE1      HIS  35   6.047   1.694   6.655
  239    H    THR  36           H        THR  36   8.112   8.909   6.384
  240    HA   THR  36           HA       THR  36   8.669  10.264   4.015
  241    HB   THR  36           HB       THR  36   7.764  11.297   6.118
  242    HG1  THR  36           HG1      THR  36   9.446  13.188   5.790
  243   HG21  THR  36          3HG2      THR  36   9.902  10.248   7.369
  244   HG22  THR  36          1HG2      THR  36   9.018  11.648   7.976
  245   HG23  THR  36          2HG2      THR  36  10.507  11.875   7.058
  246    H    GLY  37           H        GLY  37  10.558  11.317   3.254
  247    HA2  GLY  37           1HA      GLY  37  12.792  11.475   2.748
  248    HA3  GLY  37           2HA      GLY  37  13.108  11.047   4.423
  249    H    GLU  38           H        GLU  38  11.467   9.134   1.934
  250    HA   GLU  38           HA       GLU  38  13.712   7.237   1.994
  251    HB2  GLU  38           1HB      GLU  38  10.778   6.611   2.314
  252    HB3  GLU  38           2HB      GLU  38  11.973   5.395   1.887
  253    HG2  GLU  38           1HG      GLU  38  13.171   5.847   3.973
  254    HG3  GLU  38           2HG      GLU  38  11.954   7.047   4.403
  255    H    LYS  39           H        LYS  39  14.462   6.881   0.023
  256    HA   LYS  39           HA       LYS  39  12.680   6.482  -2.211
  257    HB2  LYS  39           1HB      LYS  39  14.345   8.943  -1.923
  258    HB3  LYS  39           2HB      LYS  39  14.176   8.230  -3.522
  259    HG2  LYS  39           1HG      LYS  39  11.625   8.276  -2.941
  260    HG3  LYS  39           2HG      LYS  39  12.125   9.519  -1.792
  261    HD2  LYS  39           1HD      LYS  39  13.070   9.680  -4.618
  262    HD3  LYS  39           2HD      LYS  39  11.416  10.162  -4.234
  263    HE2  LYS  39           1HE      LYS  39  12.400  11.646  -2.443
  264    HE3  LYS  39           2HE      LYS  39  13.980  11.304  -3.146
  265    HZ1  LYS  39           3HZ      LYS  39  11.688  12.642  -4.473
  266    HZ2  LYS  39           1HZ      LYS  39  13.101  12.172  -5.277
  267    HZ3  LYS  39           2HZ      LYS  39  13.173  13.337  -4.053
  268    HA   PRO  40           HA       PRO  40  15.914   3.741  -3.381
  269    HB2  PRO  40           1HB      PRO  40  15.373   3.495  -6.030
  270    HB3  PRO  40           2HB      PRO  40  14.378   2.750  -4.773
  271    HG2  PRO  40           1HG      PRO  40  13.922   5.288  -6.293
  272    HG3  PRO  40           2HG      PRO  40  12.764   4.014  -5.872
  273    HD2  PRO  40           1HD      PRO  40  12.941   6.336  -4.490
  274    HD3  PRO  40           2HD      PRO  40  12.488   4.800  -3.723
  275    H    SER  41           H        SER  41  15.892   6.947  -4.142
  276    HA   SER  41           HA       SER  41  18.244   6.793  -5.893
  277    HB2  SER  41           1HB      SER  41  17.840   9.270  -6.186
  278    HB3  SER  41           2HB      SER  41  16.550   8.232  -6.792
  279    HG   SER  41           HG       SER  41  15.584   9.829  -5.609
  280    H    GLY  42           H        GLY  42  19.811   6.274  -4.358
  281    HA2  GLY  42           1HA      GLY  42  20.201   7.359  -1.857
  282    HA3  GLY  42           2HA      GLY  42  21.505   6.804  -2.897
  283    HA   PRO  43           HA       PRO  43  20.885  11.647  -3.036
  284    HB2  PRO  43           1HB      PRO  43  20.742  12.601  -0.499
  285    HB3  PRO  43           2HB      PRO  43  19.311  12.213  -1.461
  286    HG2  PRO  43           1HG      PRO  43  20.663  10.593   0.662
  287    HG3  PRO  43           2HG      PRO  43  18.931  10.863   0.394
  288    HD2  PRO  43           1HD      PRO  43  20.190   8.597  -0.388
  289    HD3  PRO  43           2HD      PRO  43  18.815   9.281  -1.279
  290    H    SER  44           H        SER  44  22.408  10.161  -0.173
  291    HA   SER  44           HA       SER  44  24.752  11.844  -0.484
  292    HB2  SER  44           1HB      SER  44  24.039   9.713   1.542
  293    HB3  SER  44           2HB      SER  44  25.547  10.627   1.565
  294    HG   SER  44           HG       SER  44  22.969  11.427   2.206
  295    H    SER  45           H        SER  45  26.916  10.562  -0.051
  296    HA   SER  45           HA       SER  45  27.752   9.344  -2.300
  297    HB2  SER  45           1HB      SER  45  28.613   8.803   0.542
  298    HB3  SER  45           2HB      SER  45  29.449   8.111  -0.848
  299    HG   SER  45           HG       SER  45  30.035  10.343   0.157
  300    H    GLY  46           H        GLY  46  26.319   7.656   0.480
  301    HA2  GLY  46           1HA      GLY  46  26.536   5.047  -0.524
  302    HA3  GLY  46           2HA      GLY  46  25.353   5.583   0.660