*HEADER    TRANSCRIPTION                           28-MAR-07   2EM3              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 640-          
*TITLE    2 672) OF HUMAN ZINC FINGER PROTEIN 28 HOMOLOG                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 28 HOMOLOG;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2;                                                   
*COMPND   5 SYNONYM: ZFP-28, KRUEPPEL-LIKE ZINC FINGER FACTOR X6;                
*COMPND   6 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: ZFP28;                                                         
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P061225-08;                               
*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 2EM3    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
 10 GLU  HN     10 GLU  QG      4.82 #SUP  0.95  #QF  0.95
 31 HIS  HA     34 THR  HN      4.35 #SUP  0.78  #QF  0.78
 34 THR  HN     34 THR  HB      3.80 #SUP  0.99  #QF  0.99
 32 GLN  HA     34 THR  HN      4.57 #SUP  0.98  #QF  0.98
 34 THR  HN     34 THR  QG2     3.25 #SUP  0.98  #QF  0.98
 31 HIS  HB2    32 GLN  HN      4.05 #SUP  1.00
 32 GLN  HN     32 GLN  QG      3.37 #SUP  0.99  #QF  0.99
 29 ALA  HA     32 GLN  HN      4.04 #SUP  0.98  #QF  0.98
 28 LEU  QD1    32 GLN  HN      4.43 #SUP  0.95  #QF  0.95
 28 LEU  HA     32 GLN  HN      4.41 #SUP  0.97  #QF  0.97
 31 HIS  HD2    32 GLN  HN      4.38 #SUP  0.98  #QF  0.98
 31 HIS  HB3    32 GLN  HN      4.05 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  HB2     3.72 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  HB3     3.72 #SUP  1.00
 30 GLN  QG     31 HIS  HN      4.65 #SUP  0.98  #QF  0.98
 31 HIS  HN     32 GLN  HN      3.37 #SUP  0.99  #QF  0.99
 31 HIS  HN     31 HIS  HD2     4.83 #SUP  0.98  #QF  0.98
 27 HIS  HA     31 HIS  HN      4.68 #SUP  0.94  #QF  0.94
 28 LEU  HA     31 HIS  HN      3.82 #SUP  0.98  #QF  0.98
 31 HIS  HN     31 HIS  HB3     3.13 #SUP  0.98  #QF  0.98
 31 HIS  HN     31 HIS  HB2     3.13 #SUP  0.99  #QF  0.99
 28 LEU  QD1    31 HIS  HN      5.09 #SUP  1.00
 28 LEU  HG     31 HIS  HN      5.11 #SUP  0.77  #QF  0.77
 11 LYS  HB3    13 TYR  HN      4.80 #SUP  0.97  #QF  0.97
 13 TYR  HN     22 PHE  HN      4.26 #SUP  0.98  #QF  0.98
 13 TYR  HN     14 GLU  HN      4.41 #SUP  1.00
 13 TYR  HN     13 TYR  QD      3.44 #SUP  0.99  #QF  0.99
 11 LYS  HA     13 TYR  HN      4.16 #SUP  0.95  #QF  0.95
 13 TYR  HN     13 TYR  HB2     3.18 #SUP  0.97  #QF  0.97
 11 LYS  HB2    13 TYR  HN      4.80 #SUP  0.86  #QF  0.54
 13 TYR  HN     28 LEU  QD2     5.50 #SUP  0.99  #QF  0.99
 12 PRO  HD2    13 TYR  HN      3.66 #SUP  0.99  #QF  0.99
 13 TYR  HN     13 TYR  HB3     3.91 #SUP  0.99  #QF  0.99
 12 PRO  HB2    13 TYR  HN      4.53 #SUP  0.96  #QF  0.96
 13 TYR  HN     21 ALA  QB      5.50 #SUP  0.96  #QF  0.38
 12 PRO  HG2    13 TYR  HN      4.73 #SUP  0.94  #QF  0.94
 34 THR  HB     35 HIS  HN      4.58 #SUP  0.98  #QF  0.98
 34 THR  HN     35 HIS  HN      3.30 #SUP  0.87  #QF  0.87
 35 HIS  HN     35 HIS  HB3     3.77 #SUP  0.99  #QF  0.99
 35 HIS  HN     35 HIS  HB2     3.77 #SUP  0.94  #QF  0.94
 35 HIS  HN     35 HIS  HD2     4.24 #SUP  0.97  #QF  0.97
 32 GLN  HA     35 HIS  HN      4.13 #SUP  0.89  #QF  0.89
 34 THR  QG2    35 HIS  HN      4.55 #SUP  0.99  #QF  0.99
 33 LYS  HN     34 THR  HN      3.38 #SUP  0.90  #QF  0.90
 30 GLN  HA     33 LYS  HN      4.32 #SUP  0.95  #QF  0.95
 32 GLN  HB3    33 LYS  HN      4.20 #SUP  0.99  #QF  0.99
 33 LYS  HN     34 THR  QG2     4.60 #SUP  0.81  #QF  0.81
 22 PHE  HN     22 PHE  HB3     3.95 #SUP  0.99  #QF  0.99
 22 PHE  HN     28 LEU  QD1     4.83 #SUP  0.85  #QF  0.85
 13 TYR  HB3    22 PHE  HN      4.64 #SUP  0.99  #QF  0.99
 32 GLN  HN     33 LYS  HN      3.41 #SUP  0.99  #QF  0.99
 32 GLN  HB2    33 LYS  HN      4.20 #SUP  0.98  #QF  0.98
 22 PHE  HN     22 PHE  QD      3.21 #SUP  0.96  #QF  0.96
 22 PHE  HN     22 PHE  QE      4.83 #SUP  0.96  #QF  0.96
 21 ALA  HA     22 PHE  HN      2.83 #SUP  0.83  #QF  0.83
 22 PHE  HN     22 PHE  HB2     3.32 #SUP  0.95  #QF  0.95
 21 ALA  QB     22 PHE  HN      3.31 #SUP  0.91  #QF  0.91
 17 VAL  HN     18 CYSS HN      3.14 #SUP  0.97  #QF  0.97
 18 CYSS HN     19 SER  HA      4.60 #SUP  0.78  #QF  0.78
 15 CYSS HB3    18 CYSS HN      3.67 #SUP  0.70  #QF  0.59
 18 CYSS HN     18 CYSS HB3     4.07 #SUP  0.99  #QF  0.99
 17 VAL  HB     18 CYSS HN      3.09 #SUP  0.93  #QF  0.93
 17 VAL  QG2    18 CYSS HN      4.11 #SUP  0.99  #QF  0.99
 17 VAL  QG1    18 CYSS HN      3.78 #SUP  0.99  #QF  0.99
 29 ALA  HN     30 GLN  HN      3.39 #SUP  0.99  #QF  0.99
 27 HIS  HA     30 GLN  HN      4.10 #SUP  0.97  #QF  0.97
 28 LEU  HA     30 GLN  HN      4.77 #SUP  0.94  #QF  0.94
 30 GLN  HN     30 GLN  QG      4.04 #SUP  0.99  #QF  0.99
 30 GLN  HN     30 GLN  HB2     3.54 #SUP  0.90  #QF  0.72
 30 GLN  HN     30 GLN  HB3     3.54 #SUP  0.90  #QF  0.72
 29 ALA  QB     30 GLN  HN      3.27 #SUP  0.94  #QF  0.94
 15 CYSS HN     20 LYS  HN      4.12 #SUP  0.97  #QF  0.97
 15 CYSS HN     22 PHE  QD      4.67 #SUP  0.94  #QF  0.94
 14 GLU  HG2    15 CYSS HN      4.91 #SUP  0.87  #QF  0.55
 15 CYSS HN     22 PHE  QE      4.43 #SUP  0.97  #QF  0.97
 15 CYSS HN     21 ALA  HA      3.77 #SUP  0.89  #QF  0.89
 15 CYSS HN     15 CYSS HB3     3.13 #SUP  0.99  #QF  0.99
 15 CYSS HN     15 CYSS HB2     3.24 #SUP  0.99  #QF  0.99
 14 GLU  QB     15 CYSS HN      3.92 #SUP  0.95  #QF  0.95
 15 CYSS HN     21 ALA  QB      5.06 #SUP  0.57  #QF  0.36
 15 CYSS HN     28 LEU  QD1     3.96 #SUP  0.99  #QF  0.99
 23 THR  HN     24 GLN  HN      4.17 #SUP  0.90  #QF  0.90
 13 TYR  QD     24 GLN  HN      5.11 #SUP  0.88  #QF  0.67
 24 GLN  HN     28 LEU  HN      5.50 #SUP  0.88  #QF  0.67
 24 GLN  HN     27 HIS  HN      4.41 #SUP  0.98  #QF  0.98
 22 PHE  HB3    24 GLN  HN      3.35 #SUP  0.88  #QF  0.88
 22 PHE  HB2    24 GLN  HN      3.83 #SUP  0.96  #QF  0.96
 24 GLN  HN     24 GLN  HG3     4.48 #SUP  0.99  #QF  0.99
 24 GLN  HN     24 GLN  HG2     4.48 #SUP  1.00
 24 GLN  HN     24 GLN  HB2     4.00 #SUP  0.99  #QF  0.99
 24 GLN  HN     24 GLN  HB3     4.00 #SUP  0.96  #QF  0.96
 23 THR  QG2    24 GLN  HN      4.60 #SUP  0.90  #QF  0.90
 27 HIS  HN     29 ALA  HN      4.44 #SUP  1.00
 22 PHE  HB3    27 HIS  HN      5.12 #SUP  0.99  #QF  0.99
 27 HIS  HN     27 HIS  HB3     3.72 #SUP  0.98  #QF  0.98
 27 HIS  HN     27 HIS  HB2     3.72 #SUP  1.00
 25 LYS  HA     27 HIS  HN      4.70 #SUP  0.88  #QF  0.88
 24 GLN  HB2    27 HIS  HN      3.64 #SUP  0.95  #QF  0.95
 26 ALA  QB     27 HIS  HN      3.54 #SUP  0.83  #QF  0.83
 24 GLN  HB3    27 HIS  HN      3.64 #SUP  0.93  #QF  0.93
 17 VAL  HN     19 SER  HN      4.29 #SUP  0.87  #QF  0.87
 19 SER  HN     19 SER  HB2     4.15 #SUP  0.99  #QF  0.99
 15 CYSS HB3    19 SER  HN      3.55 #SUP  0.67  #QF  0.67
 19 SER  HN     19 SER  HA      2.76 #SUP  0.94  #QF  0.94
 19 SER  HN     19 SER  HB3     4.15 #SUP  0.95  #QF  0.95
 17 VAL  HB     19 SER  HN      4.52 #SUP  0.75  #QF  0.75
 20 LYS  HA     21 ALA  HN      2.70 #SUP  0.92  #QF  0.92
 20 LYS  HG3    21 ALA  HN      4.25 #SUP  0.64  #QF  0.52
 21 ALA  HN     21 ALA  QB      2.99 #SUP  0.78  #QF  0.78
 20 LYS  HG2    21 ALA  HN      4.25 #SUP  0.99  #QF  0.99
 13 TYR  QD     14 GLU  HN      4.52 #SUP  0.99  #QF  0.99
 13 TYR  HA     14 GLU  HN      2.93 #SUP  0.89  #QF  0.89
 13 TYR  HB3    14 GLU  HN      4.13 #SUP  0.98  #QF  0.98
 13 TYR  HB2    14 GLU  HN      4.69 #SUP  0.99  #QF  0.99
 14 GLU  HN     14 GLU  QB      3.26 #SUP  0.86  #QF  0.86
 14 GLU  HN     28 LEU  QD2     4.14 #SUP  0.98  #QF  0.97
 14 GLU  HN     28 LEU  QD1     4.62 #SUP  0.98  #QF  0.97
 15 CYSS HB3    20 LYS  HN      3.52 #SUP  0.91  #QF  0.91
 20 LYS  HN     20 LYS  HB2     3.82 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HB3     3.82 #SUP  1.00
 20 LYS  HN     28 LEU  QD1     5.50 #SUP  0.99  #QF  0.98
 28 LEU  QD2    32 GLN  HE22    5.50 #SUP  0.78  #QF  0.28
 28 LEU  QD1    32 GLN  HE22    5.50 #SUP  0.78  #QF  0.28
 28 LEU  QD2    32 GLN  HE21    5.50 #SUP  0.61  #QF  0.22
 28 LEU  QD1    32 GLN  HE21    5.50 #SUP  0.61  #QF  0.22
 10 GLU  HB3    11 LYS  HN      5.02 #SUP  0.96  #QF  0.96
 11 LYS  HN     11 LYS  HG2     4.91 #SUP  0.99  #QF  0.99
 10 GLU  HA     11 LYS  HN      3.22 #SUP  0.90  #QF  0.90
 11 LYS  HN     12 PRO  HD2     5.29 #SUP  0.97  #QF  0.90
 11 LYS  HN     12 PRO  HD3     5.50 #SUP  0.97  #QF  0.90
 10 GLU  HB2    11 LYS  HN      5.02 #SUP  0.98  #QF  0.98
 11 LYS  HN     11 LYS  QD      4.48 #SUP  0.97  #QF  0.95
 11 LYS  HN     11 LYS  HG3     4.91 #SUP  0.96  #QF  0.95
 11 LYS  HN     21 ALA  QB      5.41 #SUP  0.96  #QF  0.95
 28 LEU  HN     29 ALA  HN      3.15 #SUP  1.00
 22 PHE  QD     28 LEU  HN      4.37 #SUP  0.72  #QF  0.72
 22 PHE  HB3    28 LEU  HN      4.24 #SUP  0.99  #QF  0.99
 25 LYS  HA     28 LEU  HN      3.70 #SUP  0.94  #QF  0.94
 22 PHE  HB2    28 LEU  HN      4.20 #SUP  1.00
 28 LEU  HN     28 LEU  HB3     3.01 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HG      4.57 #SUP  1.00
 28 LEU  HN     29 ALA  QB      4.36 #SUP  0.97  #QF  0.97
 28 LEU  HN     28 LEU  HB2     3.21 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  QD2     4.50 #SUP  0.99  #QF  0.92
 28 LEU  HN     28 LEU  QD1     4.86 #SUP  0.99  #QF  0.92
 25 LYS  HA     29 ALA  HN      4.17 #SUP  0.95  #QF  0.95
 28 LEU  HB3    29 ALA  HN      3.27 #SUP  0.99  #QF  0.99
 28 LEU  HG     29 ALA  HN      4.06 #SUP  0.99  #QF  0.99
 29 ALA  HN     29 ALA  QB      2.83 #SUP  0.93  #QF  0.93
 28 LEU  HB2    29 ALA  HN      3.85 #SUP  0.98  #QF  0.98
 28 LEU  QD2    29 ALA  HN      4.33 #SUP  0.97  #QF  0.21
 26 ALA  HA     28 LEU  HN      4.86 #SUP  0.80  #QF  0.80
 15 CYSS HB3    17 VAL  HN      4.71 #SUP  0.95  #QF  0.95
 16 LYS  HN     17 VAL  HN      4.68 #SUP  0.97  #QF  0.97
 15 CYSS HA     17 VAL  HN      4.60 #SUP  0.92  #QF  0.92
 16 LYS  HB2    17 VAL  HN      4.90 #SUP  0.98  #QF  0.87
 16 LYS  HB3    17 VAL  HN      4.90 #SUP  0.98  #QF  0.87
 17 VAL  HN     17 VAL  HB      3.16 #SUP  0.94  #QF  0.94
 17 VAL  HN     17 VAL  QG2     3.14 #SUP  0.98  #QF  0.98
 27 HIS  HN     28 LEU  HN      3.09 #SUP  0.99  #QF  0.99
 17 VAL  HN     17 VAL  QG1     4.23 #SUP  1.00
 13 TYR  HA     13 TYR  QD      3.50 #SUP  0.97  #QF  0.97
 13 TYR  QD     23 THR  HA      4.29 #SUP  0.80  #QF  0.80
 12 PRO  HD2    13 TYR  QD      4.05 #SUP  0.99  #QF  0.99
 13 TYR  QD     28 LEU  HB2     4.79 #SUP  0.54  #QF  0.54
 13 TYR  QD     28 LEU  QD2     3.73 #SUP  0.98  #QF  0.98
 21 ALA  HA     22 PHE  QD      3.95 #SUP  0.96  #QF  0.96
 22 PHE  QD     27 HIS  HB3     3.86 #SUP  0.77  #QF  0.77
 22 PHE  QD     27 HIS  HB2     3.86 #SUP  0.96  #QF  0.96
 15 CYSS HB2    22 PHE  QD      4.74 #SUP  0.96  #QF  0.96
 22 PHE  QD     28 LEU  HB3     4.57 #SUP  1.00
 22 PHE  QD     28 LEU  HG      5.30 #SUP  0.98  #QF  0.98
 22 PHE  QD     28 LEU  HB2     3.88 #SUP  0.98  #QF  0.98
 22 PHE  QD     28 LEU  QD1     3.43 #SUP  0.98  #QF  0.98
 13 TYR  HB3    22 PHE  QD      4.78 #SUP  0.87  #QF  0.87
 15 CYSS HB3    22 PHE  QE      4.53 #SUP  0.93  #QF  0.93
 22 PHE  QE     31 HIS  HB3     4.60 #SUP  0.99  #QF  0.99
 15 CYSS HB2    22 PHE  QE      3.84 #SUP  0.95  #QF  0.86
 20 LYS  HB3    22 PHE  QE      4.63 #SUP  0.99  #QF  0.99
 22 PHE  QE     28 LEU  QD1     3.81 #SUP  0.98  #QF  0.49
 14 GLU  HA     22 PHE  QE      5.13 #SUP  0.99  #QF  0.79
 22 PHE  HA     22 PHE  QE      5.50 #SUP  0.99  #QF  0.79
 22 PHE  HZ     31 HIS  HB3     4.56 #SUP  0.99  #QF  0.99
 20 LYS  QE     22 PHE  HZ      4.40 #SUP  0.99  #QF  0.36
 20 LYS  HB2    22 PHE  HZ      4.58 #SUP  0.97  #QF  0.94
 20 LYS  HD3    22 PHE  HZ      5.20 #SUP  0.97  #QF  0.94
 20 LYS  HB3    22 PHE  HZ      4.58 #SUP  0.99  #QF  0.99
 17 VAL  QG1    18 CYSS HA      4.85 #SUP  1.00
 31 HIS  HD2    32 GLN  QG      4.16 #SUP  0.97  #QF  0.97
 18 CYSS HN     35 HIS  HD2     5.50 #SUP  0.99  #QF  0.85
 31 HIS  HE1    35 HIS  HD2     5.50 #SUP  0.99  #QF  0.85
 31 HIS  HD2    35 HIS  HD2     4.47 #SUP  0.80  #QF  0.80
 32 GLN  HA     35 HIS  HD2     3.53 #SUP  0.98  #QF  0.98
 32 GLN  QG     35 HIS  HD2     4.60 #SUP  0.98  #QF  0.98
 17 VAL  HB     35 HIS  HD2     4.23 #SUP  0.97  #QF  0.97
 17 VAL  QG2    35 HIS  HD2     4.22 #SUP  0.99  #QF  0.99
 17 VAL  QG1    35 HIS  HD2     4.86 #SUP  0.98  #QF  0.98
 14 GLU  HA     21 ALA  HA      3.50 #SUP  0.80  #QF  0.80
 12 PRO  HD2    13 TYR  QE      4.82 #SUP  0.86  #QF  0.86
 13 TYR  QE     25 LYS  HA      4.27 #SUP  0.95  #QF  0.95
 13 TYR  QE     25 LYS  HB3     5.00 #SUP  0.98  #QF  0.98
 13 TYR  QE     28 LEU  QD2     5.21 #SUP  0.92  #QF  0.70
 13 TYR  QE     25 LYS  QD      4.96 #SUP  0.72  #QF  0.35
 13 TYR  QE     25 LYS  HB2     5.00 #SUP  0.98  #QF  0.98
 17 VAL  HB     35 HIS  HE1     4.93 #SUP  0.94  #QF  0.94
 31 HIS  HE1    34 THR  QG2     4.81 #SUP  0.85  #QF  0.85
 27 HIS  HA     27 HIS  HD2     3.69 #SUP  0.84  #QF  0.84
 14 GLU  HA     28 LEU  QD1     4.67 #SUP  0.95  #QF  0.95
 13 TYR  HB3    28 LEU  QD1     4.59 #SUP  0.94  #QF  0.94
 28 LEU  QD1    32 GLN  QG      3.54 #SUP  0.96  #QF  0.96
 28 LEU  QD1    31 HIS  HD2     3.60 #SUP  1.00
 15 CYSS HA     28 LEU  QD1     3.53 #SUP  0.95  #QF  0.95
 28 LEU  HB3    28 LEU  QD1     4.01 #SUP  1.00
 22 PHE  HB3    23 THR  QG2     4.69 #SUP  0.38  #QF  0.38
 14 GLU  HA     21 ALA  QB      3.78 #SUP  0.94  #QF  0.94
 20 LYS  HA     21 ALA  QB      4.30 #SUP  0.88  #QF  0.88
 14 GLU  QB     21 ALA  QB      4.18 #SUP  0.98  #QF  0.98
 11 LYS  QD     21 ALA  QB      4.58 #SUP  0.54  #QF  0.28
 42 GLY  HA2    43 PRO  QD      3.82 #SUP  0.96  #QF  0.96
  8 THR  HA      8 THR  QG2     3.50 #SUP  0.99  #QF  0.32
 17 VAL  QG2    35 HIS  HE1     4.94 #SUP  1.00
 17 VAL  QG2    35 HIS  HB3     4.60 #SUP  1.00
 17 VAL  QG2    35 HIS  HB2     4.60 #SUP  1.00
 16 LYS  QG     17 VAL  QG2     4.94 #SUP  0.92  #QF  0.92
 22 PHE  HB3    27 HIS  HB3     4.06 #SUP  1.00
 22 PHE  HB3    27 HIS  HB2     4.06 #SUP  1.00
 13 TYR  HB3    22 PHE  HB3     5.50 #SUP  1.00
 22 PHE  HB3    25 LYS  HA      5.50 #SUP  1.00
 22 PHE  HB3    28 LEU  HB2     4.65 #SUP  1.00
 13 TYR  QD     22 PHE  HB2     5.06 #SUP  0.99  #QF  0.61
 22 PHE  HB2    27 HIS  HB3     4.65 #SUP  0.99  #QF  0.99
 22 PHE  HB2    28 LEU  HB3     4.72 #SUP  1.00
 22 PHE  HB2    28 LEU  HB2     4.08 #SUP  0.99  #QF  0.99
 13 TYR  HB3    22 PHE  HB2     4.34 #SUP  0.95  #QF  0.95
 22 PHE  HB2    28 LEU  QD2     5.13 #SUP  0.98  #QF  0.73
 22 PHE  HB2    28 LEU  QD1     5.37 #SUP  0.98  #QF  0.73
 17 VAL  QG1    35 HIS  HE1     4.04 #SUP  1.00  #QF  0.99
 16 LYS  HN     17 VAL  QG1     5.50 #SUP  0.46  #QF  0.46
 30 GLN  HA     33 LYS  QE      4.29 #SUP  0.98  #QF  0.98
 17 VAL  HA     17 VAL  QG2     3.22 #SUP  1.00
 17 VAL  HA     17 VAL  QG1     3.23 #SUP  0.99  #QF  0.99
 16 LYS  HB2    17 VAL  HA      5.50 #SUP  0.86  #QF  0.57
 13 TYR  QE     25 LYS  QE      5.33 #SUP  0.83  #QF  0.71
 20 LYS  QE     22 PHE  QE      5.50 #SUP  0.83  #QF  0.71
 23 THR  HA     23 THR  QG2     4.06 #SUP  0.98  #QF  0.98
 12 PRO  HD2    23 THR  HA      4.15 #SUP  0.30  #QF  0.30
 34 THR  HA     34 THR  QG2     3.24 #SUP  1.00
 13 TYR  HB3    28 LEU  HB2     4.01 #SUP  1.00  #QF  0.99
 28 LEU  HB2    28 LEU  QD2     3.99 #SUP  0.99  #QF  0.95
 28 LEU  HB2    28 LEU  QD1     4.13 #SUP  0.99  #QF  0.95
 12 PRO  HA     13 TYR  HN      3.50 #SUP  1.00
 13 TYR  HB3    28 LEU  HB3     4.09 #SUP  1.00  #QF  0.96
 28 LEU  HB3    28 LEU  QD2     3.44 #SUP  1.00  #QF  0.99
 28 LEU  HB3    29 ALA  QB      5.09 #SUP  0.98  #QF  0.31
 13 TYR  HB2    22 PHE  HN      4.56 #SUP  0.93  #QF  0.93
 12 PRO  HD2    13 TYR  HB2     5.34 #SUP  1.00  #QF  0.98
 13 TYR  HB2    22 PHE  HB3     5.50 #SUP  1.00  #QF  0.98
 13 TYR  HB2    28 LEU  HB3     4.71 #SUP  1.00
 13 TYR  HB2    28 LEU  HB2     4.23 #SUP  0.99  #QF  0.99
 13 TYR  HB2    28 LEU  QD2     3.87 #SUP  0.99  #QF  0.99
 14 GLU  QB     19 SER  HA      5.50 #SUP  0.96  #QF  0.96
 25 LYS  HA     28 LEU  HB3     3.61 #SUP  0.91  #QF  0.91
 13 TYR  QD     25 LYS  HA      4.13 #SUP  0.99  #QF  0.49
 25 LYS  HA     28 LEU  QD2     4.30 #SUP  0.96  #QF  0.87
 14 GLU  HG3    15 CYSS HN      4.91 #SUP  0.98  #QF  0.98
 14 GLU  HG3    19 SER  HA      4.77 #SUP  0.82  #QF  0.82
 14 GLU  HG3    21 ALA  QB      4.57 #SUP  0.98  #QF  0.98
 14 GLU  HG2    19 SER  HA      4.77 #SUP  0.83  #QF  0.83
 14 GLU  HG2    21 ALA  QB      4.57 #SUP  0.98  #QF  0.98
 31 HIS  HD2    32 GLN  HA      4.06 #SUP  0.99  #QF  0.99
 32 GLN  HA     32 GLN  QG      3.54 #SUP  1.00
 31 HIS  HA     34 THR  QG2     3.65 #SUP  0.98  #QF  0.98
 33 LYS  HA     33 LYS  HG3     4.13 #SUP  0.89  #QF  0.86
 33 LYS  HA     33 LYS  QD      4.55 #SUP  0.89  #QF  0.86
 33 LYS  HA     33 LYS  HG2     4.13 #SUP  0.96  #QF  0.96
 30 GLN  HA     30 GLN  QG      3.78 #SUP  1.00
 28 LEU  HG     32 GLN  QG      3.98 #SUP  0.97  #QF  0.97
 16 LYS  HA     16 LYS  QD      4.09 #SUP  0.99  #QF  0.99
 16 LYS  HA     16 LYS  QG      3.94 #SUP  0.97  #QF  0.97
 22 PHE  QD     28 LEU  HA      4.14 #SUP  0.99  #QF  0.99
 22 PHE  QE     28 LEU  HA      4.46 #SUP  0.94  #QF  0.94
 28 LEU  HA     31 HIS  HB3     3.96 #SUP  0.99  #QF  0.99
 22 PHE  HB2    28 LEU  HA      4.72 #SUP  1.00
 28 LEU  HA     32 GLN  QG      5.08 #SUP  1.00
 28 LEU  HA     28 LEU  HG      4.18 #SUP  1.00
 28 LEU  HA     28 LEU  QD1     3.27 #SUP  1.00
 20 LYS  HB2    21 ALA  HN      4.81 #SUP  1.00
 20 LYS  HB2    22 PHE  QE      4.63 #SUP  1.00
 20 LYS  HB3    21 ALA  HN      4.81 #SUP  0.99  #QF  0.99
 27 HIS  HA     30 GLN  QG      4.88 #SUP  0.99  #QF  0.99
 11 LYS  HB2    21 ALA  QB      4.20 #SUP  1.00
 11 LYS  HB2    12 PRO  HD2     4.72 #SUP  0.99  #QF  0.99
 11 LYS  HB3    21 ALA  QB      4.20 #SUP  1.00
 18 CYSS HN     18 CYSS HB2     4.07 #SUP  0.98  #QF  0.98
 17 VAL  QG1    18 CYSS HB2     4.83 #SUP  1.00
 17 VAL  QG1    18 CYSS HB3     4.83 #SUP  1.00
 16 LYS  HB2    17 VAL  QG2     4.88 #SUP  0.96  #QF  0.96
 12 PRO  HB3    13 TYR  HN      4.53 #SUP  1.00
 29 ALA  HA     32 GLN  QG      4.19 #SUP  1.00
 28 LEU  HG     29 ALA  HA      4.27 #SUP  0.99  #QF  0.99
 28 LEU  QD2    29 ALA  HA      4.87 #SUP  0.93  #QF  0.76
 28 LEU  QD1    29 ALA  HA      5.49 #SUP  0.93  #QF  0.76
 16 LYS  HB3    17 VAL  HA      5.50 #SUP  0.97  #QF  0.33
 16 LYS  HB3    17 VAL  QG2     4.88 #SUP  0.98  #QF  0.98
 27 HIS  HB3    28 LEU  HN      4.44 #SUP  0.99  #QF  0.99
 27 HIS  HB2    28 LEU  HN      4.44 #SUP  1.00
 22 PHE  HB2    27 HIS  HB2     4.65 #SUP  1.00
 26 ALA  HA     29 ALA  HN      4.16 #SUP  0.50  #QF  0.50
 11 LYS  HA     11 LYS  QD      4.71 #SUP  1.00  #QF  0.99
 15 CYSS HB3    31 HIS  HD2     4.71 #SUP  0.98  #QF  0.98
 14 GLU  HA     15 CYSS HB3     5.11 #SUP  1.00
 15 CYSS HB3    28 LEU  QD1     4.18 #SUP  0.90  #QF  0.90
 15 CYSS HB2    20 LYS  HN      3.94 #SUP  0.99  #QF  0.39
 15 CYSS HB2    31 HIS  HD2     3.46 #SUP  0.97  #QF  0.97
 14 GLU  HA     15 CYSS HB2     4.56 #SUP  0.98  #QF  0.98
 15 CYSS HB2    28 LEU  QD1     3.55 #SUP  1.00
 20 LYS  HD2    22 PHE  HZ      5.20 #SUP  0.98  #QF  0.98
 30 GLN  HA     33 LYS  QD      4.22 #SUP  0.95  #QF  0.95
 33 LYS  HN     33 LYS  QD      4.94 #SUP  0.99  #QF  0.99
 17 VAL  QG1    35 HIS  HB3     4.93 #SUP  0.99  #QF  0.99
 17 VAL  QG1    35 HIS  HB2     4.93 #SUP  0.95  #QF  0.95
 22 PHE  QE     31 HIS  HB2     4.60 #SUP  0.97  #QF  0.97
 22 PHE  HZ     31 HIS  HB2     4.56 #SUP  0.98  #QF  0.98
 28 LEU  HA     31 HIS  HB2     3.96 #SUP  1.00
 30 GLN  HB3    31 HIS  HN      4.27 #SUP  0.98  #QF  0.98
 27 HIS  HA     30 GLN  HB3     4.41 #SUP  0.98  #QF  0.98
 30 GLN  HB2    31 HIS  HN      4.27 #SUP  0.99  #QF  0.99
 27 HIS  HA     30 GLN  HB2     4.41 #SUP  0.95  #QF  0.95
 39 LYS  HA     40 PRO  HD3     3.56 #SUP  0.95  #QF  0.95
 39 LYS  HA     40 PRO  HD2     3.56 #SUP  0.97  #QF  0.97
 12 PRO  HD3    13 TYR  QD      4.96 #SUP  0.94  #QF  0.94
 11 LYS  HA     12 PRO  HD3     3.13 #SUP  0.93  #QF  0.93
 11 LYS  HB3    12 PRO  HD2     4.72 #SUP  0.97  #QF  0.95
 11 LYS  HA     12 PRO  HD2     3.13 #SUP  0.98  #QF  0.98
 12 PRO  HD3    13 TYR  HN      4.69 #SUP  0.99  #QF  0.99
 11 LYS  HA     12 PRO  HG2     4.97 #SUP  1.00
 12 PRO  HG3    13 TYR  HN      4.73 #SUP  1.00
 11 LYS  HA     12 PRO  HG3     4.97 #SUP  0.99  #QF  0.99
 42 GLY  HA1    43 PRO  QD      3.82 #SUP  0.94  #QF  0.73
 13 TYR  HA     28 LEU  QD2     4.25 #SUP  0.99  #QF  0.99
 13 TYR  HB3    28 LEU  QD2     3.37 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HG3     4.89 #SUP  1.00
 20 LYS  HN     20 LYS  HG2     4.89 #SUP  1.00
 10 GLU  HN     10 GLU  QB      3.67 
 10 GLU  QB     11 LYS  HN      4.15 
 11 LYS  HN     11 LYS  QB      3.61 
 11 LYS  HN     11 LYS  QG      4.11 
 11 LYS  HA     11 LYS  QG      3.69 
 11 LYS  QB     12 PRO  HD2     4.11 
 11 LYS  QB     12 PRO  HD3     5.01 
 11 LYS  QB     13 TYR  HN      4.20 
 11 LYS  QB     22 PHE  HN      4.20 
 11 LYS  QG     12 PRO  HD2     4.52 
 11 LYS  QG     13 TYR  HN      5.25 
 12 PRO  QB     13 TYR  HN      3.84 
 12 PRO  QG     13 TYR  QD      4.28 
 12 PRO  QG     13 TYR  QE      4.53 
 13 TYR  QE     25 LYS  QB      4.24 
 13 TYR  QE     25 LYS  QG      4.70 
 14 GLU  QG     19 SER  HN      5.34 
 15 CYSS HN     20 LYS  QB      4.45 
 15 CYSS HB2    20 LYS  QB      4.65 
 15 CYSS HB3    20 LYS  QB      4.54 
 16 LYS  QB     17 VAL  HN      4.16 
 16 LYS  QB     17 VAL  HA      4.84 
 16 LYS  QB     19 SER  HN      5.34 
 17 VAL  QG1    18 CYSS QB      3.98 
 17 VAL  QG1    35 HIS  QB      4.16 
 17 VAL  QG2    35 HIS  QB      4.02 
 18 CYSS HN     18 CYSS QB      3.46 
 18 CYSS QB     35 HIS  HE1     3.39 
 19 SER  HN     19 SER  QB      3.52 
 20 LYS  HN     20 LYS  QB      3.09 
 20 LYS  HN     20 LYS  QG      4.19 
 20 LYS  HN     20 LYS  QD      5.02 
 20 LYS  HA     20 LYS  QG      3.63 
 20 LYS  QB     21 ALA  HN      3.98 
 20 LYS  QB     22 PHE  QE      3.86 
 20 LYS  QB     22 PHE  HZ      3.98 
 20 LYS  QG     21 ALA  HN      3.61 
 20 LYS  QG     22 PHE  HZ      4.61 
 20 LYS  QD     22 PHE  QE      5.24 
 20 LYS  QD     22 PHE  HZ      4.46 
 22 PHE  HB2    27 HIS  QB      3.97 
 22 PHE  HB3    27 HIS  QB      3.46 
 22 PHE  QD     27 HIS  QB      3.32 
 22 PHE  QE     31 HIS  QB      3.96 
 22 PHE  HZ     31 HIS  QB      3.84 
 24 GLN  HN     24 GLN  QB      3.24 
 24 GLN  HN     24 GLN  QG      3.83 
 24 GLN  HN     27 HIS  QB      3.58 
 24 GLN  QB     26 ALA  QB      4.18 
 24 GLN  QB     27 HIS  HN      3.15 
 24 GLN  QB     27 HIS  QB      4.49 
 24 GLN  QG     27 HIS  HN      5.34 
 25 LYS  HN     25 LYS  QG      4.84 
 25 LYS  HA     25 LYS  QG      3.58 
 25 LYS  QB     25 LYS  QE      4.88 
 27 HIS  HN     27 HIS  QB      3.06 
 27 HIS  HA     30 GLN  QB      3.80 
 27 HIS  QB     28 LEU  HN      3.83 
 28 LEU  HA     31 HIS  QB      3.28 
 28 LEU  QD1    31 HIS  QB      4.20 
 28 LEU  QD1    32 GLN  QE2     4.83 
 28 LEU  QD2    32 GLN  QE2     4.66 
 29 ALA  HA     32 GLN  QB      3.76 
 30 GLN  HN     30 GLN  QB      2.95 
 30 GLN  HA     33 LYS  QB      4.58 
 30 GLN  HA     33 LYS  QG      4.02 
 31 HIS  HN     31 HIS  QB      2.70 
 31 HIS  QB     32 GLN  HN      3.34 
 32 GLN  HN     32 GLN  QB      3.07 
 32 GLN  HA     35 HIS  QB      4.68 
 32 GLN  QB     33 LYS  HN      3.64 
 32 GLN  QB     33 LYS  HA      5.07 
 33 LYS  HN     33 LYS  QB      3.01 
 33 LYS  HN     33 LYS  QG      3.19 
 33 LYS  HA     33 LYS  QG      3.46 
 33 LYS  QB     34 THR  HN      4.03 
 33 LYS  QG     33 LYS  QE      3.51 
 35 HIS  HN     35 HIS  QB      3.11 
 35 HIS  QB     35 HIS  HD2     3.39 
 39 LYS  HN     39 LYS  QB      3.70 
 39 LYS  HA     40 PRO  QD      3.11 
 39 LYS  QB     40 PRO  QD      4.60 
 39 LYS  QG     40 PRO  QD      5.17 
     14   GLU  PHI  -143.00     -83.00
     14   GLU  PSI   106.00     166.00
     15   CYS  PHI  -112.00     -52.00
     15   CYS  PSI   105.00     165.00
     21   ALA  PHI  -151.00     -91.00
     21   ALA  PSI   115.00     175.00
     22   PHE  PHI  -160.00    -100.00
     22   PHE  PSI   121.00     181.00
     25   LYS  PHI   -87.00     -27.00
     25   LYS  PSI   -70.00     -10.00
     26   ALA  PHI   -92.00     -32.00
     26   ALA  PSI   -66.00      -6.00
     27   HIS  PHI  -101.00     -41.00
     27   HIS  PSI   -67.00      -7.00
     28   LEU  PHI   -90.00     -30.00
     28   LEU  PSI   -76.00     -16.00
     29   ALA  PHI   -91.00     -31.00
     29   ALA  PSI   -68.00      -8.00
     30   GLN  PHI   -92.00     -32.00
     30   GLN  PSI   -75.00     -15.00
     31   HIS  PHI   -95.00     -35.00
     31   HIS  PSI   -69.00      -9.00
     32   GLN  PHI   -95.00     -35.00
     32   GLN  PSI   -70.00     -10.00
     33   LYS  PHI   -95.00     -35.00
     33   LYS  PSI   -63.00      -3.00
     34   THR  PHI  -104.00     -44.00
     34   THR  PSI   -55.00       5.00


     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   5.455 -19.022   5.461
    2    HA2  GLY   1           1HA      GLY   1   6.374 -17.064   3.954
    3    HA3  GLY   1           2HA      GLY   1   6.002 -18.235   2.698
    4    H    SER   2           H        SER   2   4.874 -15.523   3.557
    5    HA   SER   2           HA       SER   2   2.362 -15.618   4.600
    6    HB2  SER   2           1HB      SER   2   3.352 -13.516   3.927
    7    HB3  SER   2           2HB      SER   2   3.313 -13.994   2.230
    8    HG   SER   2           HG       SER   2   1.501 -12.867   2.373
    9    H    SER   3           H        SER   3   0.242 -15.803   3.732
   10    HA   SER   3           HA       SER   3   0.047 -17.281   1.198
   11    HB2  SER   3           1HB      SER   3  -1.530 -18.848   2.166
   12    HB3  SER   3           2HB      SER   3  -0.051 -18.863   3.127
   13    HG   SER   3           HG       SER   3  -2.596 -18.009   3.796
   14    H    GLY   4           H        GLY   4  -1.559 -16.634  -0.117
   15    HA2  GLY   4           1HA      GLY   4  -3.079 -14.305   0.624
   16    HA3  GLY   4           2HA      GLY   4  -3.111 -15.122  -0.931
   17    H    SER   5           H        SER   5  -3.810 -16.394   2.306
   18    HA   SER   5           HA       SER   5  -6.180 -17.692   1.365
   19    HB2  SER   5           1HB      SER   5  -4.656 -18.538   3.210
   20    HB3  SER   5           2HB      SER   5  -5.364 -17.301   4.249
   21    HG   SER   5           HG       SER   5  -7.285 -18.319   4.181
   22    H    SER   6           H        SER   6  -8.283 -17.131   1.613
   23    HA   SER   6           HA       SER   6  -8.961 -14.777   3.205
   24    HB2  SER   6           1HB      SER   6  -9.738 -15.053   0.292
   25    HB3  SER   6           2HB      SER   6 -10.203 -13.741   1.374
   26    HG   SER   6           HG       SER   6  -8.327 -13.386  -0.066
   27    H    GLY   7           H        GLY   7 -11.310 -14.523   3.497
   28    HA2  GLY   7           1HA      GLY   7 -12.535 -17.125   3.880
   29    HA3  GLY   7           2HA      GLY   7 -13.156 -15.582   4.449
   30    H    THR   8           H        THR   8 -14.730 -17.594   3.249
   31    HA   THR   8           HA       THR   8 -15.265 -17.561   0.604
   32    HB   THR   8           HB       THR   8 -17.396 -17.307   2.736
   33    HG1  THR   8           HG1      THR   8 -17.319 -19.673   2.532
   34   HG21  THR   8          3HG2      THR   8 -18.618 -18.794   1.009
   35   HG22  THR   8          1HG2      THR   8 -17.431 -18.172  -0.137
   36   HG23  THR   8          2HG2      THR   8 -18.513 -17.061   0.703
   37    H    GLY   9           H        GLY   9 -15.018 -15.786  -0.645
   38    HA2  GLY   9           1HA      GLY   9 -16.560 -14.030  -1.565
   39    HA3  GLY   9           2HA      GLY   9 -16.605 -13.400   0.075
   40    H    GLU  10           H        GLU  10 -15.941 -11.518  -1.493
   41    HA   GLU  10           HA       GLU  10 -13.106 -11.110  -1.037
   42    HB2  GLU  10           1HB      GLU  10 -14.313 -11.392  -3.748
   43    HB3  GLU  10           2HB      GLU  10 -13.071 -10.169  -3.522
   44    HG2  GLU  10           1HG      GLU  10 -12.718 -13.065  -2.798
   45    HG3  GLU  10           2HG      GLU  10 -12.244 -12.369  -4.346
   46    H    LYS  11           H        LYS  11 -12.583  -8.995  -0.712
   47    HA   LYS  11           HA       LYS  11 -14.783  -7.153  -0.392
   48    HB2  LYS  11           1HB      LYS  11 -11.821  -6.802   0.108
   49    HB3  LYS  11           2HB      LYS  11 -13.067  -5.644   0.557
   50    HG2  LYS  11           1HG      LYS  11 -12.742  -6.743   2.538
   51    HG3  LYS  11           2HG      LYS  11 -14.079  -7.671   1.853
   52    HD2  LYS  11           1HD      LYS  11 -12.643  -9.428   1.187
   53    HD3  LYS  11           2HD      LYS  11 -11.199  -8.451   1.462
   54    HE2  LYS  11           1HE      LYS  11 -13.081  -9.097   3.704
   55    HE3  LYS  11           2HE      LYS  11 -11.840 -10.244   3.204
   56    HZ1  LYS  11           3HZ      LYS  11 -11.460  -7.513   4.282
   57    HZ2  LYS  11           1HZ      LYS  11 -10.218  -8.364   3.509
   58    HZ3  LYS  11           2HZ      LYS  11 -10.907  -8.975   4.928
   59    HA   PRO  12           HA       PRO  12 -14.372  -5.058  -4.241
   60    HB2  PRO  12           1HB      PRO  12 -15.452  -2.665  -3.550
   61    HB3  PRO  12           2HB      PRO  12 -16.421  -4.125  -3.782
   62    HG2  PRO  12           1HG      PRO  12 -15.435  -2.890  -1.239
   63    HG3  PRO  12           2HG      PRO  12 -17.028  -3.577  -1.605
   64    HD2  PRO  12           1HD      PRO  12 -15.140  -4.934  -0.217
   65    HD3  PRO  12           2HD      PRO  12 -16.308  -5.743  -1.282
   66    H    TYR  13           H        TYR  13 -13.043  -3.706  -1.301
   67    HA   TYR  13           HA       TYR  13 -11.247  -2.005  -2.895
   68    HB2  TYR  13           1HB      TYR  13 -11.718  -1.808   0.079
   69    HB3  TYR  13           2HB      TYR  13 -10.956  -0.621  -0.974
   70    HD1  TYR  13           HD1      TYR  13 -12.375   0.602  -2.655
   71    HD2  TYR  13           HD2      TYR  13 -14.056  -1.816   0.416
   72    HE1  TYR  13           HE1      TYR  13 -14.542   1.723  -2.967
   73    HE2  TYR  13           HE2      TYR  13 -16.228  -0.703   0.111
   74    HH   TYR  13           HH       TYR  13 -17.192   0.805  -2.360
   75    H    GLU  14           H        GLU  14  -9.235  -2.688  -3.146
   76    HA   GLU  14           HA       GLU  14  -7.920  -4.144  -0.979
   77    HB2  GLU  14           1HB      GLU  14  -8.954  -5.724  -2.739
   78    HB3  GLU  14           2HB      GLU  14  -7.680  -5.147  -3.804
   79    HG2  GLU  14           1HG      GLU  14  -5.999  -5.915  -2.197
   80    HG3  GLU  14           2HG      GLU  14  -7.286  -6.519  -1.154
   81    H    CYS  15           H        CYS  15  -5.717  -3.845  -0.868
   82    HA   CYS  15           HA       CYS  15  -4.688  -1.627  -2.444
   83    HB2  CYS  15           1HB      CYS  15  -4.455  -2.067   0.158
   84    HB3  CYS  15           2HB      CYS  15  -3.056  -3.004  -0.356
   85    H    LYS  16           H        LYS  16  -2.402  -1.745  -3.219
   86    HA   LYS  16           HA       LYS  16  -1.919  -4.366  -4.469
   87    HB2  LYS  16           1HB      LYS  16  -1.209  -1.574  -5.371
   88    HB3  LYS  16           2HB      LYS  16  -0.585  -3.025  -6.145
   89    HG2  LYS  16           1HG      LYS  16  -3.511  -2.378  -5.874
   90    HG3  LYS  16           2HG      LYS  16  -2.534  -2.013  -7.298
   91    HD2  LYS  16           1HD      LYS  16  -2.054  -4.382  -7.596
   92    HD3  LYS  16           2HD      LYS  16  -2.977  -4.766  -6.141
   93    HE2  LYS  16           1HE      LYS  16  -5.010  -3.989  -7.167
   94    HE3  LYS  16           2HE      LYS  16  -4.125  -3.411  -8.578
   95    HZ1  LYS  16           3HZ      LYS  16  -4.709  -6.186  -7.775
   96    HZ2  LYS  16           1HZ      LYS  16  -3.399  -5.849  -8.791
   97    HZ3  LYS  16           2HZ      LYS  16  -4.967  -5.433  -9.268
   98    H    VAL  17           H        VAL  17  -0.283  -1.584  -2.994
   99    HA   VAL  17           HA       VAL  17   2.316  -2.648  -3.018
  100    HB   VAL  17           HB       VAL  17   1.099  -0.680  -1.075
  101   HG11  VAL  17          1HG1      VAL  17   3.989  -1.314  -1.661
  102   HG12  VAL  17          2HG1      VAL  17   3.419   0.013  -0.647
  103   HG13  VAL  17          3HG1      VAL  17   3.125  -1.657  -0.163
  104   HG21  VAL  17          3HG2      VAL  17   1.438   0.956  -2.581
  105   HG22  VAL  17          1HG2      VAL  17   2.945   0.247  -3.161
  106   HG23  VAL  17          2HG2      VAL  17   1.399  -0.359  -3.755
  107    H    CYS  18           H        CYS  18   0.007  -2.474  -0.301
  108    HA   CYS  18           HA       CYS  18   1.566  -4.427   1.179
  109    HB2  CYS  18           1HB      CYS  18   0.078  -3.964   3.025
  110    HB3  CYS  18           2HB      CYS  18   0.572  -2.436   2.302
  111    H    SER  19           H        SER  19  -1.383  -4.244  -0.665
  112    HA   SER  19           HA       SER  19  -2.697  -5.904  -1.528
  113    HB2  SER  19           1HB      SER  19  -0.492  -7.226  -1.501
  114    HB3  SER  19           2HB      SER  19  -1.087  -7.949  -0.007
  115    HG   SER  19           HG       SER  19  -2.032  -8.224  -2.626
  116    H    LYS  20           H        LYS  20  -3.358  -4.522   0.831
  117    HA   LYS  20           HA       LYS  20  -4.670  -6.565   2.485
  118    HB2  LYS  20           1HB      LYS  20  -3.172  -4.644   3.432
  119    HB3  LYS  20           2HB      LYS  20  -4.598  -3.647   3.175
  120    HG2  LYS  20           1HG      LYS  20  -5.843  -5.435   4.534
  121    HG3  LYS  20           2HG      LYS  20  -4.236  -5.965   5.035
  122    HD2  LYS  20           1HD      LYS  20  -4.930  -3.072   5.239
  123    HD3  LYS  20           2HD      LYS  20  -5.577  -4.192   6.441
  124    HE2  LYS  20           1HE      LYS  20  -3.318  -4.942   6.970
  125    HE3  LYS  20           2HE      LYS  20  -2.660  -3.859   5.744
  126    HZ1  LYS  20           3HZ      LYS  20  -4.026  -2.122   7.181
  127    HZ2  LYS  20           1HZ      LYS  20  -2.425  -2.534   7.541
  128    HZ3  LYS  20           2HZ      LYS  20  -3.695  -3.249   8.399
  129    H    ALA  21           H        ALA  21  -6.880  -6.502   2.882
  130    HA   ALA  21           HA       ALA  21  -8.424  -4.962   0.915
  131    HB1  ALA  21           3HB      ALA  21  -8.871  -7.571   2.293
  132    HB2  ALA  21           1HB      ALA  21 -10.253  -6.653   1.694
  133    HB3  ALA  21           2HB      ALA  21  -8.986  -7.169   0.579
  134    H    PHE  22           H        PHE  22 -10.064  -3.611   1.507
  135    HA   PHE  22           HA       PHE  22 -10.466  -3.212   4.400
  136    HB2  PHE  22           1HB      PHE  22 -10.545  -1.081   2.255
  137    HB3  PHE  22           2HB      PHE  22 -10.734  -0.830   3.987
  138    HD1  PHE  22           HD1      PHE  22  -8.323  -2.034   1.435
  139    HD2  PHE  22           HD2      PHE  22  -8.883  -0.395   5.323
  140    HE1  PHE  22           HE1      PHE  22  -5.892  -1.716   1.647
  141    HE2  PHE  22           HE2      PHE  22  -6.454  -0.074   5.541
  142    HZ   PHE  22           HZ       PHE  22  -4.955  -0.734   3.702
  143    H    THR  23           H        THR  23 -12.553  -2.478   5.062
  144    HA   THR  23           HA       THR  23 -14.679  -3.701   3.576
  145    HB   THR  23           HB       THR  23 -14.738  -3.823   5.992
  146    HG1  THR  23           HG1      THR  23 -16.880  -2.557   6.211
  147   HG21  THR  23          3HG2      THR  23 -14.290  -2.108   7.353
  148   HG22  THR  23          1HG2      THR  23 -15.469  -1.071   6.552
  149   HG23  THR  23          2HG2      THR  23 -13.830  -1.200   5.913
  150    H    GLN  24           H        GLN  24 -13.535  -0.436   4.121
  151    HA   GLN  24           HA       GLN  24 -15.538   0.519   2.192
  152    HB2  GLN  24           1HB      GLN  24 -14.767   1.726   4.834
  153    HB3  GLN  24           2HB      GLN  24 -15.412   2.725   3.538
  154    HG2  GLN  24           1HG      GLN  24 -17.344   1.019   3.492
  155    HG3  GLN  24           2HG      GLN  24 -16.752   0.548   5.084
  156   HE21  GLN  24          1HE2      GLN  24 -18.723   1.249   5.987
  157   HE22  GLN  24          2HE2      GLN  24 -19.044   2.928   6.238
  158    H    LYS  25           H        LYS  25 -14.901   2.666   1.233
  159    HA   LYS  25           HA       LYS  25 -12.230   2.461   0.221
  160    HB2  LYS  25           1HB      LYS  25 -12.816   4.408  -1.139
  161    HB3  LYS  25           2HB      LYS  25 -14.082   3.189  -1.209
  162    HG2  LYS  25           1HG      LYS  25 -15.450   4.450   0.315
  163    HG3  LYS  25           2HG      LYS  25 -14.156   5.626   0.558
  164    HD2  LYS  25           1HD      LYS  25 -15.356   5.071  -2.145
  165    HD3  LYS  25           2HD      LYS  25 -16.010   6.289  -1.047
  166    HE2  LYS  25           1HE      LYS  25 -14.200   7.670  -1.283
  167    HE3  LYS  25           2HE      LYS  25 -13.095   6.341  -1.630
  168    HZ1  LYS  25           3HZ      LYS  25 -13.875   7.978  -3.499
  169    HZ2  LYS  25           1HZ      LYS  25 -15.204   6.934  -3.574
  170    HZ3  LYS  25           2HZ      LYS  25 -13.642   6.335  -3.827
  171    H    ALA  26           H        ALA  26 -13.944   4.729   2.334
  172    HA   ALA  26           HA       ALA  26 -12.095   6.711   2.667
  173    HB1  ALA  26           3HB      ALA  26 -14.314   6.677   3.730
  174    HB2  ALA  26           1HB      ALA  26 -13.726   5.477   4.883
  175    HB3  ALA  26           2HB      ALA  26 -13.032   7.099   4.866
  176    H    HIS  27           H        HIS  27 -12.114   3.535   4.229
  177    HA   HIS  27           HA       HIS  27  -9.892   4.002   5.916
  178    HB2  HIS  27           1HB      HIS  27 -11.328   1.562   4.941
  179    HB3  HIS  27           2HB      HIS  27  -9.788   1.378   5.776
  180    HD1  HIS  27           HD1      HIS  27 -10.568   0.439   7.964
  181    HD2  HIS  27           HD2      HIS  27 -12.632   3.879   6.881
  182    HE1  HIS  27           HE1      HIS  27 -11.971   1.039   9.963
  183    H    LEU  28           H        LEU  28 -10.148   2.273   2.809
  184    HA   LEU  28           HA       LEU  28  -7.431   1.691   2.516
  185    HB2  LEU  28           1HB      LEU  28  -8.924   0.554   1.113
  186    HB3  LEU  28           2HB      LEU  28  -9.672   2.050   0.556
  187    HG   LEU  28           HG       LEU  28  -7.326   2.502  -0.495
  188   HD11  LEU  28          1HD1      LEU  28  -7.296  -0.506  -0.321
  189   HD12  LEU  28          2HD1      LEU  28  -6.255   0.568   0.611
  190   HD13  LEU  28          3HD1      LEU  28  -6.124   0.521  -1.147
  191   HD21  LEU  28          3HD2      LEU  28  -9.693   1.099  -1.398
  192   HD22  LEU  28          1HD2      LEU  28  -8.254   0.605  -2.290
  193   HD23  LEU  28          2HD2      LEU  28  -8.710   2.308  -2.227
  194    H    ALA  29           H        ALA  29  -9.269   4.300   0.915
  195    HA   ALA  29           HA       ALA  29  -7.247   5.635  -0.332
  196    HB1  ALA  29           3HB      ALA  29  -8.813   7.690   0.697
  197    HB2  ALA  29           1HB      ALA  29  -9.036   6.852  -0.839
  198    HB3  ALA  29           2HB      ALA  29  -9.897   6.301   0.599
  199    H    GLN  30           H        GLN  30  -8.246   6.059   3.053
  200    HA   GLN  30           HA       GLN  30  -6.325   8.041   3.666
  201    HB2  GLN  30           1HB      GLN  30  -8.115   6.253   5.243
  202    HB3  GLN  30           2HB      GLN  30  -6.791   7.048   6.084
  203    HG2  GLN  30           1HG      GLN  30  -7.677   9.137   5.802
  204    HG3  GLN  30           2HG      GLN  30  -8.568   8.683   4.351
  205   HE21  GLN  30          1HE2      GLN  30  -8.557   8.727   7.816
  206   HE22  GLN  30          2HE2      GLN  30 -10.219   8.308   8.034
  207    H    HIS  31           H        HIS  31  -6.332   4.519   4.008
  208    HA   HIS  31           HA       HIS  31  -3.990   4.172   5.441
  209    HB2  HIS  31           1HB      HIS  31  -5.129   2.191   5.148
  210    HB3  HIS  31           2HB      HIS  31  -5.477   2.517   3.453
  211    HD1  HIS  31           HD1      HIS  31  -2.344   1.830   5.516
  212    HD2  HIS  31           HD2      HIS  31  -4.040   0.912   1.836
  213    HE1  HIS  31           HE1      HIS  31  -0.719   0.271   4.397
  214    H    GLN  32           H        GLN  32  -4.377   4.314   1.904
  215    HA   GLN  32           HA       GLN  32  -1.891   3.893   0.980
  216    HB2  GLN  32           1HB      GLN  32  -3.786   6.097   0.166
  217    HB3  GLN  32           2HB      GLN  32  -2.333   5.693  -0.739
  218    HG2  GLN  32           1HG      GLN  32  -3.197   3.409  -1.054
  219    HG3  GLN  32           2HG      GLN  32  -4.675   3.878  -0.215
  220   HE21  GLN  32          1HE2      GLN  32  -5.575   6.045  -1.167
  221   HE22  GLN  32          2HE2      GLN  32  -5.732   6.056  -2.887
  222    H    LYS  33           H        LYS  33  -2.992   6.972   2.372
  223    HA   LYS  33           HA       LYS  33  -0.893   8.620   2.052
  224    HB2  LYS  33           1HB      LYS  33  -2.488   8.133   4.566
  225    HB3  LYS  33           2HB      LYS  33  -1.341   9.456   4.410
  226    HG2  LYS  33           1HG      LYS  33  -2.615  10.396   2.586
  227    HG3  LYS  33           2HG      LYS  33  -3.728   9.027   2.624
  228    HD2  LYS  33           1HD      LYS  33  -4.527   9.650   4.792
  229    HD3  LYS  33           2HD      LYS  33  -3.276  10.886   4.954
  230    HE2  LYS  33           1HE      LYS  33  -5.194  12.088   4.377
  231    HE3  LYS  33           2HE      LYS  33  -4.310  11.936   2.859
  232    HZ1  LYS  33           3HZ      LYS  33  -6.764  11.467   2.764
  233    HZ2  LYS  33           1HZ      LYS  33  -6.459  10.056   3.645
  234    HZ3  LYS  33           2HZ      LYS  33  -5.766  10.264   2.117
  235    H    THR  34           H        THR  34  -1.038   5.997   4.433
  236    HA   THR  34           HA       THR  34   1.400   6.465   5.706
  237    HB   THR  34           HB       THR  34   1.349   4.108   6.383
  238    HG1  THR  34           HG1      THR  34  -0.649   2.962   5.529
  239   HG21  THR  34          3HG2      THR  34  -1.265   4.185   7.031
  240   HG22  THR  34          1HG2      THR  34  -1.014   5.870   6.576
  241   HG23  THR  34          2HG2      THR  34  -0.033   5.145   7.850
  242    H    HIS  35           H        HIS  35   0.688   4.293   2.971
  243    HA   HIS  35           HA       HIS  35   3.142   3.207   2.501
  244    HB2  HIS  35           1HB      HIS  35   0.917   4.038   0.688
  245    HB3  HIS  35           2HB      HIS  35   2.435   3.507  -0.031
  246    HD1  HIS  35           HD1      HIS  35   3.179   1.151   1.697
  247    HD2  HIS  35           HD2      HIS  35  -0.712   1.893   0.445
  248    HE1  HIS  35           HE1      HIS  35   2.002  -1.068   1.810
  249    H    THR  36           H        THR  36   2.033   6.417   1.505
  250    HA   THR  36           HA       THR  36   3.137   8.179   0.539
  251    HB   THR  36           HB       THR  36   5.375   7.344   2.388
  252    HG1  THR  36           HG1      THR  36   4.202   8.068   4.031
  253   HG21  THR  36          3HG2      THR  36   6.196   9.150   1.217
  254   HG22  THR  36          1HG2      THR  36   5.394   9.968   2.557
  255   HG23  THR  36          2HG2      THR  36   4.600   9.863   0.985
  256    H    GLY  37           H        GLY  37   3.373   5.871  -1.030
  257    HA2  GLY  37           1HA      GLY  37   6.044   6.315  -2.200
  258    HA3  GLY  37           2HA      GLY  37   5.412   4.687  -2.004
  259    H    GLU  38           H        GLU  38   6.207   6.154  -4.436
  260    HA   GLU  38           HA       GLU  38   3.622   6.152  -5.850
  261    HB2  GLU  38           1HB      GLU  38   4.886   8.312  -5.849
  262    HB3  GLU  38           2HB      GLU  38   6.184   7.502  -6.715
  263    HG2  GLU  38           1HG      GLU  38   3.407   7.466  -7.808
  264    HG3  GLU  38           2HG      GLU  38   4.428   8.887  -8.020
  265    H    LYS  39           H        LYS  39   3.383   4.143  -6.639
  266    HA   LYS  39           HA       LYS  39   5.577   3.067  -8.284
  267    HB2  LYS  39           1HB      LYS  39   3.728   1.623  -6.393
  268    HB3  LYS  39           2HB      LYS  39   4.601   0.783  -7.667
  269    HG2  LYS  39           1HG      LYS  39   6.720   1.702  -6.693
  270    HG3  LYS  39           2HG      LYS  39   5.758   2.281  -5.331
  271    HD2  LYS  39           1HD      LYS  39   5.060   0.012  -4.825
  272    HD3  LYS  39           2HD      LYS  39   5.934  -0.594  -6.234
  273    HE2  LYS  39           1HE      LYS  39   7.442  -1.021  -4.549
  274    HE3  LYS  39           2HE      LYS  39   7.981   0.565  -5.101
  275    HZ1  LYS  39           3HZ      LYS  39   5.993   0.483  -2.961
  276    HZ2  LYS  39           1HZ      LYS  39   7.265   1.570  -3.214
  277    HZ3  LYS  39           2HZ      LYS  39   7.576   0.039  -2.566
  278    HA   PRO  40           HA       PRO  40   2.747   2.794 -11.628
  279    HB2  PRO  40           1HB      PRO  40   3.625   0.561 -12.897
  280    HB3  PRO  40           2HB      PRO  40   4.513   2.089 -12.917
  281    HG2  PRO  40           1HG      PRO  40   4.954  -0.337 -11.219
  282    HG3  PRO  40           2HG      PRO  40   6.147   0.681 -12.046
  283    HD2  PRO  40           1HD      PRO  40   5.623   0.908  -9.399
  284    HD3  PRO  40           2HD      PRO  40   6.096   2.295 -10.401
  285    H    SER  41           H        SER  41   1.461   0.946 -12.885
  286    HA   SER  41           HA       SER  41  -0.229  -0.285 -10.867
  287    HB2  SER  41           1HB      SER  41  -1.453   0.850 -12.552
  288    HB3  SER  41           2HB      SER  41  -0.503   0.118 -13.845
  289    HG   SER  41           HG       SER  41  -2.215  -1.313 -12.090
  290    H    GLY  42           H        GLY  42   0.214  -2.263 -10.167
  291    HA2  GLY  42           1HA      GLY  42   1.987  -4.042 -11.476
  292    HA3  GLY  42           2HA      GLY  42   0.957  -4.436 -10.108
  293    HA   PRO  43           HA       PRO  43  -0.474  -6.712 -13.946
  294    HB2  PRO  43           1HB      PRO  43  -0.269  -9.203 -12.887
  295    HB3  PRO  43           2HB      PRO  43   1.068  -8.400 -13.717
  296    HG2  PRO  43           1HG      PRO  43   0.544  -8.659 -10.782
  297    HG3  PRO  43           2HG      PRO  43   2.070  -8.838 -11.665
  298    HD2  PRO  43           1HD      PRO  43   1.425  -6.581 -10.317
  299    HD3  PRO  43           2HD      PRO  43   2.409  -6.562 -11.794
  300    H    SER  44           H        SER  44  -2.209  -8.579 -13.863
  301    HA   SER  44           HA       SER  44  -4.380  -9.090 -13.407
  302    HB2  SER  44           1HB      SER  44  -3.320 -10.068 -11.390
  303    HB3  SER  44           2HB      SER  44  -3.551  -8.537 -10.547
  304    HG   SER  44           HG       SER  44  -5.728  -8.836 -10.592
  305    H    SER  45           H        SER  45  -3.980  -6.479 -14.241
  306    HA   SER  45           HA       SER  45  -4.971  -4.417 -12.719
  307    HB2  SER  45           1HB      SER  45  -4.105  -3.908 -14.876
  308    HB3  SER  45           2HB      SER  45  -5.260  -4.978 -15.672
  309    HG   SER  45           HG       SER  45  -6.708  -3.447 -15.616
  310    H    GLY  46           H        GLY  46  -6.837  -6.696 -14.717
  311    HA2  GLY  46           1HA      GLY  46  -9.019  -7.398 -14.539
  312    HA3  GLY  46           2HA      GLY  46  -9.034  -6.713 -12.920
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1   8.146 -24.080   7.939
    2    HA2  GLY   1           1HA      GLY   1   7.497 -21.255   7.621
    3    HA3  GLY   1           2HA      GLY   1   6.991 -22.565   6.565
    4    H    SER   2           H        SER   2   5.237 -20.579   7.391
    5    HA   SER   2           HA       SER   2   3.424 -22.119   9.129
    6    HB2  SER   2           1HB      SER   2   4.229 -20.234  10.420
    7    HB3  SER   2           2HB      SER   2   3.854 -19.122   9.103
    8    HG   SER   2           HG       SER   2   2.270 -19.269  10.863
    9    H    SER   3           H        SER   3   1.298 -22.215   8.526
   10    HA   SER   3           HA       SER   3   0.391 -20.633   6.247
   11    HB2  SER   3           1HB      SER   3   1.385 -22.769   5.358
   12    HB3  SER   3           2HB      SER   3   0.145 -23.648   6.251
   13    HG   SER   3           HG       SER   3  -0.273 -21.735   4.196
   14    H    GLY   4           H        GLY   4  -1.407 -19.711   6.974
   15    HA2  GLY   4           1HA      GLY   4  -3.161 -21.261   8.765
   16    HA3  GLY   4           2HA      GLY   4  -3.102 -19.507   8.680
   17    H    SER   5           H        SER   5  -4.046 -18.447   6.859
   18    HA   SER   5           HA       SER   5  -5.729 -20.066   5.113
   19    HB2  SER   5           1HB      SER   5  -7.760 -18.857   5.650
   20    HB3  SER   5           2HB      SER   5  -7.102 -19.546   7.133
   21    HG   SER   5           HG       SER   5  -6.622 -17.593   7.852
   22    H    SER   6           H        SER   6  -5.259 -19.386   3.140
   23    HA   SER   6           HA       SER   6  -4.711 -16.521   2.725
   24    HB2  SER   6           1HB      SER   6  -3.636 -18.992   1.394
   25    HB3  SER   6           2HB      SER   6  -3.614 -17.444   0.550
   26    HG   SER   6           HG       SER   6  -2.284 -18.193   2.919
   27    H    GLY   7           H        GLY   7  -6.799 -15.826   2.337
   28    HA2  GLY   7           1HA      GLY   7  -8.346 -17.162   0.244
   29    HA3  GLY   7           2HA      GLY   7  -8.929 -15.901   1.320
   30    H    THR   8           H        THR   8  -9.114 -16.127  -1.603
   31    HA   THR   8           HA       THR   8  -7.311 -14.354  -2.856
   32    HB   THR   8           HB       THR   8  -9.070 -14.170  -4.636
   33    HG1  THR   8           HG1      THR   8 -10.542 -15.401  -2.624
   34   HG21  THR   8          3HG2      THR   8  -8.454 -16.167  -5.517
   35   HG22  THR   8          1HG2      THR   8  -8.918 -17.068  -4.074
   36   HG23  THR   8          2HG2      THR   8  -7.381 -16.203  -4.117
   37    H    GLY   9           H        GLY   9 -10.502 -13.860  -1.388
   38    HA2  GLY   9           1HA      GLY   9 -11.207 -11.898  -0.309
   39    HA3  GLY   9           2HA      GLY   9  -9.861 -11.037  -1.042
   40    H    GLU  10           H        GLU  10 -13.066 -11.051  -0.955
   41    HA   GLU  10           HA       GLU  10 -13.338 -10.290  -3.789
   42    HB2  GLU  10           1HB      GLU  10 -14.653 -12.331  -2.869
   43    HB3  GLU  10           2HB      GLU  10 -15.662 -11.127  -2.082
   44    HG2  GLU  10           1HG      GLU  10 -15.133 -10.849  -4.992
   45    HG3  GLU  10           2HG      GLU  10 -16.262 -12.090  -4.450
   46    H    LYS  11           H        LYS  11 -12.378  -8.444  -2.000
   47    HA   LYS  11           HA       LYS  11 -14.651  -6.769  -1.231
   48    HB2  LYS  11           1HB      LYS  11 -11.717  -6.720  -0.571
   49    HB3  LYS  11           2HB      LYS  11 -12.743  -5.328  -0.253
   50    HG2  LYS  11           1HG      LYS  11 -12.587  -6.586   1.755
   51    HG3  LYS  11           2HG      LYS  11 -14.212  -6.821   1.107
   52    HD2  LYS  11           1HD      LYS  11 -13.596  -8.980   0.224
   53    HD3  LYS  11           2HD      LYS  11 -11.915  -8.735   0.704
   54    HE2  LYS  11           1HE      LYS  11 -12.889  -8.459   3.085
   55    HE3  LYS  11           2HE      LYS  11 -14.319  -9.246   2.419
   56    HZ1  LYS  11           3HZ      LYS  11 -11.900 -10.415   3.265
   57    HZ2  LYS  11           1HZ      LYS  11 -12.120 -10.741   1.620
   58    HZ3  LYS  11           2HZ      LYS  11 -13.314 -11.177   2.735
   59    HA   PRO  12           HA       PRO  12 -14.261  -4.114  -4.717
   60    HB2  PRO  12           1HB      PRO  12 -15.277  -1.828  -3.662
   61    HB3  PRO  12           2HB      PRO  12 -16.280  -3.221  -4.082
   62    HG2  PRO  12           1HG      PRO  12 -15.219  -2.387  -1.409
   63    HG3  PRO  12           2HG      PRO  12 -16.834  -2.985  -1.835
   64    HD2  PRO  12           1HD      PRO  12 -14.948  -4.563  -0.701
   65    HD3  PRO  12           2HD      PRO  12 -16.153  -5.187  -1.846
   66    H    TYR  13           H        TYR  13 -12.719  -3.404  -1.699
   67    HA   TYR  13           HA       TYR  13 -10.889  -1.557  -3.088
   68    HB2  TYR  13           1HB      TYR  13 -11.490  -1.484  -0.131
   69    HB3  TYR  13           2HB      TYR  13 -10.619  -0.288  -1.084
   70    HD1  TYR  13           HD1      TYR  13 -11.884   1.103  -2.748
   71    HD2  TYR  13           HD2      TYR  13 -13.845  -1.400   0.079
   72    HE1  TYR  13           HE1      TYR  13 -13.974   2.350  -3.103
   73    HE2  TYR  13           HE2      TYR  13 -15.941  -0.161  -0.269
   74    HH   TYR  13           HH       TYR  13 -16.117   2.543  -2.568
   75    H    GLU  14           H        GLU  14  -8.987  -2.489  -3.400
   76    HA   GLU  14           HA       GLU  14  -7.816  -4.072  -1.223
   77    HB2  GLU  14           1HB      GLU  14  -8.851  -5.386  -3.275
   78    HB3  GLU  14           2HB      GLU  14  -7.332  -4.938  -4.038
   79    HG2  GLU  14           1HG      GLU  14  -6.722  -6.935  -3.168
   80    HG3  GLU  14           2HG      GLU  14  -6.332  -5.904  -1.792
   81    H    CYS  15           H        CYS  15  -5.737  -3.616  -0.805
   82    HA   CYS  15           HA       CYS  15  -4.488  -1.453  -2.232
   83    HB2  CYS  15           1HB      CYS  15  -4.416  -2.094   0.339
   84    HB3  CYS  15           2HB      CYS  15  -3.022  -3.041  -0.171
   85    H    LYS  16           H        LYS  16  -2.166  -1.604  -2.889
   86    HA   LYS  16           HA       LYS  16  -1.710  -4.141  -4.310
   87    HB2  LYS  16           1HB      LYS  16  -0.882  -1.312  -4.951
   88    HB3  LYS  16           2HB      LYS  16  -0.206  -2.709  -5.778
   89    HG2  LYS  16           1HG      LYS  16  -2.160  -3.176  -6.883
   90    HG3  LYS  16           2HG      LYS  16  -3.165  -2.393  -5.662
   91    HD2  LYS  16           1HD      LYS  16  -3.294  -0.834  -7.330
   92    HD3  LYS  16           2HD      LYS  16  -1.866  -0.242  -6.478
   93    HE2  LYS  16           1HE      LYS  16  -0.407  -1.256  -8.069
   94    HE3  LYS  16           2HE      LYS  16  -1.740  -2.130  -8.822
   95    HZ1  LYS  16           3HZ      LYS  16  -1.004   0.697  -9.057
   96    HZ2  LYS  16           1HZ      LYS  16  -2.639   0.283  -9.184
   97    HZ3  LYS  16           2HZ      LYS  16  -1.512  -0.387 -10.252
   98    H    VAL  17           H        VAL  17  -0.068  -1.558  -2.517
   99    HA   VAL  17           HA       VAL  17   2.494  -2.699  -2.490
  100    HB   VAL  17           HB       VAL  17   1.231  -0.915  -0.403
  101   HG11  VAL  17          1HG1      VAL  17   3.176  -1.896   0.539
  102   HG12  VAL  17          2HG1      VAL  17   4.094  -1.668  -0.950
  103   HG13  VAL  17          3HG1      VAL  17   3.628  -0.272   0.023
  104   HG21  VAL  17          3HG2      VAL  17   1.678   0.885  -1.694
  105   HG22  VAL  17          1HG2      VAL  17   3.137   0.165  -2.377
  106   HG23  VAL  17          2HG2      VAL  17   1.552  -0.290  -3.003
  107    H    CYS  18           H        CYS  18   0.220  -2.579   0.259
  108    HA   CYS  18           HA       CYS  18   1.570  -4.807   1.516
  109    HB2  CYS  18           1HB      CYS  18   0.080  -4.416   3.387
  110    HB3  CYS  18           2HB      CYS  18   0.731  -2.877   2.834
  111    H    SER  19           H        SER  19  -1.140  -4.314  -0.527
  112    HA   SER  19           HA       SER  19  -2.665  -5.730  -1.446
  113    HB2  SER  19           1HB      SER  19  -0.558  -7.619  -0.476
  114    HB3  SER  19           2HB      SER  19  -2.091  -8.279  -1.045
  115    HG   SER  19           HG       SER  19  -0.251  -6.667  -2.475
  116    H    LYS  20           H        LYS  20  -3.531  -4.612   0.806
  117    HA   LYS  20           HA       LYS  20  -4.699  -6.779   2.415
  118    HB2  LYS  20           1HB      LYS  20  -3.358  -4.714   3.385
  119    HB3  LYS  20           2HB      LYS  20  -4.911  -3.907   3.211
  120    HG2  LYS  20           1HG      LYS  20  -5.908  -5.792   4.554
  121    HG3  LYS  20           2HG      LYS  20  -4.255  -6.308   4.894
  122    HD2  LYS  20           1HD      LYS  20  -3.810  -4.475   6.207
  123    HD3  LYS  20           2HD      LYS  20  -5.003  -3.465   5.388
  124    HE2  LYS  20           1HE      LYS  20  -5.703  -5.790   7.174
  125    HE3  LYS  20           2HE      LYS  20  -5.606  -4.120   7.729
  126    HZ1  LYS  20           3HZ      LYS  20  -7.325  -3.544   6.107
  127    HZ2  LYS  20           1HZ      LYS  20  -7.873  -4.703   7.211
  128    HZ3  LYS  20           2HZ      LYS  20  -7.442  -5.166   5.642
  129    H    ALA  21           H        ALA  21  -6.954  -6.480   3.118
  130    HA   ALA  21           HA       ALA  21  -8.554  -5.154   1.026
  131    HB1  ALA  21           3HB      ALA  21  -8.502  -7.813   1.506
  132    HB2  ALA  21           1HB      ALA  21  -9.827  -7.318   2.559
  133    HB3  ALA  21           2HB      ALA  21  -9.889  -6.956   0.834
  134    H    PHE  22           H        PHE  22 -10.228  -3.855   1.623
  135    HA   PHE  22           HA       PHE  22 -10.742  -3.560   4.507
  136    HB2  PHE  22           1HB      PHE  22 -10.645  -1.288   2.515
  137    HB3  PHE  22           2HB      PHE  22 -10.873  -1.158   4.255
  138    HD1  PHE  22           HD1      PHE  22  -8.467  -1.760   1.571
  139    HD2  PHE  22           HD2      PHE  22  -9.015  -1.396   5.776
  140    HE1  PHE  22           HE1      PHE  22  -6.033  -1.551   1.866
  141    HE2  PHE  22           HE2      PHE  22  -6.583  -1.186   6.078
  142    HZ   PHE  22           HZ       PHE  22  -5.088  -1.262   4.122
  143    H    THR  23           H        THR  23 -12.842  -2.731   5.063
  144    HA   THR  23           HA       THR  23 -14.903  -3.795   3.359
  145    HB   THR  23           HB       THR  23 -15.110  -4.087   5.761
  146    HG1  THR  23           HG1      THR  23 -17.014  -3.575   4.305
  147   HG21  THR  23          3HG2      THR  23 -15.265  -1.073   5.893
  148   HG22  THR  23          1HG2      THR  23 -13.945  -2.071   6.499
  149   HG23  THR  23          2HG2      THR  23 -15.541  -2.175   7.242
  150    H    GLN  24           H        GLN  24 -13.873  -0.589   4.437
  151    HA   GLN  24           HA       GLN  24 -15.746   0.590   2.492
  152    HB2  GLN  24           1HB      GLN  24 -14.644   1.730   5.062
  153    HB3  GLN  24           2HB      GLN  24 -15.539   2.677   3.881
  154    HG2  GLN  24           1HG      GLN  24 -17.324   0.776   4.199
  155    HG3  GLN  24           2HG      GLN  24 -16.492   0.564   5.738
  156   HE21  GLN  24          1HE2      GLN  24 -17.772   3.172   3.699
  157   HE22  GLN  24          2HE2      GLN  24 -18.457   4.083   4.998
  158    H    LYS  25           H        LYS  25 -14.979   2.726   1.604
  159    HA   LYS  25           HA       LYS  25 -12.373   2.355   0.459
  160    HB2  LYS  25           1HB      LYS  25 -14.294   3.263  -0.824
  161    HB3  LYS  25           2HB      LYS  25 -14.268   4.697   0.194
  162    HG2  LYS  25           1HG      LYS  25 -12.024   5.229  -0.603
  163    HG3  LYS  25           2HG      LYS  25 -12.041   3.785  -1.619
  164    HD2  LYS  25           1HD      LYS  25 -14.007   4.692  -2.812
  165    HD3  LYS  25           2HD      LYS  25 -13.894   6.159  -1.836
  166    HE2  LYS  25           1HE      LYS  25 -11.700   5.118  -3.624
  167    HE3  LYS  25           2HE      LYS  25 -12.858   6.363  -4.088
  168    HZ1  LYS  25           3HZ      LYS  25 -10.463   6.778  -2.855
  169    HZ2  LYS  25           1HZ      LYS  25 -11.582   6.940  -1.596
  170    HZ3  LYS  25           2HZ      LYS  25 -11.722   7.900  -2.981
  171    H    ALA  26           H        ALA  26 -13.857   4.819   2.555
  172    HA   ALA  26           HA       ALA  26 -11.872   6.611   2.906
  173    HB1  ALA  26           3HB      ALA  26 -13.017   7.315   4.706
  174    HB2  ALA  26           1HB      ALA  26 -14.188   6.092   4.212
  175    HB3  ALA  26           2HB      ALA  26 -13.004   5.724   5.467
  176    H    HIS  27           H        HIS  27 -12.016   3.404   4.394
  177    HA   HIS  27           HA       HIS  27  -9.747   3.666   6.036
  178    HB2  HIS  27           1HB      HIS  27 -11.163   1.290   4.847
  179    HB3  HIS  27           2HB      HIS  27  -9.715   1.096   5.831
  180    HD1  HIS  27           HD1      HIS  27 -12.408  -0.068   6.751
  181    HD2  HIS  27           HD2      HIS  27 -10.982   3.673   7.863
  182    HE1  HIS  27           HE1      HIS  27 -13.584   0.488   8.903
  183    H    LEU  28           H        LEU  28 -10.125   2.521   2.708
  184    HA   LEU  28           HA       LEU  28  -7.422   1.746   2.354
  185    HB2  LEU  28           1HB      LEU  28  -9.190   0.904   0.926
  186    HB3  LEU  28           2HB      LEU  28  -9.524   2.532   0.341
  187    HG   LEU  28           HG       LEU  28  -7.017   2.406  -0.455
  188   HD11  LEU  28          1HD1      LEU  28  -6.072   0.370  -0.708
  189   HD12  LEU  28          2HD1      LEU  28  -7.619  -0.444  -0.942
  190   HD13  LEU  28          3HD1      LEU  28  -7.086  -0.015   0.684
  191   HD21  LEU  28          3HD2      LEU  28  -7.811   1.562  -2.619
  192   HD22  LEU  28          1HD2      LEU  28  -8.929   2.731  -1.917
  193   HD23  LEU  28          2HD2      LEU  28  -9.298   1.008  -1.849
  194    H    ALA  29           H        ALA  29  -9.202   4.636   1.262
  195    HA   ALA  29           HA       ALA  29  -7.071   5.991   0.105
  196    HB1  ALA  29           3HB      ALA  29  -8.723   7.934   1.304
  197    HB2  ALA  29           1HB      ALA  29  -8.746   7.365  -0.366
  198    HB3  ALA  29           2HB      ALA  29  -9.764   6.586   0.846
  199    H    GLN  30           H        GLN  30  -8.267   6.176   3.451
  200    HA   GLN  30           HA       GLN  30  -6.314   8.032   4.322
  201    HB2  GLN  30           1HB      GLN  30  -8.442   7.667   5.506
  202    HB3  GLN  30           2HB      GLN  30  -7.919   6.045   5.940
  203    HG2  GLN  30           1HG      GLN  30  -6.005   7.070   7.164
  204    HG3  GLN  30           2HG      GLN  30  -6.723   8.649   6.850
  205   HE21  GLN  30          1HE2      GLN  30  -6.893   5.739   8.688
  206   HE22  GLN  30          2HE2      GLN  30  -8.145   6.239   9.768
  207    H    HIS  31           H        HIS  31  -6.138   4.729   3.593
  208    HA   HIS  31           HA       HIS  31  -3.879   4.225   5.366
  209    HB2  HIS  31           1HB      HIS  31  -5.194   2.320   5.298
  210    HB3  HIS  31           2HB      HIS  31  -5.600   2.533   3.597
  211    HD1  HIS  31           HD1      HIS  31  -2.555   1.622   5.690
  212    HD2  HIS  31           HD2      HIS  31  -4.208   0.900   1.947
  213    HE1  HIS  31           HE1      HIS  31  -1.050  -0.076   4.606
  214    H    GLN  32           H        GLN  32  -4.444   3.615   1.896
  215    HA   GLN  32           HA       GLN  32  -1.958   3.245   0.974
  216    HB2  GLN  32           1HB      GLN  32  -4.149   4.915  -0.246
  217    HB3  GLN  32           2HB      GLN  32  -2.656   4.555  -1.103
  218    HG2  GLN  32           1HG      GLN  32  -3.122   2.171  -0.934
  219    HG3  GLN  32           2HG      GLN  32  -4.608   2.519  -0.053
  220   HE21  GLN  32          1HE2      GLN  32  -3.017   2.576  -3.134
  221   HE22  GLN  32          2HE2      GLN  32  -4.427   2.862  -4.089
  222    H    LYS  33           H        LYS  33  -3.358   6.451   1.598
  223    HA   LYS  33           HA       LYS  33  -1.494   8.181   0.766
  224    HB2  LYS  33           1HB      LYS  33  -2.045   9.642   2.609
  225    HB3  LYS  33           2HB      LYS  33  -3.496   8.786   2.103
  226    HG2  LYS  33           1HG      LYS  33  -3.181   7.210   3.974
  227    HG3  LYS  33           2HG      LYS  33  -1.788   8.157   4.502
  228    HD2  LYS  33           1HD      LYS  33  -4.543   9.326   4.165
  229    HD3  LYS  33           2HD      LYS  33  -3.965   8.644   5.687
  230    HE2  LYS  33           1HE      LYS  33  -2.441  10.332   6.020
  231    HE3  LYS  33           2HE      LYS  33  -2.298  10.688   4.299
  232    HZ1  LYS  33           3HZ      LYS  33  -4.932  11.204   5.078
  233    HZ2  LYS  33           1HZ      LYS  33  -3.761  12.308   4.557
  234    HZ3  LYS  33           2HZ      LYS  33  -3.915  11.953   6.203
  235    H    THR  34           H        THR  34  -1.196   6.237   3.720
  236    HA   THR  34           HA       THR  34   1.239   7.249   4.627
  237    HB   THR  34           HB       THR  34  -0.401   5.549   5.739
  238    HG1  THR  34           HG1      THR  34   1.262   6.170   6.990
  239   HG21  THR  34          3HG2      THR  34   0.367   3.232   5.636
  240   HG22  THR  34          1HG2      THR  34   1.580   3.676   4.436
  241   HG23  THR  34          2HG2      THR  34  -0.135   3.794   4.041
  242    H    HIS  35           H        HIS  35   0.586   4.526   2.440
  243    HA   HIS  35           HA       HIS  35   3.146   3.567   2.085
  244    HB2  HIS  35           1HB      HIS  35   0.783   3.729   0.234
  245    HB3  HIS  35           2HB      HIS  35   2.306   3.032  -0.309
  246    HD1  HIS  35           HD1      HIS  35   3.072   1.439   2.208
  247    HD2  HIS  35           HD2      HIS  35  -0.737   1.494   0.550
  248    HE1  HIS  35           HE1      HIS  35   1.967  -0.680   2.991
  249    H    THR  36           H        THR  36   1.532   5.997   0.030
  250    HA   THR  36           HA       THR  36   3.717   6.627  -1.569
  251    HB   THR  36           HB       THR  36   1.516   8.511  -0.702
  252    HG1  THR  36           HG1      THR  36   0.501   6.842  -1.689
  253   HG21  THR  36          3HG2      THR  36   1.999   9.514  -2.982
  254   HG22  THR  36          1HG2      THR  36   3.489   8.572  -2.976
  255   HG23  THR  36          2HG2      THR  36   3.215   9.797  -1.737
  256    H    GLY  37           H        GLY  37   2.693   8.056   1.515
  257    HA2  GLY  37           1HA      GLY  37   4.395  10.184   1.745
  258    HA3  GLY  37           2HA      GLY  37   3.928   9.174   3.105
  259    H    GLU  38           H        GLU  38   6.485  10.253   1.216
  260    HA   GLU  38           HA       GLU  38   8.275   8.129   1.203
  261    HB2  GLU  38           1HB      GLU  38   8.572  11.101   1.233
  262    HB3  GLU  38           2HB      GLU  38  10.004  10.111   1.477
  263    HG2  GLU  38           1HG      GLU  38   9.996   9.317  -0.655
  264    HG3  GLU  38           2HG      GLU  38   8.246   9.454  -0.818
  265    H    LYS  39           H        LYS  39   9.059   6.956   2.810
  266    HA   LYS  39           HA       LYS  39   9.463   8.244   5.431
  267    HB2  LYS  39           1HB      LYS  39   8.418   5.516   4.731
  268    HB3  LYS  39           2HB      LYS  39   9.174   5.812   6.291
  269    HG2  LYS  39           1HG      LYS  39   6.969   7.591   5.355
  270    HG3  LYS  39           2HG      LYS  39   6.597   6.004   6.032
  271    HD2  LYS  39           1HD      LYS  39   7.411   6.561   8.124
  272    HD3  LYS  39           2HD      LYS  39   8.445   7.845   7.492
  273    HE2  LYS  39           1HE      LYS  39   6.793   9.112   8.425
  274    HE3  LYS  39           2HE      LYS  39   6.118   8.895   6.812
  275    HZ1  LYS  39           3HZ      LYS  39   5.264   7.739   9.355
  276    HZ2  LYS  39           1HZ      LYS  39   5.091   6.780   7.972
  277    HZ3  LYS  39           2HZ      LYS  39   4.336   8.291   8.053
  278    HA   PRO  40           HA       PRO  40  13.586   6.829   3.920
  279    HB2  PRO  40           1HB      PRO  40  14.924   8.972   4.915
  280    HB3  PRO  40           2HB      PRO  40  14.137   8.981   3.332
  281    HG2  PRO  40           1HG      PRO  40  13.162  10.082   5.940
  282    HG3  PRO  40           2HG      PRO  40  13.081  10.802   4.321
  283    HD2  PRO  40           1HD      PRO  40  10.964   9.569   5.474
  284    HD3  PRO  40           2HD      PRO  40  11.239   9.553   3.720
  285    H    SER  41           H        SER  41  13.196   5.160   5.589
  286    HA   SER  41           HA       SER  41  13.871   5.739   8.320
  287    HB2  SER  41           1HB      SER  41  13.658   3.307   8.654
  288    HB3  SER  41           2HB      SER  41  12.276   3.955   7.771
  289    HG   SER  41           HG       SER  41  13.618   3.315   5.837
  290    H    GLY  42           H        GLY  42  15.484   4.191   5.574
  291    HA2  GLY  42           1HA      GLY  42  17.879   4.561   5.319
  292    HA3  GLY  42           2HA      GLY  42  18.021   4.432   7.066
  293    HA   PRO  43           HA       PRO  43  18.442   0.248   4.724
  294    HB2  PRO  43           1HB      PRO  43  21.113   0.191   4.242
  295    HB3  PRO  43           2HB      PRO  43  19.939   0.813   3.076
  296    HG2  PRO  43           1HG      PRO  43  21.682   2.313   4.992
  297    HG3  PRO  43           2HG      PRO  43  21.318   2.673   3.295
  298    HD2  PRO  43           1HD      PRO  43  20.096   3.945   5.348
  299    HD3  PRO  43           2HD      PRO  43  19.282   3.626   3.803
  300    H    SER  44           H        SER  44  19.459  -1.635   5.622
  301    HA   SER  44           HA       SER  44  20.976  -1.263   8.091
  302    HB2  SER  44           1HB      SER  44  18.394  -1.447   8.476
  303    HB3  SER  44           2HB      SER  44  18.650  -3.159   8.140
  304    HG   SER  44           HG       SER  44  20.182  -1.743  10.050
  305    H    SER  45           H        SER  45  22.031  -3.203   8.832
  306    HA   SER  45           HA       SER  45  23.070  -4.757   6.692
  307    HB2  SER  45           1HB      SER  45  23.443  -4.726   9.665
  308    HB3  SER  45           2HB      SER  45  24.061  -6.088   8.731
  309    HG   SER  45           HG       SER  45  24.640  -3.388   8.101
  310    H    GLY  46           H        GLY  46  20.950  -5.536   9.441
  311    HA2  GLY  46           1HA      GLY  46  19.820  -7.729   7.862
  312    HA3  GLY  46           2HA      GLY  46  20.514  -8.125   9.428
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1   5.886 -21.036  -9.718
    2    HA2  GLY   1           1HA      GLY   1   5.179 -21.657  -6.987
    3    HA3  GLY   1           2HA      GLY   1   6.756 -21.866  -7.733
    4    H    SER   2           H        SER   2   8.159 -20.826  -6.469
    5    HA   SER   2           HA       SER   2   7.823 -18.839  -4.686
    6    HB2  SER   2           1HB      SER   2  10.156 -19.152  -6.588
    7    HB3  SER   2           2HB      SER   2  10.179 -18.136  -5.147
    8    HG   SER   2           HG       SER   2  10.366 -19.855  -3.933
    9    H    SER   3           H        SER   3   8.191 -16.531  -4.694
   10    HA   SER   3           HA       SER   3   7.776 -14.410  -5.403
   11    HB2  SER   3           1HB      SER   3   8.444 -15.552  -8.128
   12    HB3  SER   3           2HB      SER   3   8.329 -13.835  -7.740
   13    HG   SER   3           HG       SER   3  10.478 -14.475  -7.634
   14    H    GLY   4           H        GLY   4   5.564 -15.971  -4.975
   15    HA2  GLY   4           1HA      GLY   4   3.768 -15.459  -7.243
   16    HA3  GLY   4           2HA      GLY   4   3.428 -16.520  -5.883
   17    H    SER   5           H        SER   5   2.174 -13.994  -7.195
   18    HA   SER   5           HA       SER   5   1.829 -12.465  -4.701
   19    HB2  SER   5           1HB      SER   5   1.262 -10.548  -6.037
   20    HB3  SER   5           2HB      SER   5   2.747 -11.233  -6.698
   21    HG   SER   5           HG       SER   5   1.573 -12.126  -8.365
   22    H    SER   6           H        SER   6  -0.249 -11.873  -4.035
   23    HA   SER   6           HA       SER   6  -2.262 -13.799  -4.456
   24    HB2  SER   6           1HB      SER   6  -2.265 -11.088  -3.136
   25    HB3  SER   6           2HB      SER   6  -3.720 -12.080  -3.229
   26    HG   SER   6           HG       SER   6  -2.025 -13.739  -2.340
   27    H    GLY   7           H        GLY   7  -4.630 -12.840  -4.893
   28    HA2  GLY   7           1HA      GLY   7  -4.921 -10.847  -6.872
   29    HA3  GLY   7           2HA      GLY   7  -4.802 -12.419  -7.650
   30    H    THR   8           H        THR   8  -6.153 -13.984  -5.773
   31    HA   THR   8           HA       THR   8  -8.833 -13.548  -6.549
   32    HB   THR   8           HB       THR   8  -7.905 -15.299  -4.270
   33    HG1  THR   8           HG1      THR   8  -7.760 -16.925  -5.920
   34   HG21  THR   8          3HG2      THR   8 -10.432 -14.921  -5.727
   35   HG22  THR   8          1HG2      THR   8 -10.141 -15.562  -4.111
   36   HG23  THR   8          2HG2      THR   8  -9.935 -16.601  -5.521
   37    H    GLY   9           H        GLY   9 -10.180 -12.060  -5.789
   38    HA2  GLY   9           1HA      GLY   9 -10.562 -11.712  -2.960
   39    HA3  GLY   9           2HA      GLY   9  -9.807 -10.321  -3.722
   40    H    GLU  10           H        GLU  10 -12.623 -11.230  -2.585
   41    HA   GLU  10           HA       GLU  10 -14.214 -10.169  -4.818
   42    HB2  GLU  10           1HB      GLU  10 -16.148 -11.176  -3.764
   43    HB3  GLU  10           2HB      GLU  10 -14.882 -12.383  -3.943
   44    HG2  GLU  10           1HG      GLU  10 -14.254 -11.865  -1.540
   45    HG3  GLU  10           2HG      GLU  10 -15.782 -10.990  -1.445
   46    H    LYS  11           H        LYS  11 -12.697  -8.353  -3.363
   47    HA   LYS  11           HA       LYS  11 -14.802  -6.860  -1.945
   48    HB2  LYS  11           1HB      LYS  11 -11.866  -6.983  -1.233
   49    HB3  LYS  11           2HB      LYS  11 -13.044  -5.921  -0.473
   50    HG2  LYS  11           1HG      LYS  11 -14.169  -7.717   0.540
   51    HG3  LYS  11           2HG      LYS  11 -13.356  -8.906  -0.481
   52    HD2  LYS  11           1HD      LYS  11 -12.270  -9.075   1.587
   53    HD3  LYS  11           2HD      LYS  11 -11.189  -8.082   0.607
   54    HE2  LYS  11           1HE      LYS  11 -11.345  -7.070   2.760
   55    HE3  LYS  11           2HE      LYS  11 -12.253  -6.064   1.633
   56    HZ1  LYS  11           3HZ      LYS  11 -13.442  -6.396   3.719
   57    HZ2  LYS  11           1HZ      LYS  11 -13.437  -8.071   3.475
   58    HZ3  LYS  11           2HZ      LYS  11 -14.294  -7.065   2.419
   59    HA   PRO  12           HA       PRO  12 -13.965  -3.690  -4.892
   60    HB2  PRO  12           1HB      PRO  12 -15.092  -1.607  -3.566
   61    HB3  PRO  12           2HB      PRO  12 -16.043  -2.866  -4.362
   62    HG2  PRO  12           1HG      PRO  12 -15.333  -2.573  -1.469
   63    HG3  PRO  12           2HG      PRO  12 -16.882  -3.030  -2.199
   64    HD2  PRO  12           1HD      PRO  12 -15.173  -4.849  -1.151
   65    HD3  PRO  12           2HD      PRO  12 -16.223  -5.213  -2.536
   66    H    TYR  13           H        TYR  13 -12.795  -3.630  -1.642
   67    HA   TYR  13           HA       TYR  13 -10.857  -1.534  -2.375
   68    HB2  TYR  13           1HB      TYR  13 -11.790  -2.249   0.411
   69    HB3  TYR  13           2HB      TYR  13 -10.714  -0.928  -0.031
   70    HD1  TYR  13           HD1      TYR  13 -11.680   0.887  -1.594
   71    HD2  TYR  13           HD2      TYR  13 -14.086  -1.882   0.561
   72    HE1  TYR  13           HE1      TYR  13 -13.613   2.388  -1.837
   73    HE2  TYR  13           HE2      TYR  13 -16.027  -0.390   0.323
   74    HH   TYR  13           HH       TYR  13 -16.563   1.876  -0.115
   75    H    GLU  14           H        GLU  14  -9.049  -2.560  -2.970
   76    HA   GLU  14           HA       GLU  14  -7.815  -4.379  -1.046
   77    HB2  GLU  14           1HB      GLU  14  -9.046  -5.730  -2.783
   78    HB3  GLU  14           2HB      GLU  14  -7.956  -5.055  -3.985
   79    HG2  GLU  14           1HG      GLU  14  -6.061  -5.989  -2.599
   80    HG3  GLU  14           2HG      GLU  14  -7.287  -6.873  -1.693
   81    H    CYS  15           H        CYS  15  -5.907  -3.521  -0.593
   82    HA   CYS  15           HA       CYS  15  -4.633  -1.581  -2.221
   83    HB2  CYS  15           1HB      CYS  15  -4.467  -2.102   0.373
   84    HB3  CYS  15           2HB      CYS  15  -3.099  -3.083  -0.145
   85    H    LYS  16           H        LYS  16  -2.334  -1.788  -2.949
   86    HA   LYS  16           HA       LYS  16  -1.958  -4.389  -4.275
   87    HB2  LYS  16           1HB      LYS  16  -2.140  -2.852  -6.000
   88    HB3  LYS  16           2HB      LYS  16  -1.352  -1.574  -5.084
   89    HG2  LYS  16           1HG      LYS  16   0.778  -2.407  -5.520
   90    HG3  LYS  16           2HG      LYS  16   0.164  -3.999  -5.971
   91    HD2  LYS  16           1HD      LYS  16  -1.053  -2.646  -7.863
   92    HD3  LYS  16           2HD      LYS  16   0.218  -1.463  -7.544
   93    HE2  LYS  16           1HE      LYS  16   1.897  -2.884  -8.244
   94    HE3  LYS  16           2HE      LYS  16   0.940  -4.333  -7.939
   95    HZ1  LYS  16           3HZ      LYS  16   0.752  -4.278 -10.172
   96    HZ2  LYS  16           1HZ      LYS  16   1.002  -2.608 -10.281
   97    HZ3  LYS  16           2HZ      LYS  16  -0.515  -3.208  -9.839
   98    H    VAL  17           H        VAL  17  -0.099  -1.694  -2.868
   99    HA   VAL  17           HA       VAL  17   2.395  -2.908  -2.811
  100    HB   VAL  17           HB       VAL  17   1.247  -0.954  -0.812
  101   HG11  VAL  17          1HG1      VAL  17   3.188  -2.009   0.131
  102   HG12  VAL  17          2HG1      VAL  17   4.097  -1.771  -1.363
  103   HG13  VAL  17          3HG1      VAL  17   3.627  -0.381  -0.385
  104   HG21  VAL  17          3HG2      VAL  17   2.609   0.676  -2.203
  105   HG22  VAL  17          1HG2      VAL  17   2.713  -0.602  -3.414
  106   HG23  VAL  17          2HG2      VAL  17   1.140   0.045  -2.948
  107    H    CYS  18           H        CYS  18   0.261  -2.569   0.030
  108    HA   CYS  18           HA       CYS  18   1.623  -4.754   1.351
  109    HB2  CYS  18           1HB      CYS  18   0.246  -4.208   3.271
  110    HB3  CYS  18           2HB      CYS  18   0.913  -2.726   2.593
  111    H    SER  19           H        SER  19  -1.066  -4.376  -0.683
  112    HA   SER  19           HA       SER  19  -2.642  -5.821  -1.460
  113    HB2  SER  19           1HB      SER  19  -0.612  -7.641  -0.265
  114    HB3  SER  19           2HB      SER  19  -2.191  -8.329  -0.641
  115    HG   SER  19           HG       SER  19  -1.821  -7.233  -2.779
  116    H    LYS  20           H        LYS  20  -2.919  -4.473   1.135
  117    HA   LYS  20           HA       LYS  20  -4.428  -6.328   2.779
  118    HB2  LYS  20           1HB      LYS  20  -2.956  -4.517   3.728
  119    HB3  LYS  20           2HB      LYS  20  -4.122  -3.343   3.131
  120    HG2  LYS  20           1HG      LYS  20  -5.857  -4.402   4.528
  121    HG3  LYS  20           2HG      LYS  20  -4.632  -5.497   5.173
  122    HD2  LYS  20           1HD      LYS  20  -3.375  -3.245   5.702
  123    HD3  LYS  20           2HD      LYS  20  -5.006  -2.574   5.630
  124    HE2  LYS  20           1HE      LYS  20  -4.526  -3.155   7.905
  125    HE3  LYS  20           2HE      LYS  20  -5.718  -4.294   7.280
  126    HZ1  LYS  20           3HZ      LYS  20  -4.311  -5.784   8.174
  127    HZ2  LYS  20           1HZ      LYS  20  -2.972  -4.751   8.106
  128    HZ3  LYS  20           2HZ      LYS  20  -3.466  -5.586   6.721
  129    H    ALA  21           H        ALA  21  -6.561  -6.618   2.696
  130    HA   ALA  21           HA       ALA  21  -8.118  -5.011   0.829
  131    HB1  ALA  21           3HB      ALA  21  -8.597  -7.627   2.215
  132    HB2  ALA  21           1HB      ALA  21  -9.899  -6.766   1.393
  133    HB3  ALA  21           2HB      ALA  21  -8.480  -7.293   0.487
  134    H    PHE  22           H        PHE  22 -10.060  -3.973   1.379
  135    HA   PHE  22           HA       PHE  22 -10.571  -3.612   4.249
  136    HB2  PHE  22           1HB      PHE  22 -10.501  -1.360   2.230
  137    HB3  PHE  22           2HB      PHE  22 -10.843  -1.212   3.951
  138    HD1  PHE  22           HD1      PHE  22  -8.204  -2.219   1.546
  139    HD2  PHE  22           HD2      PHE  22  -9.120  -0.857   5.473
  140    HE1  PHE  22           HE1      PHE  22  -5.806  -1.888   1.987
  141    HE2  PHE  22           HE2      PHE  22  -6.724  -0.522   5.920
  142    HZ   PHE  22           HZ       PHE  22  -5.063  -1.037   4.176
  143    H    THR  23           H        THR  23 -12.711  -2.414   4.579
  144    HA   THR  23           HA       THR  23 -14.690  -3.646   2.798
  145    HB   THR  23           HB       THR  23 -16.309  -3.118   4.660
  146    HG1  THR  23           HG1      THR  23 -15.421  -1.655   5.964
  147   HG21  THR  23          3HG2      THR  23 -15.122  -5.331   4.319
  148   HG22  THR  23          1HG2      THR  23 -15.719  -5.020   5.948
  149   HG23  THR  23          2HG2      THR  23 -14.005  -4.823   5.585
  150    H    GLN  24           H        GLN  24 -13.681  -0.562   4.141
  151    HA   GLN  24           HA       GLN  24 -15.611   0.774   2.360
  152    HB2  GLN  24           1HB      GLN  24 -14.627   1.605   5.088
  153    HB3  GLN  24           2HB      GLN  24 -15.469   2.699   3.999
  154    HG2  GLN  24           1HG      GLN  24 -17.477   1.629   4.249
  155    HG3  GLN  24           2HG      GLN  24 -16.728   0.088   4.664
  156   HE21  GLN  24          1HE2      GLN  24 -18.393   2.680   5.850
  157   HE22  GLN  24          2HE2      GLN  24 -18.018   2.513   7.527
  158    H    LYS  25           H        LYS  25 -14.927   2.801   1.445
  159    HA   LYS  25           HA       LYS  25 -12.277   2.718   0.448
  160    HB2  LYS  25           1HB      LYS  25 -14.455   3.771  -0.557
  161    HB3  LYS  25           2HB      LYS  25 -13.952   5.200   0.336
  162    HG2  LYS  25           1HG      LYS  25 -11.919   5.348  -0.888
  163    HG3  LYS  25           2HG      LYS  25 -12.186   3.771  -1.635
  164    HD2  LYS  25           1HD      LYS  25 -14.337   4.811  -2.581
  165    HD3  LYS  25           2HD      LYS  25 -13.617   6.362  -2.141
  166    HE2  LYS  25           1HE      LYS  25 -12.086   4.366  -3.768
  167    HE3  LYS  25           2HE      LYS  25 -13.258   5.439  -4.531
  168    HZ1  LYS  25           3HZ      LYS  25 -11.701   6.992  -4.569
  169    HZ2  LYS  25           1HZ      LYS  25 -10.618   6.003  -3.726
  170    HZ3  LYS  25           2HZ      LYS  25 -11.678   7.011  -2.877
  171    H    ALA  26           H        ALA  26 -13.881   5.106   2.560
  172    HA   ALA  26           HA       ALA  26 -11.923   6.832   3.156
  173    HB1  ALA  26           3HB      ALA  26 -13.647   5.540   5.266
  174    HB2  ALA  26           1HB      ALA  26 -12.869   7.121   5.361
  175    HB3  ALA  26           2HB      ALA  26 -14.161   6.842   4.193
  176    H    HIS  27           H        HIS  27 -12.174   3.567   4.511
  177    HA   HIS  27           HA       HIS  27  -9.945   3.764   6.233
  178    HB2  HIS  27           1HB      HIS  27 -11.533   1.507   5.080
  179    HB3  HIS  27           2HB      HIS  27 -10.007   1.151   5.885
  180    HD1  HIS  27           HD1      HIS  27 -11.410  -0.123   7.711
  181    HD2  HIS  27           HD2      HIS  27 -12.096   3.969   7.496
  182    HE1  HIS  27           HE1      HIS  27 -12.617   0.470   9.837
  183    H    LEU  28           H        LEU  28 -10.265   2.274   3.011
  184    HA   LEU  28           HA       LEU  28  -7.532   1.632   2.738
  185    HB2  LEU  28           1HB      LEU  28  -9.049   0.483   1.357
  186    HB3  LEU  28           2HB      LEU  28  -9.776   1.979   0.775
  187    HG   LEU  28           HG       LEU  28  -7.441   2.399  -0.286
  188   HD11  LEU  28          1HD1      LEU  28  -6.060   0.588  -0.679
  189   HD12  LEU  28          2HD1      LEU  28  -7.322  -0.588  -0.314
  190   HD13  LEU  28          3HD1      LEU  28  -6.564   0.324   0.991
  191   HD21  LEU  28          3HD2      LEU  28  -8.133   1.179  -2.296
  192   HD22  LEU  28          1HD2      LEU  28  -9.483   2.039  -1.555
  193   HD23  LEU  28          2HD2      LEU  28  -9.326   0.295  -1.344
  194    H    ALA  29           H        ALA  29  -9.398   4.215   1.127
  195    HA   ALA  29           HA       ALA  29  -7.393   5.559  -0.137
  196    HB1  ALA  29           3HB      ALA  29  -8.987   7.597   0.914
  197    HB2  ALA  29           1HB      ALA  29  -9.176   6.784  -0.640
  198    HB3  ALA  29           2HB      ALA  29 -10.048   6.195   0.776
  199    H    GLN  30           H        GLN  30  -8.434   6.112   3.226
  200    HA   GLN  30           HA       GLN  30  -6.516   8.076   3.823
  201    HB2  GLN  30           1HB      GLN  30  -8.559   7.602   5.171
  202    HB3  GLN  30           2HB      GLN  30  -7.796   6.125   5.744
  203    HG2  GLN  30           1HG      GLN  30  -7.439   7.654   7.455
  204    HG3  GLN  30           2HG      GLN  30  -5.912   7.630   6.575
  205   HE21  GLN  30          1HE2      GLN  30  -6.875   9.701   8.289
  206   HE22  GLN  30          2HE2      GLN  30  -7.034  11.129   7.329
  207    H    HIS  31           H        HIS  31  -6.396   4.576   3.897
  208    HA   HIS  31           HA       HIS  31  -3.968   4.365   5.364
  209    HB2  HIS  31           1HB      HIS  31  -5.136   2.377   5.403
  210    HB3  HIS  31           2HB      HIS  31  -5.636   2.514   3.720
  211    HD1  HIS  31           HD1      HIS  31  -2.440   1.854   5.676
  212    HD2  HIS  31           HD2      HIS  31  -4.237   0.905   2.053
  213    HE1  HIS  31           HE1      HIS  31  -0.892   0.211   4.568
  214    H    GLN  32           H        GLN  32  -4.647   3.877   1.894
  215    HA   GLN  32           HA       GLN  32  -2.242   3.435   0.830
  216    HB2  GLN  32           1HB      GLN  32  -4.400   5.299  -0.115
  217    HB3  GLN  32           2HB      GLN  32  -2.934   5.067  -1.058
  218    HG2  GLN  32           1HG      GLN  32  -4.565   2.725  -0.168
  219    HG3  GLN  32           2HG      GLN  32  -5.009   3.649  -1.602
  220   HE21  GLN  32          1HE2      GLN  32  -4.596   1.295  -2.334
  221   HE22  GLN  32          2HE2      GLN  32  -3.013   0.987  -2.954
  222    H    LYS  33           H        LYS  33  -3.308   6.554   2.082
  223    HA   LYS  33           HA       LYS  33  -1.384   8.275   1.241
  224    HB2  LYS  33           1HB      LYS  33  -2.736   7.996   3.908
  225    HB3  LYS  33           2HB      LYS  33  -1.548   9.263   3.638
  226    HG2  LYS  33           1HG      LYS  33  -2.889  10.401   2.167
  227    HG3  LYS  33           2HG      LYS  33  -3.793   8.956   1.706
  228    HD2  LYS  33           1HD      LYS  33  -5.361   9.991   3.007
  229    HD3  LYS  33           2HD      LYS  33  -4.530   9.045   4.245
  230    HE2  LYS  33           1HE      LYS  33  -3.721  11.860   3.576
  231    HE3  LYS  33           2HE      LYS  33  -4.990  11.508   4.748
  232    HZ1  LYS  33           3HZ      LYS  33  -3.397  10.207   6.021
  233    HZ2  LYS  33           1HZ      LYS  33  -2.853  11.797   5.827
  234    HZ3  LYS  33           2HZ      LYS  33  -2.181  10.553   4.898
  235    H    THR  34           H        THR  34  -1.079   6.073   4.019
  236    HA   THR  34           HA       THR  34   1.437   6.741   4.898
  237    HB   THR  34           HB       THR  34  -0.076   5.048   5.957
  238    HG1  THR  34           HG1      THR  34   2.522   3.981   5.530
  239   HG21  THR  34          3HG2      THR  34   1.168   2.916   4.303
  240   HG22  THR  34          1HG2      THR  34  -0.179   3.811   3.601
  241   HG23  THR  34          2HG2      THR  34  -0.393   2.945   5.123
  242    H    HIS  35           H        HIS  35   0.549   4.776   2.121
  243    HA   HIS  35           HA       HIS  35   3.186   3.850   1.566
  244    HB2  HIS  35           1HB      HIS  35   0.681   3.990  -0.114
  245    HB3  HIS  35           2HB      HIS  35   2.190   3.293  -0.696
  246    HD1  HIS  35           HD1      HIS  35   3.059   1.614   1.663
  247    HD2  HIS  35           HD2      HIS  35  -0.881   1.831   0.364
  248    HE1  HIS  35           HE1      HIS  35   1.959  -0.487   2.499
  249    H    THR  36           H        THR  36   4.663   5.471   1.387
  250    HA   THR  36           HA       THR  36   4.156   7.851  -0.136
  251    HB   THR  36           HB       THR  36   6.761   6.799   0.984
  252    HG1  THR  36           HG1      THR  36   5.336   8.960   2.076
  253   HG21  THR  36          3HG2      THR  36   7.735   8.456  -0.143
  254   HG22  THR  36          1HG2      THR  36   6.778   9.603   0.793
  255   HG23  THR  36          2HG2      THR  36   6.178   9.010  -0.756
  256    H    GLY  37           H        GLY  37   3.587   6.878  -2.182
  257    HA2  GLY  37           1HA      GLY  37   5.439   5.288  -3.650
  258    HA3  GLY  37           2HA      GLY  37   4.023   6.099  -4.303
  259    H    GLU  38           H        GLU  38   6.129   6.033  -5.912
  260    HA   GLU  38           HA       GLU  38   7.516   8.604  -5.598
  261    HB2  GLU  38           1HB      GLU  38   8.909   6.565  -5.913
  262    HB3  GLU  38           2HB      GLU  38   8.158   6.333  -7.486
  263    HG2  GLU  38           1HG      GLU  38  10.321   7.365  -7.737
  264    HG3  GLU  38           2HG      GLU  38   9.053   8.487  -8.226
  265    H    LYS  39           H        LYS  39   7.585  10.098  -7.302
  266    HA   LYS  39           HA       LYS  39   5.378   9.812  -9.227
  267    HB2  LYS  39           1HB      LYS  39   6.570  12.164  -7.813
  268    HB3  LYS  39           2HB      LYS  39   5.794  12.406  -9.372
  269    HG2  LYS  39           1HG      LYS  39   4.081  12.822  -7.889
  270    HG3  LYS  39           2HG      LYS  39   3.809  11.131  -8.314
  271    HD2  LYS  39           1HD      LYS  39   5.178  10.545  -6.258
  272    HD3  LYS  39           2HD      LYS  39   5.043  12.246  -5.806
  273    HE2  LYS  39           1HE      LYS  39   2.577  10.718  -6.505
  274    HE3  LYS  39           2HE      LYS  39   3.316  10.480  -4.922
  275    HZ1  LYS  39           3HZ      LYS  39   1.557  12.235  -5.036
  276    HZ2  LYS  39           1HZ      LYS  39   2.610  13.154  -5.988
  277    HZ3  LYS  39           2HZ      LYS  39   3.037  12.753  -4.402
  278    HA   PRO  40           HA       PRO  40   9.209   9.551 -11.794
  279    HB2  PRO  40           1HB      PRO  40   8.202   7.691 -13.496
  280    HB3  PRO  40           2HB      PRO  40   8.979   7.271 -11.966
  281    HG2  PRO  40           1HG      PRO  40   6.064   7.482 -12.615
  282    HG3  PRO  40           2HG      PRO  40   6.913   6.248 -11.665
  283    HD2  PRO  40           1HD      PRO  40   5.529   8.273 -10.518
  284    HD3  PRO  40           2HD      PRO  40   6.980   7.567  -9.777
  285    H    SER  41           H        SER  41   5.799   9.672 -12.759
  286    HA   SER  41           HA       SER  41   6.126  11.984 -14.337
  287    HB2  SER  41           1HB      SER  41   5.918  11.126 -16.567
  288    HB3  SER  41           2HB      SER  41   7.269  10.281 -15.810
  289    HG   SER  41           HG       SER  41   4.960   9.281 -16.801
  290    H    GLY  42           H        GLY  42   4.242  12.923 -13.924
  291    HA2  GLY  42           1HA      GLY  42   1.862  11.333 -13.453
  292    HA3  GLY  42           2HA      GLY  42   2.009  13.075 -13.271
  293    HA   PRO  43           HA       PRO  43  -0.048  13.748 -17.076
  294    HB2  PRO  43           1HB      PRO  43   1.313  15.842 -18.142
  295    HB3  PRO  43           2HB      PRO  43   0.246  16.002 -16.742
  296    HG2  PRO  43           1HG      PRO  43   3.228  15.760 -16.834
  297    HG3  PRO  43           2HG      PRO  43   2.223  16.834 -15.843
  298    HD2  PRO  43           1HD      PRO  43   3.313  14.553 -14.873
  299    HD3  PRO  43           2HD      PRO  43   1.753  15.182 -14.306
  300    H    SER  44           H        SER  44   0.213  13.875 -19.460
  301    HA   SER  44           HA       SER  44   2.054  11.869 -20.353
  302    HB2  SER  44           1HB      SER  44   1.028  12.327 -22.601
  303    HB3  SER  44           2HB      SER  44  -0.140  11.915 -21.345
  304    HG   SER  44           HG       SER  44  -1.037  13.775 -21.666
  305    H    SER  45           H        SER  45   3.417  12.204 -22.315
  306    HA   SER  45           HA       SER  45   5.130  14.488 -21.889
  307    HB2  SER  45           1HB      SER  45   5.763  11.998 -22.506
  308    HB3  SER  45           2HB      SER  45   5.540  12.579 -24.156
  309    HG   SER  45           HG       SER  45   7.560  13.161 -23.867
  310    H    GLY  46           H        GLY  46   3.677  16.172 -22.535
  311    HA2  GLY  46           1HA      GLY  46   3.085  17.797 -24.057
  312    HA3  GLY  46           2HA      GLY  46   3.996  16.912 -25.272
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1  -2.304 -22.500 -21.805
    2    HA2  GLY   1           1HA      GLY   1  -3.969 -23.122 -20.353
    3    HA3  GLY   1           2HA      GLY   1  -2.677 -23.485 -19.219
    4    H    SER   2           H        SER   2  -5.396 -21.670 -19.689
    5    HA   SER   2           HA       SER   2  -4.944 -19.150 -18.742
    6    HB2  SER   2           1HB      SER   2  -7.247 -20.957 -17.967
    7    HB3  SER   2           2HB      SER   2  -7.231 -19.200 -17.825
    8    HG   SER   2           HG       SER   2  -7.893 -19.180 -19.809
    9    H    SER   3           H        SER   3  -3.685 -18.565 -17.103
   10    HA   SER   3           HA       SER   3  -2.924 -20.115 -14.935
   11    HB2  SER   3           1HB      SER   3  -2.231 -17.975 -13.872
   12    HB3  SER   3           2HB      SER   3  -1.710 -18.101 -15.551
   13    HG   SER   3           HG       SER   3  -3.376 -16.297 -14.386
   14    H    GLY   4           H        GLY   4  -4.124 -20.956 -13.370
   15    HA2  GLY   4           1HA      GLY   4  -6.763 -20.176 -12.785
   16    HA3  GLY   4           2HA      GLY   4  -5.764 -21.222 -11.787
   17    H    SER   5           H        SER   5  -7.132 -19.994 -10.150
   18    HA   SER   5           HA       SER   5  -6.150 -17.313  -9.576
   19    HB2  SER   5           1HB      SER   5  -7.943 -17.105  -8.061
   20    HB3  SER   5           2HB      SER   5  -8.610 -18.057  -9.387
   21    HG   SER   5           HG       SER   5  -8.663 -19.798  -8.139
   22    H    SER   6           H        SER   6  -5.134 -16.730  -7.636
   23    HA   SER   6           HA       SER   6  -3.767 -18.962  -6.290
   24    HB2  SER   6           1HB      SER   6  -2.907 -16.065  -6.481
   25    HB3  SER   6           2HB      SER   6  -1.983 -17.381  -5.757
   26    HG   SER   6           HG       SER   6  -1.268 -17.816  -7.671
   27    H    GLY   7           H        GLY   7  -4.763 -15.615  -5.529
   28    HA2  GLY   7           1HA      GLY   7  -5.158 -16.395  -2.743
   29    HA3  GLY   7           2HA      GLY   7  -5.180 -14.756  -3.378
   30    H    THR   8           H        THR   8  -7.102 -14.944  -1.772
   31    HA   THR   8           HA       THR   8  -9.497 -15.382  -3.407
   32    HB   THR   8           HB       THR   8  -9.300 -17.367  -1.991
   33    HG1  THR   8           HG1      THR   8 -11.402 -16.629  -2.368
   34   HG21  THR   8          3HG2      THR   8  -8.066 -15.935  -0.164
   35   HG22  THR   8          1HG2      THR   8  -9.021 -17.345   0.295
   36   HG23  THR   8          2HG2      THR   8  -9.699 -15.726   0.469
   37    H    GLY   9           H        GLY   9 -11.379 -14.204  -2.659
   38    HA2  GLY   9           1HA      GLY   9 -12.051 -12.610  -0.761
   39    HA3  GLY   9           2HA      GLY   9 -10.593 -11.749  -1.234
   40    H    GLU  10           H        GLU  10 -13.718 -11.391  -1.377
   41    HA   GLU  10           HA       GLU  10 -13.729 -10.384  -4.147
   42    HB2  GLU  10           1HB      GLU  10 -16.150 -10.678  -4.158
   43    HB3  GLU  10           2HB      GLU  10 -15.344 -12.199  -3.801
   44    HG2  GLU  10           1HG      GLU  10 -15.776 -11.767  -1.380
   45    HG3  GLU  10           2HG      GLU  10 -16.754 -10.383  -1.865
   46    H    LYS  11           H        LYS  11 -12.626  -8.859  -2.106
   47    HA   LYS  11           HA       LYS  11 -14.620  -6.979  -1.171
   48    HB2  LYS  11           1HB      LYS  11 -12.506  -7.714   0.094
   49    HB3  LYS  11           2HB      LYS  11 -11.635  -6.629  -0.982
   50    HG2  LYS  11           1HG      LYS  11 -12.055  -5.425   1.003
   51    HG3  LYS  11           2HG      LYS  11 -13.175  -4.798  -0.209
   52    HD2  LYS  11           1HD      LYS  11 -14.466  -5.056   1.738
   53    HD3  LYS  11           2HD      LYS  11 -14.868  -6.453   0.736
   54    HE2  LYS  11           1HE      LYS  11 -13.056  -7.690   2.040
   55    HE3  LYS  11           2HE      LYS  11 -13.105  -6.336   3.168
   56    HZ1  LYS  11           3HZ      LYS  11 -14.776  -8.548   3.108
   57    HZ2  LYS  11           1HZ      LYS  11 -15.727  -7.229   2.642
   58    HZ3  LYS  11           2HZ      LYS  11 -14.896  -7.194   4.114
   59    HA   PRO  12           HA       PRO  12 -14.374  -4.332  -4.699
   60    HB2  PRO  12           1HB      PRO  12 -15.529  -2.139  -3.591
   61    HB3  PRO  12           2HB      PRO  12 -16.449  -3.570  -4.071
   62    HG2  PRO  12           1HG      PRO  12 -15.475  -2.765  -1.357
   63    HG3  PRO  12           2HG      PRO  12 -17.047  -3.435  -1.828
   64    HD2  PRO  12           1HD      PRO  12 -15.096  -4.944  -0.712
   65    HD3  PRO  12           2HD      PRO  12 -16.248  -5.596  -1.895
   66    H    TYR  13           H        TYR  13 -12.666  -3.925  -1.813
   67    HA   TYR  13           HA       TYR  13 -10.979  -1.877  -3.067
   68    HB2  TYR  13           1HB      TYR  13 -11.721  -1.828  -0.138
   69    HB3  TYR  13           2HB      TYR  13 -10.776  -0.632  -1.018
   70    HD1  TYR  13           HD1      TYR  13 -11.962   0.655  -2.897
   71    HD2  TYR  13           HD2      TYR  13 -14.036  -1.588   0.064
   72    HE1  TYR  13           HE1      TYR  13 -14.012   1.927  -3.378
   73    HE2  TYR  13           HE2      TYR  13 -16.092  -0.324  -0.410
   74    HH   TYR  13           HH       TYR  13 -16.481   1.599  -3.136
   75    H    GLU  14           H        GLU  14  -9.129  -2.920  -3.416
   76    HA   GLU  14           HA       GLU  14  -7.880  -4.312  -1.155
   77    HB2  GLU  14           1HB      GLU  14  -8.906  -5.992  -2.672
   78    HB3  GLU  14           2HB      GLU  14  -7.914  -5.372  -3.985
   79    HG2  GLU  14           1HG      GLU  14  -5.903  -5.939  -2.588
   80    HG3  GLU  14           2HG      GLU  14  -7.000  -6.781  -1.495
   81    H    CYS  15           H        CYS  15  -5.862  -3.662  -0.800
   82    HA   CYS  15           HA       CYS  15  -4.642  -1.734  -2.539
   83    HB2  CYS  15           1HB      CYS  15  -4.481  -1.651  -0.047
   84    HB3  CYS  15           2HB      CYS  15  -3.464  -3.087  -0.104
   85    H    LYS  16           H        LYS  16  -2.387  -1.933  -3.287
   86    HA   LYS  16           HA       LYS  16  -1.848  -4.667  -4.240
   87    HB2  LYS  16           1HB      LYS  16  -2.344  -2.607  -5.829
   88    HB3  LYS  16           2HB      LYS  16  -0.639  -2.274  -5.554
   89    HG2  LYS  16           1HG      LYS  16  -0.664  -3.537  -7.505
   90    HG3  LYS  16           2HG      LYS  16  -0.243  -4.704  -6.249
   91    HD2  LYS  16           1HD      LYS  16  -1.864  -5.781  -7.570
   92    HD3  LYS  16           2HD      LYS  16  -2.732  -5.235  -6.133
   93    HE2  LYS  16           1HE      LYS  16  -4.115  -4.690  -7.963
   94    HE3  LYS  16           2HE      LYS  16  -3.361  -3.175  -7.467
   95    HZ1  LYS  16           3HZ      LYS  16  -2.657  -2.949  -9.540
   96    HZ2  LYS  16           1HZ      LYS  16  -3.241  -4.477  -9.971
   97    HZ3  LYS  16           2HZ      LYS  16  -1.678  -4.315  -9.346
   98    H    VAL  17           H        VAL  17  -0.520  -1.864  -2.653
   99    HA   VAL  17           HA       VAL  17   2.210  -2.607  -2.753
  100    HB   VAL  17           HB       VAL  17   0.773  -0.883  -0.730
  101   HG11  VAL  17          1HG1      VAL  17   3.643  -1.556  -1.148
  102   HG12  VAL  17          2HG1      VAL  17   3.219   0.076  -0.627
  103   HG13  VAL  17          3HG1      VAL  17   2.747  -1.314   0.352
  104   HG21  VAL  17          3HG2      VAL  17   2.494   0.165  -2.931
  105   HG22  VAL  17          1HG2      VAL  17   0.831  -0.305  -3.282
  106   HG23  VAL  17          2HG2      VAL  17   1.160   0.943  -2.079
  107    H    CYS  18           H        CYS  18  -0.142  -2.833  -0.077
  108    HA   CYS  18           HA       CYS  18   1.513  -4.983   1.070
  109    HB2  CYS  18           1HB      CYS  18   0.437  -4.407   3.238
  110    HB3  CYS  18           2HB      CYS  18   1.376  -3.082   2.560
  111    H    SER  19           H        SER  19  -0.762  -5.000  -0.968
  112    HA   SER  19           HA       SER  19  -2.720  -6.123  -1.391
  113    HB2  SER  19           1HB      SER  19  -0.876  -7.868  -1.332
  114    HB3  SER  19           2HB      SER  19  -1.426  -8.273   0.293
  115    HG   SER  19           HG       SER  19  -2.640  -8.733  -2.169
  116    H    LYS  20           H        LYS  20  -2.793  -4.476   1.010
  117    HA   LYS  20           HA       LYS  20  -4.416  -6.004   2.884
  118    HB2  LYS  20           1HB      LYS  20  -2.660  -4.296   3.584
  119    HB3  LYS  20           2HB      LYS  20  -3.777  -3.060   3.018
  120    HG2  LYS  20           1HG      LYS  20  -5.468  -3.935   4.607
  121    HG3  LYS  20           2HG      LYS  20  -4.248  -5.048   5.230
  122    HD2  LYS  20           1HD      LYS  20  -2.815  -3.047   5.723
  123    HD3  LYS  20           2HD      LYS  20  -4.200  -2.034   5.306
  124    HE2  LYS  20           1HE      LYS  20  -5.477  -2.885   7.109
  125    HE3  LYS  20           2HE      LYS  20  -4.335  -4.197   7.393
  126    HZ1  LYS  20           3HZ      LYS  20  -4.329  -2.044   8.864
  127    HZ2  LYS  20           1HZ      LYS  20  -3.357  -1.447   7.615
  128    HZ3  LYS  20           2HZ      LYS  20  -2.886  -2.831   8.465
  129    H    ALA  21           H        ALA  21  -6.522  -6.214   2.557
  130    HA   ALA  21           HA       ALA  21  -7.927  -4.316   0.845
  131    HB1  ALA  21           3HB      ALA  21  -9.811  -5.980   1.079
  132    HB2  ALA  21           1HB      ALA  21  -8.353  -6.573   0.284
  133    HB3  ALA  21           2HB      ALA  21  -8.680  -7.006   1.962
  134    H    PHE  22           H        PHE  22 -10.031  -3.475   1.484
  135    HA   PHE  22           HA       PHE  22 -10.439  -3.266   4.380
  136    HB2  PHE  22           1HB      PHE  22 -10.511  -0.872   2.536
  137    HB3  PHE  22           2HB      PHE  22 -10.703  -0.871   4.286
  138    HD1  PHE  22           HD1      PHE  22  -8.289  -1.487   1.554
  139    HD2  PHE  22           HD2      PHE  22  -8.841  -0.754   5.711
  140    HE1  PHE  22           HE1      PHE  22  -5.866  -1.148   1.813
  141    HE2  PHE  22           HE2      PHE  22  -6.419  -0.413   5.976
  142    HZ   PHE  22           HZ       PHE  22  -4.928  -0.610   4.025
  143    H    THR  23           H        THR  23 -12.580  -2.672   5.002
  144    HA   THR  23           HA       THR  23 -14.580  -3.714   3.218
  145    HB   THR  23           HB       THR  23 -14.718  -4.211   5.605
  146    HG1  THR  23           HG1      THR  23 -16.786  -4.274   5.202
  147   HG21  THR  23          3HG2      THR  23 -14.933  -2.631   7.284
  148   HG22  THR  23          1HG2      THR  23 -15.515  -1.385   6.181
  149   HG23  THR  23          2HG2      THR  23 -13.809  -1.833   6.185
  150    H    GLN  24           H        GLN  24 -13.742  -0.552   4.552
  151    HA   GLN  24           HA       GLN  24 -15.752   0.664   2.776
  152    HB2  GLN  24           1HB      GLN  24 -14.589   1.598   5.395
  153    HB3  GLN  24           2HB      GLN  24 -15.460   2.680   4.316
  154    HG2  GLN  24           1HG      GLN  24 -16.595   0.148   5.479
  155    HG3  GLN  24           2HG      GLN  24 -16.848   1.763   6.140
  156   HE21  GLN  24          1HE2      GLN  24 -18.813  -0.113   5.153
  157   HE22  GLN  24          2HE2      GLN  24 -19.642   0.676   3.859
  158    H    LYS  25           H        LYS  25 -15.170   2.334   1.423
  159    HA   LYS  25           HA       LYS  25 -12.616   2.332   0.330
  160    HB2  LYS  25           1HB      LYS  25 -14.715   3.198  -0.749
  161    HB3  LYS  25           2HB      LYS  25 -14.557   4.645   0.237
  162    HG2  LYS  25           1HG      LYS  25 -12.188   4.788  -0.817
  163    HG3  LYS  25           2HG      LYS  25 -12.869   3.714  -2.040
  164    HD2  LYS  25           1HD      LYS  25 -13.204   5.887  -2.875
  165    HD3  LYS  25           2HD      LYS  25 -14.772   5.397  -2.229
  166    HE2  LYS  25           1HE      LYS  25 -14.421   6.688  -0.240
  167    HE3  LYS  25           2HE      LYS  25 -12.758   7.042  -0.705
  168    HZ1  LYS  25           3HZ      LYS  25 -13.404   8.617  -2.169
  169    HZ2  LYS  25           1HZ      LYS  25 -14.746   8.715  -1.144
  170    HZ3  LYS  25           2HZ      LYS  25 -14.843   7.829  -2.581
  171    H    ALA  26           H        ALA  26 -14.068   4.703   2.553
  172    HA   ALA  26           HA       ALA  26 -12.129   6.559   2.823
  173    HB1  ALA  26           3HB      ALA  26 -13.526   5.310   5.184
  174    HB2  ALA  26           1HB      ALA  26 -12.857   6.939   5.080
  175    HB3  ALA  26           2HB      ALA  26 -14.256   6.496   4.101
  176    H    HIS  27           H        HIS  27 -12.138   3.407   4.471
  177    HA   HIS  27           HA       HIS  27  -9.811   3.683   5.950
  178    HB2  HIS  27           1HB      HIS  27 -11.261   1.345   4.782
  179    HB3  HIS  27           2HB      HIS  27  -9.666   1.086   5.481
  180    HD1  HIS  27           HD1      HIS  27 -12.564   0.118   6.581
  181    HD2  HIS  27           HD2      HIS  27 -10.152   3.148   8.085
  182    HE1  HIS  27           HE1      HIS  27 -13.247   0.390   8.986
  183    H    LEU  28           H        LEU  28 -10.142   2.255   2.699
  184    HA   LEU  28           HA       LEU  28  -7.414   1.823   2.254
  185    HB2  LEU  28           1HB      LEU  28  -9.013   0.753   0.857
  186    HB3  LEU  28           2HB      LEU  28  -9.702   2.297   0.359
  187    HG   LEU  28           HG       LEU  28  -7.274   2.668  -0.616
  188   HD11  LEU  28          1HD1      LEU  28  -6.284   0.630  -1.448
  189   HD12  LEU  28          2HD1      LEU  28  -7.553  -0.332  -0.692
  190   HD13  LEU  28          3HD1      LEU  28  -6.405   0.555   0.310
  191   HD21  LEU  28          3HD2      LEU  28  -9.425   0.973  -1.877
  192   HD22  LEU  28          1HD2      LEU  28  -8.083   1.707  -2.754
  193   HD23  LEU  28          2HD2      LEU  28  -9.274   2.729  -1.950
  194    H    ALA  29           H        ALA  29  -9.463   4.509   1.108
  195    HA   ALA  29           HA       ALA  29  -7.576   6.032  -0.172
  196    HB1  ALA  29           3HB      ALA  29  -9.043   7.999   0.875
  197    HB2  ALA  29           1HB      ALA  29  -9.627   6.963  -0.427
  198    HB3  ALA  29           2HB      ALA  29 -10.105   6.639   1.240
  199    H    GLN  30           H        GLN  30  -8.334   6.030   3.297
  200    HA   GLN  30           HA       GLN  30  -6.408   8.028   3.949
  201    HB2  GLN  30           1HB      GLN  30  -8.312   7.677   5.398
  202    HB3  GLN  30           2HB      GLN  30  -7.850   6.001   5.665
  203    HG2  GLN  30           1HG      GLN  30  -6.035   6.589   7.005
  204    HG3  GLN  30           2HG      GLN  30  -6.035   8.255   6.430
  205   HE21  GLN  30          1HE2      GLN  30  -6.126   9.090   8.506
  206   HE22  GLN  30          2HE2      GLN  30  -7.557   9.014   9.471
  207    H    HIS  31           H        HIS  31  -6.410   4.507   3.914
  208    HA   HIS  31           HA       HIS  31  -4.006   4.059   5.270
  209    HB2  HIS  31           1HB      HIS  31  -5.179   2.104   4.950
  210    HB3  HIS  31           2HB      HIS  31  -5.632   2.520   3.300
  211    HD1  HIS  31           HD1      HIS  31  -2.587   1.364   5.245
  212    HD2  HIS  31           HD2      HIS  31  -4.114   1.327   1.381
  213    HE1  HIS  31           HE1      HIS  31  -1.004  -0.062   3.910
  214    H    GLN  32           H        GLN  32  -4.602   4.391   1.775
  215    HA   GLN  32           HA       GLN  32  -2.207   3.985   0.656
  216    HB2  GLN  32           1HB      GLN  32  -4.029   6.337   0.137
  217    HB3  GLN  32           2HB      GLN  32  -2.692   5.884  -0.911
  218    HG2  GLN  32           1HG      GLN  32  -3.726   3.770  -1.402
  219    HG3  GLN  32           2HG      GLN  32  -5.014   4.092  -0.242
  220   HE21  GLN  32          1HE2      GLN  32  -6.812   4.372  -1.355
  221   HE22  GLN  32          2HE2      GLN  32  -7.000   5.388  -2.739
  222    H    LYS  33           H        LYS  33  -3.083   6.931   2.425
  223    HA   LYS  33           HA       LYS  33  -0.995   8.580   2.074
  224    HB2  LYS  33           1HB      LYS  33  -2.430   7.834   4.608
  225    HB3  LYS  33           2HB      LYS  33  -1.154   9.045   4.618
  226    HG2  LYS  33           1HG      LYS  33  -2.468  10.227   2.796
  227    HG3  LYS  33           2HG      LYS  33  -3.796   9.136   3.198
  228    HD2  LYS  33           1HD      LYS  33  -2.468  10.609   5.415
  229    HD3  LYS  33           2HD      LYS  33  -3.544  11.510   4.345
  230    HE2  LYS  33           1HE      LYS  33  -5.205   9.580   4.773
  231    HE3  LYS  33           2HE      LYS  33  -4.170   9.198   6.148
  232    HZ1  LYS  33           3HZ      LYS  33  -6.104  10.697   6.623
  233    HZ2  LYS  33           1HZ      LYS  33  -5.327  11.890   5.710
  234    HZ3  LYS  33           2HZ      LYS  33  -4.598  11.291   7.113
  235    H    THR  34           H        THR  34  -0.948   5.827   4.331
  236    HA   THR  34           HA       THR  34   1.556   6.047   5.391
  237    HB   THR  34           HB       THR  34   1.603   3.616   5.640
  238    HG1  THR  34           HG1      THR  34   0.109   2.331   4.566
  239   HG21  THR  34          3HG2      THR  34  -1.267   3.977   6.029
  240   HG22  THR  34          1HG2      THR  34  -0.307   5.318   6.653
  241   HG23  THR  34          2HG2      THR  34   0.005   3.674   7.212
  242    H    HIS  35           H        HIS  35   0.726   4.521   2.288
  243    HA   HIS  35           HA       HIS  35   3.418   3.880   1.621
  244    HB2  HIS  35           1HB      HIS  35   0.958   4.114  -0.123
  245    HB3  HIS  35           2HB      HIS  35   2.501   3.447  -0.649
  246    HD1  HIS  35           HD1      HIS  35   3.128   1.689   1.817
  247    HD2  HIS  35           HD2      HIS  35  -0.564   1.851  -0.082
  248    HE1  HIS  35           HE1      HIS  35   1.986  -0.479   2.382
  249    H    THR  36           H        THR  36   4.557   4.760  -0.285
  250    HA   THR  36           HA       THR  36   3.994   7.606  -0.758
  251    HB   THR  36           HB       THR  36   5.762   7.519   0.925
  252    HG1  THR  36           HG1      THR  36   7.164   8.863  -0.173
  253   HG21  THR  36          3HG2      THR  36   7.735   6.319  -0.917
  254   HG22  THR  36          1HG2      THR  36   6.563   5.209  -0.208
  255   HG23  THR  36          2HG2      THR  36   7.594   6.187   0.836
  256    H    GLY  37           H        GLY  37   4.636   8.412  -2.769
  257    HA2  GLY  37           1HA      GLY  37   4.297   7.020  -5.019
  258    HA3  GLY  37           2HA      GLY  37   5.469   8.327  -4.942
  259    H    GLU  38           H        GLU  38   5.089   5.219  -5.857
  260    HA   GLU  38           HA       GLU  38   7.570   4.105  -4.942
  261    HB2  GLU  38           1HB      GLU  38   5.342   2.938  -5.775
  262    HB3  GLU  38           2HB      GLU  38   6.148   3.027  -7.335
  263    HG2  GLU  38           1HG      GLU  38   8.142   1.947  -6.083
  264    HG3  GLU  38           2HG      GLU  38   6.922   1.496  -4.893
  265    H    LYS  39           H        LYS  39   9.445   3.737  -6.131
  266    HA   LYS  39           HA       LYS  39   9.685   5.237  -8.653
  267    HB2  LYS  39           1HB      LYS  39  11.642   5.160  -6.352
  268    HB3  LYS  39           2HB      LYS  39  12.025   5.807  -7.942
  269    HG2  LYS  39           1HG      LYS  39   9.864   6.835  -6.113
  270    HG3  LYS  39           2HG      LYS  39  11.456   7.564  -6.340
  271    HD2  LYS  39           1HD      LYS  39  10.913   7.811  -8.765
  272    HD3  LYS  39           2HD      LYS  39   9.277   7.256  -8.404
  273    HE2  LYS  39           1HE      LYS  39   8.983   9.527  -8.299
  274    HE3  LYS  39           2HE      LYS  39   9.364   9.174  -6.615
  275    HZ1  LYS  39           3HZ      LYS  39  11.275  10.303  -6.734
  276    HZ2  LYS  39           1HZ      LYS  39  10.616  11.020  -8.118
  277    HZ3  LYS  39           2HZ      LYS  39  11.669   9.705  -8.266
  278    HA   PRO  40           HA       PRO  40  11.418   1.583 -10.369
  279    HB2  PRO  40           1HB      PRO  40  13.032   2.651 -12.273
  280    HB3  PRO  40           2HB      PRO  40  11.270   2.629 -12.409
  281    HG2  PRO  40           1HG      PRO  40  13.075   4.856 -11.545
  282    HG3  PRO  40           2HG      PRO  40  11.664   4.911 -12.618
  283    HD2  PRO  40           1HD      PRO  40  11.548   5.664 -10.020
  284    HD3  PRO  40           2HD      PRO  40  10.171   4.925 -10.862
  285    H    SER  41           H        SER  41  13.145   3.654  -8.454
  286    HA   SER  41           HA       SER  41  15.682   2.217  -8.817
  287    HB2  SER  41           1HB      SER  41  15.149   4.749  -7.244
  288    HB3  SER  41           2HB      SER  41  16.727   4.033  -7.572
  289    HG   SER  41           HG       SER  41  16.302   4.390  -9.814
  290    H    GLY  42           H        GLY  42  16.913   1.802  -6.748
  291    HA2  GLY  42           1HA      GLY  42  16.202   1.666  -4.215
  292    HA3  GLY  42           2HA      GLY  42  15.094   0.475  -4.880
  293    HA   PRO  43           HA       PRO  43  19.549  -1.173  -4.097
  294    HB2  PRO  43           1HB      PRO  43  19.340  -2.029  -1.529
  295    HB3  PRO  43           2HB      PRO  43  19.930  -0.419  -1.960
  296    HG2  PRO  43           1HG      PRO  43  17.207  -1.255  -1.040
  297    HG3  PRO  43           2HG      PRO  43  18.165   0.157  -0.559
  298    HD2  PRO  43           1HD      PRO  43  16.147   0.309  -2.358
  299    HD3  PRO  43           2HD      PRO  43  17.582   1.350  -2.443
  300    H    SER  44           H        SER  44  18.977  -2.839  -5.480
  301    HA   SER  44           HA       SER  44  17.666  -5.142  -4.196
  302    HB2  SER  44           1HB      SER  44  17.328  -4.261  -7.074
  303    HB3  SER  44           2HB      SER  44  16.631  -5.714  -6.357
  304    HG   SER  44           HG       SER  44  15.793  -3.118  -6.209
  305    H    SER  45           H        SER  45  19.229  -6.585  -3.881
  306    HA   SER  45           HA       SER  45  20.806  -7.464  -6.164
  307    HB2  SER  45           1HB      SER  45  22.050  -6.481  -3.587
  308    HB3  SER  45           2HB      SER  45  22.916  -7.411  -4.810
  309    HG   SER  45           HG       SER  45  22.915  -5.723  -6.124
  310    H    GLY  46           H        GLY  46  22.062  -9.475  -5.626
  311    HA2  GLY  46           1HA      GLY  46  22.030 -11.105  -3.536
  312    HA3  GLY  46           2HA      GLY  46  20.346 -11.212  -4.026
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1   3.984 -19.287 -10.860
    2    HA2  GLY   1           1HA      GLY   1   3.620 -20.838 -13.344
    3    HA3  GLY   1           2HA      GLY   1   2.917 -21.261 -11.790
    4    H    SER   2           H        SER   2   2.259 -19.978 -14.754
    5    HA   SER   2           HA       SER   2   0.462 -17.885 -14.129
    6    HB2  SER   2           1HB      SER   2  -0.390 -18.239 -16.445
    7    HB3  SER   2           2HB      SER   2   1.366 -18.101 -16.372
    8    HG   SER   2           HG       SER   2   0.011 -20.033 -17.458
    9    H    SER   3           H        SER   3  -0.847 -18.624 -12.430
   10    HA   SER   3           HA       SER   3  -2.911 -20.561 -13.250
   11    HB2  SER   3           1HB      SER   3  -1.416 -20.295 -10.672
   12    HB3  SER   3           2HB      SER   3  -3.084 -20.867 -10.632
   13    HG   SER   3           HG       SER   3  -1.801 -22.652 -10.858
   14    H    GLY   4           H        GLY   4  -2.352 -18.069 -10.750
   15    HA2  GLY   4           1HA      GLY   4  -3.695 -16.003 -10.910
   16    HA3  GLY   4           2HA      GLY   4  -5.048 -17.026 -11.368
   17    H    SER   5           H        SER   5  -5.384 -15.271  -9.331
   18    HA   SER   5           HA       SER   5  -5.625 -17.073  -7.027
   19    HB2  SER   5           1HB      SER   5  -4.904 -15.366  -5.481
   20    HB3  SER   5           2HB      SER   5  -3.655 -15.553  -6.712
   21    HG   SER   5           HG       SER   5  -3.913 -13.426  -6.703
   22    H    SER   6           H        SER   6  -7.688 -17.230  -6.489
   23    HA   SER   6           HA       SER   6  -9.384 -14.839  -6.604
   24    HB2  SER   6           1HB      SER   6  -9.866 -16.068  -8.652
   25    HB3  SER   6           2HB      SER   6 -10.118 -17.552  -7.732
   26    HG   SER   6           HG       SER   6 -11.945 -16.664  -6.828
   27    H    GLY   7           H        GLY   7 -10.909 -14.686  -5.004
   28    HA2  GLY   7           1HA      GLY   7 -12.349 -15.853  -3.382
   29    HA3  GLY   7           2HA      GLY   7 -10.985 -16.915  -3.064
   30    H    THR   8           H        THR   8 -10.609 -16.528  -0.950
   31    HA   THR   8           HA       THR   8 -10.311 -15.331   1.005
   32    HB   THR   8           HB       THR   8  -8.275 -13.865   0.859
   33    HG1  THR   8           HG1      THR   8  -7.998 -13.072  -1.095
   34   HG21  THR   8          3HG2      THR   8  -7.436 -15.893   1.332
   35   HG22  THR   8          1HG2      THR   8  -6.973 -15.947  -0.368
   36   HG23  THR   8          2HG2      THR   8  -8.479 -16.698   0.161
   37    H    GLY   9           H        GLY   9 -12.498 -14.251  -0.389
   38    HA2  GLY   9           1HA      GLY   9 -13.841 -12.398   0.100
   39    HA3  GLY   9           2HA      GLY   9 -12.411 -11.532   0.642
   40    H    GLU  10           H        GLU  10 -14.574 -10.673  -1.153
   41    HA   GLU  10           HA       GLU  10 -12.902  -9.983  -3.474
   42    HB2  GLU  10           1HB      GLU  10 -15.857 -10.620  -3.496
   43    HB3  GLU  10           2HB      GLU  10 -14.954  -9.995  -4.869
   44    HG2  GLU  10           1HG      GLU  10 -13.513 -12.021  -4.757
   45    HG3  GLU  10           2HG      GLU  10 -14.589 -12.654  -3.513
   46    H    LYS  11           H        LYS  11 -13.010  -8.421  -1.205
   47    HA   LYS  11           HA       LYS  11 -14.993  -6.432  -1.198
   48    HB2  LYS  11           1HB      LYS  11 -12.113  -6.165  -0.316
   49    HB3  LYS  11           2HB      LYS  11 -13.453  -5.138   0.176
   50    HG2  LYS  11           1HG      LYS  11 -13.674  -8.052   0.691
   51    HG3  LYS  11           2HG      LYS  11 -12.570  -7.107   1.693
   52    HD2  LYS  11           1HD      LYS  11 -14.472  -6.862   2.925
   53    HD3  LYS  11           2HD      LYS  11 -14.679  -5.497   1.825
   54    HE2  LYS  11           1HE      LYS  11 -16.729  -6.462   1.599
   55    HE3  LYS  11           2HE      LYS  11 -15.863  -7.349   0.347
   56    HZ1  LYS  11           3HZ      LYS  11 -16.262  -9.232   1.412
   57    HZ2  LYS  11           1HZ      LYS  11 -17.189  -8.391   2.550
   58    HZ3  LYS  11           2HZ      LYS  11 -15.541  -8.650   2.828
   59    HA   PRO  12           HA       PRO  12 -14.008  -3.982  -4.719
   60    HB2  PRO  12           1HB      PRO  12 -15.087  -1.622  -3.922
   61    HB3  PRO  12           2HB      PRO  12 -16.067  -3.004  -4.428
   62    HG2  PRO  12           1HG      PRO  12 -15.381  -2.077  -1.665
   63    HG3  PRO  12           2HG      PRO  12 -16.935  -2.647  -2.300
   64    HD2  PRO  12           1HD      PRO  12 -15.293  -4.225  -0.835
   65    HD3  PRO  12           2HD      PRO  12 -16.338  -4.866  -2.119
   66    H    TYR  13           H        TYR  13 -12.510  -3.680  -1.777
   67    HA   TYR  13           HA       TYR  13 -10.694  -1.611  -2.820
   68    HB2  TYR  13           1HB      TYR  13 -11.344  -1.951   0.108
   69    HB3  TYR  13           2HB      TYR  13 -10.439  -0.645  -0.650
   70    HD1  TYR  13           HD1      TYR  13 -11.758   0.783  -2.396
   71    HD2  TYR  13           HD2      TYR  13 -13.598  -1.654   0.567
   72    HE1  TYR  13           HE1      TYR  13 -13.825   2.100  -2.605
   73    HE2  TYR  13           HE2      TYR  13 -15.670  -0.345   0.365
   74    HH   TYR  13           HH       TYR  13 -16.119   2.011  -2.147
   75    H    GLU  14           H        GLU  14  -8.778  -2.481  -3.208
   76    HA   GLU  14           HA       GLU  14  -7.602  -4.292  -1.239
   77    HB2  GLU  14           1HB      GLU  14  -8.710  -5.662  -3.033
   78    HB3  GLU  14           2HB      GLU  14  -7.601  -4.937  -4.189
   79    HG2  GLU  14           1HG      GLU  14  -5.798  -5.815  -2.476
   80    HG3  GLU  14           2HG      GLU  14  -7.089  -6.943  -2.065
   81    H    CYS  15           H        CYS  15  -5.730  -3.418  -0.687
   82    HA   CYS  15           HA       CYS  15  -4.423  -1.414  -2.198
   83    HB2  CYS  15           1HB      CYS  15  -4.336  -1.939   0.361
   84    HB3  CYS  15           2HB      CYS  15  -3.014  -3.013  -0.086
   85    H    LYS  16           H        LYS  16  -2.104  -1.555  -2.863
   86    HA   LYS  16           HA       LYS  16  -1.641  -4.096  -4.274
   87    HB2  LYS  16           1HB      LYS  16  -1.941  -1.843  -5.527
   88    HB3  LYS  16           2HB      LYS  16  -0.307  -1.498  -4.978
   89    HG2  LYS  16           1HG      LYS  16  -0.100  -2.377  -7.150
   90    HG3  LYS  16           2HG      LYS  16   0.387  -3.671  -6.052
   91    HD2  LYS  16           1HD      LYS  16  -1.000  -4.836  -7.452
   92    HD3  LYS  16           2HD      LYS  16  -2.165  -4.316  -6.232
   93    HE2  LYS  16           1HE      LYS  16  -3.124  -3.893  -8.374
   94    HE3  LYS  16           2HE      LYS  16  -2.668  -2.338  -7.679
   95    HZ1  LYS  16           3HZ      LYS  16  -1.771  -3.565 -10.086
   96    HZ2  LYS  16           1HZ      LYS  16  -0.465  -3.162  -9.089
   97    HZ3  LYS  16           2HZ      LYS  16  -1.571  -1.971  -9.556
   98    H    VAL  17           H        VAL  17   0.067  -1.468  -2.591
   99    HA   VAL  17           HA       VAL  17   2.613  -2.550  -2.537
  100    HB   VAL  17           HB       VAL  17   1.255  -0.903  -0.400
  101   HG11  VAL  17          1HG1      VAL  17   3.314  -2.174   0.323
  102   HG12  VAL  17          2HG1      VAL  17   4.215  -1.206  -0.845
  103   HG13  VAL  17          3HG1      VAL  17   3.389  -0.422   0.502
  104   HG21  VAL  17          3HG2      VAL  17   3.175   0.036  -2.515
  105   HG22  VAL  17          1HG2      VAL  17   1.428   0.026  -2.756
  106   HG23  VAL  17          2HG2      VAL  17   2.135   1.005  -1.471
  107    H    CYS  18           H        CYS  18   0.356  -2.667   0.225
  108    HA   CYS  18           HA       CYS  18   1.787  -4.918   1.342
  109    HB2  CYS  18           1HB      CYS  18   0.213  -4.709   3.217
  110    HB3  CYS  18           2HB      CYS  18   0.948  -3.158   2.823
  111    H    SER  19           H        SER  19  -1.101  -4.346  -0.493
  112    HA   SER  19           HA       SER  19  -2.493  -5.797  -1.576
  113    HB2  SER  19           1HB      SER  19  -0.368  -7.207  -1.762
  114    HB3  SER  19           2HB      SER  19  -0.963  -8.096  -0.360
  115    HG   SER  19           HG       SER  19  -1.813  -8.150  -2.976
  116    H    LYS  20           H        LYS  20  -3.393  -4.706   0.697
  117    HA   LYS  20           HA       LYS  20  -4.613  -6.895   2.234
  118    HB2  LYS  20           1HB      LYS  20  -3.300  -4.987   3.366
  119    HB3  LYS  20           2HB      LYS  20  -4.696  -3.985   2.992
  120    HG2  LYS  20           1HG      LYS  20  -6.053  -5.074   4.484
  121    HG3  LYS  20           2HG      LYS  20  -5.114  -6.567   4.415
  122    HD2  LYS  20           1HD      LYS  20  -4.697  -5.613   6.543
  123    HD3  LYS  20           2HD      LYS  20  -3.255  -5.306   5.572
  124    HE2  LYS  20           1HE      LYS  20  -3.781  -3.044   5.300
  125    HE3  LYS  20           2HE      LYS  20  -5.465  -3.287   5.759
  126    HZ1  LYS  20           3HZ      LYS  20  -4.382  -4.008   8.005
  127    HZ2  LYS  20           1HZ      LYS  20  -4.622  -2.370   7.656
  128    HZ3  LYS  20           2HZ      LYS  20  -3.090  -3.061   7.464
  129    H    ALA  21           H        ALA  21  -6.877  -6.152   3.127
  130    HA   ALA  21           HA       ALA  21  -8.424  -4.928   0.945
  131    HB1  ALA  21           3HB      ALA  21 -10.218  -6.670   1.511
  132    HB2  ALA  21           1HB      ALA  21  -8.831  -7.192   0.556
  133    HB3  ALA  21           2HB      ALA  21  -8.909  -7.570   2.277
  134    H    PHE  22           H        PHE  22 -10.033  -3.580   1.566
  135    HA   PHE  22           HA       PHE  22 -10.594  -3.388   4.452
  136    HB2  PHE  22           1HB      PHE  22 -10.358  -1.116   2.467
  137    HB3  PHE  22           2HB      PHE  22 -10.827  -0.945   4.156
  138    HD1  PHE  22           HD1      PHE  22  -8.069  -1.615   1.851
  139    HD2  PHE  22           HD2      PHE  22  -9.201  -1.129   5.925
  140    HE1  PHE  22           HE1      PHE  22  -5.700  -1.390   2.479
  141    HE2  PHE  22           HE2      PHE  22  -6.835  -0.903   6.559
  142    HZ   PHE  22           HZ       PHE  22  -5.081  -1.033   4.835
  143    H    THR  23           H        THR  23 -12.690  -2.439   4.989
  144    HA   THR  23           HA       THR  23 -14.715  -3.145   2.971
  145    HB   THR  23           HB       THR  23 -16.277  -3.487   4.823
  146    HG1  THR  23           HG1      THR  23 -14.729  -1.974   6.185
  147   HG21  THR  23          3HG2      THR  23 -14.950  -5.380   5.993
  148   HG22  THR  23          1HG2      THR  23 -13.663  -4.955   4.864
  149   HG23  THR  23          2HG2      THR  23 -15.230  -5.488   4.255
  150    H    GLN  24           H        GLN  24 -13.269  -0.536   3.388
  151    HA   GLN  24           HA       GLN  24 -15.525   1.163   3.003
  152    HB2  GLN  24           1HB      GLN  24 -14.172   1.110   5.651
  153    HB3  GLN  24           2HB      GLN  24 -14.594   2.685   4.993
  154    HG2  GLN  24           1HG      GLN  24 -16.926   1.507   4.615
  155    HG3  GLN  24           2HG      GLN  24 -16.348   0.484   5.929
  156   HE21  GLN  24          1HE2      GLN  24 -16.523   1.200   7.951
  157   HE22  GLN  24          2HE2      GLN  24 -16.998   2.798   8.406
  158    H    LYS  25           H        LYS  25 -14.805   2.297   1.333
  159    HA   LYS  25           HA       LYS  25 -12.239   2.661   0.478
  160    HB2  LYS  25           1HB      LYS  25 -13.031   4.458  -0.897
  161    HB3  LYS  25           2HB      LYS  25 -14.318   3.265  -0.776
  162    HG2  LYS  25           1HG      LYS  25 -15.539   5.141  -0.431
  163    HG3  LYS  25           2HG      LYS  25 -15.058   4.823   1.238
  164    HD2  LYS  25           1HD      LYS  25 -14.657   7.126   0.857
  165    HD3  LYS  25           2HD      LYS  25 -13.078   6.337   0.824
  166    HE2  LYS  25           1HE      LYS  25 -14.547   6.642  -1.742
  167    HE3  LYS  25           2HE      LYS  25 -13.819   8.081  -1.030
  168    HZ1  LYS  25           3HZ      LYS  25 -12.566   6.042  -2.485
  169    HZ2  LYS  25           1HZ      LYS  25 -11.943   6.015  -0.912
  170    HZ3  LYS  25           2HZ      LYS  25 -11.873   7.437  -1.825
  171    H    ALA  26           H        ALA  26 -13.992   4.588   2.845
  172    HA   ALA  26           HA       ALA  26 -12.232   6.736   3.087
  173    HB1  ALA  26           3HB      ALA  26 -13.261   7.186   5.190
  174    HB2  ALA  26           1HB      ALA  26 -14.506   6.551   4.114
  175    HB3  ALA  26           2HB      ALA  26 -13.796   5.513   5.351
  176    H    HIS  27           H        HIS  27 -12.136   3.524   4.529
  177    HA   HIS  27           HA       HIS  27  -9.905   4.115   6.235
  178    HB2  HIS  27           1HB      HIS  27 -11.453   1.658   5.522
  179    HB3  HIS  27           2HB      HIS  27  -9.877   1.478   6.288
  180    HD1  HIS  27           HD1      HIS  27 -13.182   1.353   7.252
  181    HD2  HIS  27           HD2      HIS  27  -9.946   3.535   8.678
  182    HE1  HIS  27           HE1      HIS  27 -13.788   1.993   9.607
  183    H    LEU  28           H        LEU  28 -10.364   2.620   3.079
  184    HA   LEU  28           HA       LEU  28  -7.683   1.724   2.779
  185    HB2  LEU  28           1HB      LEU  28  -9.405   0.710   1.472
  186    HB3  LEU  28           2HB      LEU  28  -9.878   2.264   0.790
  187    HG   LEU  28           HG       LEU  28  -7.544   2.302  -0.264
  188   HD11  LEU  28          1HD1      LEU  28  -7.539  -0.633  -0.250
  189   HD12  LEU  28          2HD1      LEU  28  -7.097   0.123   1.281
  190   HD13  LEU  28          3HD1      LEU  28  -6.197   0.509  -0.185
  191   HD21  LEU  28          3HD2      LEU  28  -9.999   1.316  -1.114
  192   HD22  LEU  28          1HD2      LEU  28  -8.832   0.084  -1.596
  193   HD23  LEU  28          2HD2      LEU  28  -8.624   1.752  -2.129
  194    H    ALA  29           H        ALA  29  -9.400   4.393   1.142
  195    HA   ALA  29           HA       ALA  29  -7.339   5.592  -0.162
  196    HB1  ALA  29           3HB      ALA  29  -9.894   6.255   0.199
  197    HB2  ALA  29           1HB      ALA  29  -9.153   7.444   1.271
  198    HB3  ALA  29           2HB      ALA  29  -8.700   7.388  -0.433
  199    H    GLN  30           H        GLN  30  -8.134   5.938   3.267
  200    HA   GLN  30           HA       GLN  30  -6.168   7.907   3.822
  201    HB2  GLN  30           1HB      GLN  30  -7.922   6.123   5.434
  202    HB3  GLN  30           2HB      GLN  30  -6.525   6.829   6.235
  203    HG2  GLN  30           1HG      GLN  30  -8.751   8.071   6.376
  204    HG3  GLN  30           2HG      GLN  30  -7.308   8.998   5.969
  205   HE21  GLN  30          1HE2      GLN  30  -7.096   9.870   3.937
  206   HE22  GLN  30          2HE2      GLN  30  -8.395   9.928   2.799
  207    H    HIS  31           H        HIS  31  -6.141   4.416   3.712
  208    HA   HIS  31           HA       HIS  31  -3.592   4.151   5.018
  209    HB2  HIS  31           1HB      HIS  31  -5.020   2.283   5.253
  210    HB3  HIS  31           2HB      HIS  31  -5.386   2.241   3.531
  211    HD1  HIS  31           HD1      HIS  31  -2.624   1.414   5.962
  212    HD2  HIS  31           HD2      HIS  31  -3.676   0.716   2.004
  213    HE1  HIS  31           HE1      HIS  31  -0.998  -0.314   5.128
  214    H    GLN  32           H        GLN  32  -4.717   3.610   1.675
  215    HA   GLN  32           HA       GLN  32  -2.414   3.000   0.399
  216    HB2  GLN  32           1HB      GLN  32  -4.654   4.811  -0.481
  217    HB3  GLN  32           2HB      GLN  32  -3.325   4.390  -1.553
  218    HG2  GLN  32           1HG      GLN  32  -3.895   1.980  -1.148
  219    HG3  GLN  32           2HG      GLN  32  -5.347   2.542  -0.322
  220   HE21  GLN  32          1HE2      GLN  32  -6.606   4.212  -1.662
  221   HE22  GLN  32          2HE2      GLN  32  -6.850   3.802  -3.322
  222    H    LYS  33           H        LYS  33  -3.244   6.079   1.788
  223    HA   LYS  33           HA       LYS  33  -0.960   7.406   0.561
  224    HB2  LYS  33           1HB      LYS  33  -1.811   9.427   1.465
  225    HB3  LYS  33           2HB      LYS  33  -3.207   8.528   0.886
  226    HG2  LYS  33           1HG      LYS  33  -3.969   8.076   3.012
  227    HG3  LYS  33           2HG      LYS  33  -2.375   8.285   3.741
  228    HD2  LYS  33           1HD      LYS  33  -2.644  10.753   2.934
  229    HD3  LYS  33           2HD      LYS  33  -4.362  10.351   2.890
  230    HE2  LYS  33           1HE      LYS  33  -4.500  10.102   5.164
  231    HE3  LYS  33           2HE      LYS  33  -2.805   9.647   5.326
  232    HZ1  LYS  33           3HZ      LYS  33  -4.015  12.305   5.232
  233    HZ2  LYS  33           1HZ      LYS  33  -2.485  12.123   4.533
  234    HZ3  LYS  33           2HZ      LYS  33  -2.721  11.739   6.163
  235    H    THR  34           H        THR  34  -1.951   6.045   3.620
  236    HA   THR  34           HA       THR  34  -0.042   7.202   5.305
  237    HB   THR  34           HB       THR  34  -2.066   5.644   5.862
  238    HG1  THR  34           HG1      THR  34  -0.655   4.934   7.801
  239   HG21  THR  34          3HG2      THR  34  -1.795   3.409   5.798
  240   HG22  THR  34          1HG2      THR  34  -0.111   3.498   6.311
  241   HG23  THR  34          2HG2      THR  34  -0.533   3.767   4.620
  242    H    HIS  35           H        HIS  35   0.257   4.741   2.894
  243    HA   HIS  35           HA       HIS  35   2.528   3.382   3.776
  244    HB2  HIS  35           1HB      HIS  35   1.253   3.868   1.132
  245    HB3  HIS  35           2HB      HIS  35   2.911   3.274   1.131
  246    HD1  HIS  35           HD1      HIS  35   2.586   1.381   3.632
  247    HD2  HIS  35           HD2      HIS  35   0.049   1.522   0.345
  248    HE1  HIS  35           HE1      HIS  35   1.452  -0.862   3.562
  249    H    THR  36           H        THR  36   4.719   3.685   3.498
  250    HA   THR  36           HA       THR  36   5.522   6.448   2.914
  251    HB   THR  36           HB       THR  36   7.174   4.316   4.276
  252    HG1  THR  36           HG1      THR  36   6.453   5.173   6.204
  253   HG21  THR  36          3HG2      THR  36   7.824   6.855   3.265
  254   HG22  THR  36          1HG2      THR  36   8.809   5.831   4.309
  255   HG23  THR  36          2HG2      THR  36   7.734   7.037   5.016
  256    H    GLY  37           H        GLY  37   6.956   6.947   1.329
  257    HA2  GLY  37           1HA      GLY  37   8.933   5.588   0.140
  258    HA3  GLY  37           2HA      GLY  37   7.522   4.866  -0.619
  259    H    GLU  38           H        GLU  38   6.751   5.805  -2.396
  260    HA   GLU  38           HA       GLU  38   7.775   8.474  -3.079
  261    HB2  GLU  38           1HB      GLU  38   8.079   6.306  -4.551
  262    HB3  GLU  38           2HB      GLU  38   6.448   6.694  -5.080
  263    HG2  GLU  38           1HG      GLU  38   8.288   7.579  -6.523
  264    HG3  GLU  38           2HG      GLU  38   7.127   8.779  -5.959
  265    H    LYS  39           H        LYS  39   6.302   9.844  -2.179
  266    HA   LYS  39           HA       LYS  39   3.490   9.507  -2.991
  267    HB2  LYS  39           1HB      LYS  39   3.753   9.458  -0.580
  268    HB3  LYS  39           2HB      LYS  39   4.668  10.959  -0.615
  269    HG2  LYS  39           1HG      LYS  39   2.459  11.854  -1.763
  270    HG3  LYS  39           2HG      LYS  39   1.749  10.505  -0.873
  271    HD2  LYS  39           1HD      LYS  39   3.617  12.312   0.574
  272    HD3  LYS  39           2HD      LYS  39   1.999  12.913   0.204
  273    HE2  LYS  39           1HE      LYS  39   2.556  10.302   1.604
  274    HE3  LYS  39           2HE      LYS  39   2.217  11.817   2.440
  275    HZ1  LYS  39           3HZ      LYS  39   0.052  11.578   2.082
  276    HZ2  LYS  39           1HZ      LYS  39   0.372   9.995   1.577
  277    HZ3  LYS  39           2HZ      LYS  39   0.267  11.241   0.438
  278    HA   PRO  40           HA       PRO  40   4.991  13.137  -5.392
  279    HB2  PRO  40           1HB      PRO  40   3.457  12.599  -7.566
  280    HB3  PRO  40           2HB      PRO  40   5.043  11.864  -7.304
  281    HG2  PRO  40           1HG      PRO  40   2.322  10.732  -6.781
  282    HG3  PRO  40           2HG      PRO  40   3.738   9.950  -7.506
  283    HD2  PRO  40           1HD      PRO  40   3.028   9.570  -4.921
  284    HD3  PRO  40           2HD      PRO  40   4.720   9.546  -5.460
  285    H    SER  41           H        SER  41   3.963  15.082  -5.727
  286    HA   SER  41           HA       SER  41   1.447  15.444  -4.387
  287    HB2  SER  41           1HB      SER  41   3.196  17.403  -5.895
  288    HB3  SER  41           2HB      SER  41   1.776  17.844  -4.946
  289    HG   SER  41           HG       SER  41   3.349  16.325  -3.435
  290    H    GLY  42           H        GLY  42  -0.533  15.772  -5.249
  291    HA2  GLY  42           1HA      GLY  42  -1.071  16.652  -7.862
  292    HA3  GLY  42           2HA      GLY  42  -1.096  14.895  -7.857
  293    HA   PRO  43           HA       PRO  43  -4.708  16.634  -5.080
  294    HB2  PRO  43           1HB      PRO  43  -5.615  19.054  -5.910
  295    HB3  PRO  43           2HB      PRO  43  -4.379  18.869  -4.661
  296    HG2  PRO  43           1HG      PRO  43  -4.054  19.501  -7.569
  297    HG3  PRO  43           2HG      PRO  43  -3.232  20.216  -6.170
  298    HD2  PRO  43           1HD      PRO  43  -2.077  18.327  -7.728
  299    HD3  PRO  43           2HD      PRO  43  -1.743  18.466  -5.990
  300    H    SER  44           H        SER  44  -6.563  15.694  -5.650
  301    HA   SER  44           HA       SER  44  -8.127  14.697  -6.992
  302    HB2  SER  44           1HB      SER  44  -9.437  16.317  -8.347
  303    HB3  SER  44           2HB      SER  44  -9.121  16.903  -6.714
  304    HG   SER  44           HG       SER  44  -8.547  18.101  -8.981
  305    H    SER  45           H        SER  45  -5.545  14.198  -7.912
  306    HA   SER  45           HA       SER  45  -5.069  14.774 -10.602
  307    HB2  SER  45           1HB      SER  45  -3.481  12.970 -10.568
  308    HB3  SER  45           2HB      SER  45  -3.439  13.742  -8.983
  309    HG   SER  45           HG       SER  45  -4.156  11.967  -8.106
  310    H    GLY  46           H        GLY  46  -5.206  13.319 -12.461
  311    HA2  GLY  46           1HA      GLY  46  -7.115  11.152 -12.371
  312    HA3  GLY  46           2HA      GLY  46  -7.706  12.586 -13.198
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1  -6.261 -24.812 -17.176
    2    HA2  GLY   1           1HA      GLY   1  -4.851 -22.508 -17.544
    3    HA3  GLY   1           2HA      GLY   1  -5.995 -22.507 -18.878
    4    H    SER   2           H        SER   2  -6.439 -23.649 -15.550
    5    HA   SER   2           HA       SER   2  -8.453 -21.532 -15.178
    6    HB2  SER   2           1HB      SER   2  -8.713 -24.376 -14.179
    7    HB3  SER   2           2HB      SER   2  -9.918 -23.095 -14.055
    8    HG   SER   2           HG       SER   2  -9.079 -24.538 -16.319
    9    H    SER   3           H        SER   3  -7.158 -20.240 -13.915
   10    HA   SER   3           HA       SER   3  -6.229 -21.414 -11.376
   11    HB2  SER   3           1HB      SER   3  -4.320 -20.632 -12.575
   12    HB3  SER   3           2HB      SER   3  -5.123 -19.121 -13.001
   13    HG   SER   3           HG       SER   3  -3.814 -19.834 -10.690
   14    H    GLY   4           H        GLY   4  -8.213 -21.085 -10.314
   15    HA2  GLY   4           1HA      GLY   4  -9.154 -18.318 -10.074
   16    HA3  GLY   4           2HA      GLY   4 -10.030 -19.754  -9.566
   17    H    SER   5           H        SER   5 -10.121 -17.885  -7.773
   18    HA   SER   5           HA       SER   5  -8.166 -18.710  -5.737
   19    HB2  SER   5           1HB      SER   5  -9.143 -15.892  -6.251
   20    HB3  SER   5           2HB      SER   5  -8.189 -16.381  -4.850
   21    HG   SER   5           HG       SER   5  -6.857 -17.283  -6.873
   22    H    SER   6           H        SER   6  -8.924 -18.744  -3.596
   23    HA   SER   6           HA       SER   6 -11.551 -19.606  -3.237
   24    HB2  SER   6           1HB      SER   6  -9.538 -19.999  -1.714
   25    HB3  SER   6           2HB      SER   6  -9.867 -18.403  -1.039
   26    HG   SER   6           HG       SER   6 -12.087 -19.291  -0.724
   27    H    GLY   7           H        GLY   7 -13.337 -18.655  -2.151
   28    HA2  GLY   7           1HA      GLY   7 -13.381 -15.710  -2.377
   29    HA3  GLY   7           2HA      GLY   7 -14.773 -16.740  -2.671
   30    H    THR   8           H        THR   8 -12.570 -15.571  -0.175
   31    HA   THR   8           HA       THR   8 -14.611 -16.223   1.847
   32    HB   THR   8           HB       THR   8 -12.801 -16.053   3.523
   33    HG1  THR   8           HG1      THR   8 -11.000 -15.139   2.921
   34   HG21  THR   8          3HG2      THR   8 -11.882 -17.959   1.395
   35   HG22  THR   8          1HG2      THR   8 -13.418 -18.198   2.226
   36   HG23  THR   8          2HG2      THR   8 -11.913 -18.180   3.144
   37    H    GLY   9           H        GLY   9 -15.863 -14.360   1.595
   38    HA2  GLY   9           1HA      GLY   9 -16.467 -12.163   1.894
   39    HA3  GLY   9           2HA      GLY   9 -15.294 -12.188   3.203
   40    H    GLU  10           H        GLU  10 -15.548 -11.791  -0.318
   41    HA   GLU  10           HA       GLU  10 -12.992 -10.491  -0.498
   42    HB2  GLU  10           1HB      GLU  10 -13.432 -10.281  -2.830
   43    HB3  GLU  10           2HB      GLU  10 -14.037 -11.856  -2.336
   44    HG2  GLU  10           1HG      GLU  10 -15.772  -9.416  -2.609
   45    HG3  GLU  10           2HG      GLU  10 -15.515 -10.589  -3.899
   46    H    LYS  11           H        LYS  11 -12.596  -8.315  -0.993
   47    HA   LYS  11           HA       LYS  11 -14.808  -6.488  -0.313
   48    HB2  LYS  11           1HB      LYS  11 -11.859  -6.292   0.296
   49    HB3  LYS  11           2HB      LYS  11 -12.956  -4.926   0.446
   50    HG2  LYS  11           1HG      LYS  11 -12.967  -5.686   2.592
   51    HG3  LYS  11           2HG      LYS  11 -14.321  -6.609   1.937
   52    HD2  LYS  11           1HD      LYS  11 -13.115  -8.581   1.874
   53    HD3  LYS  11           2HD      LYS  11 -11.559  -7.748   1.827
   54    HE2  LYS  11           1HE      LYS  11 -12.051  -6.974   4.183
   55    HE3  LYS  11           2HE      LYS  11 -13.402  -8.107   4.180
   56    HZ1  LYS  11           3HZ      LYS  11 -10.528  -8.641   4.238
   57    HZ2  LYS  11           1HZ      LYS  11 -11.511  -9.742   3.410
   58    HZ3  LYS  11           2HZ      LYS  11 -11.790  -9.425   5.048
   59    HA   PRO  12           HA       PRO  12 -14.305  -4.723  -4.322
   60    HB2  PRO  12           1HB      PRO  12 -15.523  -2.340  -3.866
   61    HB3  PRO  12           2HB      PRO  12 -16.414  -3.858  -4.033
   62    HG2  PRO  12           1HG      PRO  12 -15.616  -2.395  -1.547
   63    HG3  PRO  12           2HG      PRO  12 -17.157  -3.182  -1.936
   64    HD2  PRO  12           1HD      PRO  12 -15.286  -4.342  -0.360
   65    HD3  PRO  12           2HD      PRO  12 -16.360  -5.281  -1.417
   66    H    TYR  13           H        TYR  13 -12.773  -3.610  -1.530
   67    HA   TYR  13           HA       TYR  13 -11.114  -1.772  -3.124
   68    HB2  TYR  13           1HB      TYR  13 -11.794  -1.410  -0.200
   69    HB3  TYR  13           2HB      TYR  13 -10.866  -0.310  -1.214
   70    HD1  TYR  13           HD1      TYR  13 -12.062   0.809  -3.168
   71    HD2  TYR  13           HD2      TYR  13 -14.125  -1.210  -0.042
   72    HE1  TYR  13           HE1      TYR  13 -14.124   2.009  -3.762
   73    HE2  TYR  13           HE2      TYR  13 -16.194  -0.017  -0.629
   74    HH   TYR  13           HH       TYR  13 -16.418   2.620  -2.181
   75    H    GLU  14           H        GLU  14  -9.245  -2.798  -3.419
   76    HA   GLU  14           HA       GLU  14  -7.949  -4.007  -1.069
   77    HB2  GLU  14           1HB      GLU  14  -8.898  -5.610  -2.898
   78    HB3  GLU  14           2HB      GLU  14  -7.497  -5.094  -3.826
   79    HG2  GLU  14           1HG      GLU  14  -6.000  -6.080  -2.368
   80    HG3  GLU  14           2HG      GLU  14  -7.159  -6.112  -1.040
   81    H    CYS  15           H        CYS  15  -5.624  -4.006  -1.112
   82    HA   CYS  15           HA       CYS  15  -4.563  -1.734  -2.640
   83    HB2  CYS  15           1HB      CYS  15  -4.391  -1.596  -0.181
   84    HB3  CYS  15           2HB      CYS  15  -3.451  -3.084  -0.171
   85    H    LYS  16           H        LYS  16  -2.280  -1.894  -3.346
   86    HA   LYS  16           HA       LYS  16  -1.708  -4.606  -4.342
   87    HB2  LYS  16           1HB      LYS  16  -1.002  -1.910  -5.512
   88    HB3  LYS  16           2HB      LYS  16  -0.434  -3.446  -6.153
   89    HG2  LYS  16           1HG      LYS  16  -3.354  -2.821  -5.856
   90    HG3  LYS  16           2HG      LYS  16  -2.431  -2.384  -7.296
   91    HD2  LYS  16           1HD      LYS  16  -2.405  -5.191  -6.241
   92    HD3  LYS  16           2HD      LYS  16  -3.719  -4.624  -7.274
   93    HE2  LYS  16           1HE      LYS  16  -0.871  -4.222  -8.097
   94    HE3  LYS  16           2HE      LYS  16  -1.649  -5.785  -8.338
   95    HZ1  LYS  16           3HZ      LYS  16  -2.705  -3.206  -9.364
   96    HZ2  LYS  16           1HZ      LYS  16  -3.328  -4.748  -9.676
   97    HZ3  LYS  16           2HZ      LYS  16  -1.812  -4.310 -10.282
   98    H    VAL  17           H        VAL  17  -0.423  -1.827  -2.678
   99    HA   VAL  17           HA       VAL  17   2.312  -2.568  -2.741
  100    HB   VAL  17           HB       VAL  17   0.844  -0.859  -0.727
  101   HG11  VAL  17          1HG1      VAL  17   3.799  -1.017  -1.309
  102   HG12  VAL  17          2HG1      VAL  17   3.012   0.025  -0.122
  103   HG13  VAL  17          3HG1      VAL  17   3.004  -1.725   0.097
  104   HG21  VAL  17          3HG2      VAL  17   0.696  -0.064  -3.065
  105   HG22  VAL  17          1HG2      VAL  17   1.608   1.029  -2.025
  106   HG23  VAL  17          2HG2      VAL  17   2.458  -0.039  -3.141
  107    H    CYS  18           H        CYS  18  -0.127  -2.856  -0.152
  108    HA   CYS  18           HA       CYS  18   1.517  -4.999   1.027
  109    HB2  CYS  18           1HB      CYS  18   0.358  -4.445   3.171
  110    HB3  CYS  18           2HB      CYS  18   1.358  -3.137   2.547
  111    H    SER  19           H        SER  19  -0.655  -5.058  -1.080
  112    HA   SER  19           HA       SER  19  -2.635  -6.146  -1.543
  113    HB2  SER  19           1HB      SER  19  -0.899  -8.138  -0.095
  114    HB3  SER  19           2HB      SER  19  -2.453  -8.605  -0.786
  115    HG   SER  19           HG       SER  19  -0.130  -7.690  -2.094
  116    H    LYS  20           H        LYS  20  -2.788  -4.549   0.864
  117    HA   LYS  20           HA       LYS  20  -4.241  -6.084   2.824
  118    HB2  LYS  20           1HB      LYS  20  -2.836  -4.123   3.428
  119    HB3  LYS  20           2HB      LYS  20  -3.961  -3.084   2.562
  120    HG2  LYS  20           1HG      LYS  20  -5.731  -3.647   4.101
  121    HG3  LYS  20           2HG      LYS  20  -4.683  -4.803   4.927
  122    HD2  LYS  20           1HD      LYS  20  -3.218  -3.020   5.646
  123    HD3  LYS  20           2HD      LYS  20  -4.150  -1.840   4.721
  124    HE2  LYS  20           1HE      LYS  20  -5.010  -1.531   6.831
  125    HE3  LYS  20           2HE      LYS  20  -6.140  -2.714   6.173
  126    HZ1  LYS  20           3HZ      LYS  20  -5.360  -3.238   8.442
  127    HZ2  LYS  20           1HZ      LYS  20  -3.786  -3.406   7.845
  128    HZ3  LYS  20           2HZ      LYS  20  -5.004  -4.457   7.324
  129    H    ALA  21           H        ALA  21  -6.448  -5.842   3.348
  130    HA   ALA  21           HA       ALA  21  -8.104  -4.817   1.134
  131    HB1  ALA  21           3HB      ALA  21  -9.802  -6.526   2.019
  132    HB2  ALA  21           1HB      ALA  21  -8.420  -7.127   1.101
  133    HB3  ALA  21           2HB      ALA  21  -8.430  -7.246   2.861
  134    H    PHE  22           H        PHE  22 -10.126  -3.862   1.677
  135    HA   PHE  22           HA       PHE  22 -10.508  -3.137   4.488
  136    HB2  PHE  22           1HB      PHE  22 -10.727  -1.041   2.340
  137    HB3  PHE  22           2HB      PHE  22 -10.627  -0.818   4.083
  138    HD1  PHE  22           HD1      PHE  22  -8.659  -2.064   1.184
  139    HD2  PHE  22           HD2      PHE  22  -8.594  -0.320   5.067
  140    HE1  PHE  22           HE1      PHE  22  -6.226  -1.748   0.998
  141    HE2  PHE  22           HE2      PHE  22  -6.161  -0.001   4.886
  142    HZ   PHE  22           HZ       PHE  22  -4.974  -0.714   2.850
  143    H    THR  23           H        THR  23 -12.643  -2.487   5.020
  144    HA   THR  23           HA       THR  23 -14.644  -3.717   3.323
  145    HB   THR  23           HB       THR  23 -14.793  -4.170   5.693
  146    HG1  THR  23           HG1      THR  23 -16.888  -2.374   4.978
  147   HG21  THR  23          3HG2      THR  23 -14.229  -2.618   7.187
  148   HG22  THR  23          1HG2      THR  23 -15.694  -1.724   6.781
  149   HG23  THR  23          2HG2      THR  23 -14.188  -1.383   5.929
  150    H    GLN  24           H        GLN  24 -13.555  -0.534   4.167
  151    HA   GLN  24           HA       GLN  24 -15.676   0.598   2.470
  152    HB2  GLN  24           1HB      GLN  24 -14.619   1.629   5.094
  153    HB3  GLN  24           2HB      GLN  24 -15.443   2.678   3.947
  154    HG2  GLN  24           1HG      GLN  24 -17.419   1.228   4.064
  155    HG3  GLN  24           2HG      GLN  24 -16.592   0.222   5.252
  156   HE21  GLN  24          1HE2      GLN  24 -16.134   1.103   7.310
  157   HE22  GLN  24          2HE2      GLN  24 -17.044   2.434   7.930
  158    H    LYS  25           H        LYS  25 -15.100   2.365   1.178
  159    HA   LYS  25           HA       LYS  25 -12.501   2.328   0.128
  160    HB2  LYS  25           1HB      LYS  25 -13.185   4.336  -1.130
  161    HB3  LYS  25           2HB      LYS  25 -14.403   3.069  -1.191
  162    HG2  LYS  25           1HG      LYS  25 -15.808   4.215   0.324
  163    HG3  LYS  25           2HG      LYS  25 -14.531   5.354   0.755
  164    HD2  LYS  25           1HD      LYS  25 -14.687   6.483  -1.282
  165    HD3  LYS  25           2HD      LYS  25 -15.524   5.142  -2.067
  166    HE2  LYS  25           1HE      LYS  25 -17.464   5.564  -0.562
  167    HE3  LYS  25           2HE      LYS  25 -16.627   6.994   0.041
  168    HZ1  LYS  25           3HZ      LYS  25 -18.308   6.930  -2.085
  169    HZ2  LYS  25           1HZ      LYS  25 -16.786   6.903  -2.823
  170    HZ3  LYS  25           2HZ      LYS  25 -17.188   8.155  -1.759
  171    H    ALA  26           H        ALA  26 -14.047   4.495   2.452
  172    HA   ALA  26           HA       ALA  26 -12.155   6.488   2.656
  173    HB1  ALA  26           3HB      ALA  26 -12.929   6.190   5.256
  174    HB2  ALA  26           1HB      ALA  26 -13.829   7.072   4.022
  175    HB3  ALA  26           2HB      ALA  26 -14.243   5.397   4.388
  176    H    HIS  27           H        HIS  27 -12.229   3.391   4.407
  177    HA   HIS  27           HA       HIS  27  -9.960   3.742   5.968
  178    HB2  HIS  27           1HB      HIS  27 -11.720   1.801   5.878
  179    HB3  HIS  27           2HB      HIS  27 -10.566   1.062   4.772
  180    HD1  HIS  27           HD1      HIS  27 -10.173  -0.822   6.546
  181    HD2  HIS  27           HD2      HIS  27  -9.054   2.987   7.770
  182    HE1  HIS  27           HE1      HIS  27  -8.750  -1.164   8.591
  183    H    LEU  28           H        LEU  28 -10.241   2.469   2.671
  184    HA   LEU  28           HA       LEU  28  -7.493   1.862   2.360
  185    HB2  LEU  28           1HB      LEU  28  -9.045   0.809   0.913
  186    HB3  LEU  28           2HB      LEU  28  -9.717   2.354   0.397
  187    HG   LEU  28           HG       LEU  28  -7.287   2.731  -0.538
  188   HD11  LEU  28          1HD1      LEU  28  -6.545   0.448  -1.477
  189   HD12  LEU  28          2HD1      LEU  28  -7.471  -0.229  -0.138
  190   HD13  LEU  28          3HD1      LEU  28  -6.123   0.860   0.186
  191   HD21  LEU  28          3HD2      LEU  28  -9.049   0.807  -2.018
  192   HD22  LEU  28          1HD2      LEU  28  -8.072   2.130  -2.654
  193   HD23  LEU  28          2HD2      LEU  28  -9.537   2.478  -1.737
  194    H    ALA  29           H        ALA  29  -9.440   4.602   1.174
  195    HA   ALA  29           HA       ALA  29  -7.471   6.061  -0.075
  196    HB1  ALA  29           3HB      ALA  29  -9.119   7.913   1.300
  197    HB2  ALA  29           1HB      ALA  29  -9.203   7.408  -0.388
  198    HB3  ALA  29           2HB      ALA  29 -10.118   6.534   0.841
  199    H    GLN  30           H        GLN  30  -8.303   6.031   3.370
  200    HA   GLN  30           HA       GLN  30  -6.415   8.030   4.103
  201    HB2  GLN  30           1HB      GLN  30  -8.353   7.559   5.500
  202    HB3  GLN  30           2HB      GLN  30  -7.790   5.914   5.767
  203    HG2  GLN  30           1HG      GLN  30  -5.904   6.697   7.017
  204    HG3  GLN  30           2HG      GLN  30  -6.283   8.373   6.622
  205   HE21  GLN  30          1HE2      GLN  30  -5.975   7.260   9.229
  206   HE22  GLN  30          2HE2      GLN  30  -7.483   7.448  10.050
  207    H    HIS  31           H        HIS  31  -6.344   4.515   3.951
  208    HA   HIS  31           HA       HIS  31  -3.898   4.132   5.298
  209    HB2  HIS  31           1HB      HIS  31  -5.022   2.142   5.087
  210    HB3  HIS  31           2HB      HIS  31  -5.595   2.514   3.464
  211    HD1  HIS  31           HD1      HIS  31  -2.372   1.505   5.202
  212    HD2  HIS  31           HD2      HIS  31  -4.219   1.256   1.489
  213    HE1  HIS  31           HE1      HIS  31  -0.864   0.065   3.796
  214    H    GLN  32           H        GLN  32  -4.625   4.328   1.817
  215    HA   GLN  32           HA       GLN  32  -2.281   3.923   0.612
  216    HB2  GLN  32           1HB      GLN  32  -4.329   6.058   0.147
  217    HB3  GLN  32           2HB      GLN  32  -2.866   6.032  -0.829
  218    HG2  GLN  32           1HG      GLN  32  -3.414   4.030  -1.839
  219    HG3  GLN  32           2HG      GLN  32  -4.517   3.563  -0.546
  220   HE21  GLN  32          1HE2      GLN  32  -6.161   3.127  -2.022
  221   HE22  GLN  32          2HE2      GLN  32  -7.037   4.387  -2.815
  222    H    LYS  33           H        LYS  33  -3.078   6.856   2.424
  223    HA   LYS  33           HA       LYS  33  -0.951   8.475   1.910
  224    HB2  LYS  33           1HB      LYS  33  -2.460   7.939   4.449
  225    HB3  LYS  33           2HB      LYS  33  -1.123   9.081   4.436
  226    HG2  LYS  33           1HG      LYS  33  -3.085  10.349   4.136
  227    HG3  LYS  33           2HG      LYS  33  -2.307  10.266   2.553
  228    HD2  LYS  33           1HD      LYS  33  -3.828   8.496   1.874
  229    HD3  LYS  33           2HD      LYS  33  -4.574   8.498   3.474
  230    HE2  LYS  33           1HE      LYS  33  -4.478  11.049   1.943
  231    HE3  LYS  33           2HE      LYS  33  -5.638   9.817   1.450
  232    HZ1  LYS  33           3HZ      LYS  33  -6.170  11.634   3.292
  233    HZ2  LYS  33           1HZ      LYS  33  -5.523  10.433   4.293
  234    HZ3  LYS  33           2HZ      LYS  33  -6.858  10.089   3.313
  235    H    THR  34           H        THR  34  -1.007   5.928   4.404
  236    HA   THR  34           HA       THR  34   1.502   6.140   5.440
  237    HB   THR  34           HB       THR  34  -0.249   4.439   6.082
  238    HG1  THR  34           HG1      THR  34   2.430   3.530   5.713
  239   HG21  THR  34          3HG2      THR  34   0.989   2.449   4.289
  240   HG22  THR  34          1HG2      THR  34  -0.108   3.597   3.522
  241   HG23  THR  34          2HG2      THR  34  -0.676   2.587   4.852
  242    H    HIS  35           H        HIS  35   0.618   4.912   2.287
  243    HA   HIS  35           HA       HIS  35   3.268   3.901   1.729
  244    HB2  HIS  35           1HB      HIS  35   0.774   4.179   0.051
  245    HB3  HIS  35           2HB      HIS  35   2.298   3.576  -0.595
  246    HD1  HIS  35           HD1      HIS  35   3.032   1.840   1.951
  247    HD2  HIS  35           HD2      HIS  35  -0.587   1.783  -0.089
  248    HE1  HIS  35           HE1      HIS  35   2.011  -0.402   2.456
  249    H    THR  36           H        THR  36   4.700   4.737   0.174
  250    HA   THR  36           HA       THR  36   4.554   7.638  -0.090
  251    HB   THR  36           HB       THR  36   6.904   7.472  -0.868
  252    HG1  THR  36           HG1      THR  36   6.789   5.341  -1.737
  253   HG21  THR  36          3HG2      THR  36   7.790   7.234   1.249
  254   HG22  THR  36          1HG2      THR  36   6.752   5.866   1.647
  255   HG23  THR  36          2HG2      THR  36   6.088   7.499   1.622
  256    H    GLY  37           H        GLY  37   4.858   8.722  -2.085
  257    HA2  GLY  37           1HA      GLY  37   4.999   7.330  -4.571
  258    HA3  GLY  37           2HA      GLY  37   3.352   7.833  -4.220
  259    H    GLU  38           H        GLU  38   6.500   9.410  -3.685
  260    HA   GLU  38           HA       GLU  38   5.445  11.754  -5.118
  261    HB2  GLU  38           1HB      GLU  38   6.033  12.088  -2.725
  262    HB3  GLU  38           2HB      GLU  38   7.693  11.646  -3.100
  263    HG2  GLU  38           1HG      GLU  38   8.067  13.587  -4.321
  264    HG3  GLU  38           2HG      GLU  38   6.345  13.901  -4.530
  265    H    LYS  39           H        LYS  39   6.115  11.703  -7.168
  266    HA   LYS  39           HA       LYS  39   8.932  11.017  -7.696
  267    HB2  LYS  39           1HB      LYS  39   6.467  10.705  -9.406
  268    HB3  LYS  39           2HB      LYS  39   8.095  10.596 -10.065
  269    HG2  LYS  39           1HG      LYS  39   7.563   8.388  -9.690
  270    HG3  LYS  39           2HG      LYS  39   8.456   8.809  -8.227
  271    HD2  LYS  39           1HD      LYS  39   6.488   8.966  -6.945
  272    HD3  LYS  39           2HD      LYS  39   5.460   9.009  -8.380
  273    HE2  LYS  39           1HE      LYS  39   7.149   6.641  -7.590
  274    HE3  LYS  39           2HE      LYS  39   5.455   6.832  -7.138
  275    HZ1  LYS  39           3HZ      LYS  39   5.892   7.210  -9.941
  276    HZ2  LYS  39           1HZ      LYS  39   4.796   6.194  -9.149
  277    HZ3  LYS  39           2HZ      LYS  39   6.383   5.677  -9.423
  278    HA   PRO  40           HA       PRO  40   8.577  15.526  -8.570
  279    HB2  PRO  40           1HB      PRO  40  11.079  16.108  -7.690
  280    HB3  PRO  40           2HB      PRO  40   9.681  16.007  -6.613
  281    HG2  PRO  40           1HG      PRO  40  11.805  13.969  -7.157
  282    HG3  PRO  40           2HG      PRO  40  11.080  14.443  -5.610
  283    HD2  PRO  40           1HD      PRO  40  10.339  12.204  -6.940
  284    HD3  PRO  40           2HD      PRO  40   9.207  13.142  -5.945
  285    H    SER  41           H        SER  41   9.359  16.614 -10.328
  286    HA   SER  41           HA       SER  41  10.134  16.711 -12.489
  287    HB2  SER  41           1HB      SER  41  12.622  16.709 -12.594
  288    HB3  SER  41           2HB      SER  41  11.994  17.675 -11.259
  289    HG   SER  41           HG       SER  41  13.379  15.252 -11.216
  290    H    GLY  42           H        GLY  42   9.012  14.182 -11.924
  291    HA2  GLY  42           1HA      GLY  42  10.189  12.655 -14.043
  292    HA3  GLY  42           2HA      GLY  42  10.483  11.932 -12.469
  293    HA   PRO  43           HA       PRO  43   5.683  11.909 -13.123
  294    HB2  PRO  43           1HB      PRO  43   4.812  12.508 -15.624
  295    HB3  PRO  43           2HB      PRO  43   5.014  13.726 -14.359
  296    HG2  PRO  43           1HG      PRO  43   6.843  13.025 -16.623
  297    HG3  PRO  43           2HG      PRO  43   6.384  14.625 -16.009
  298    HD2  PRO  43           1HD      PRO  43   8.739  13.445 -15.382
  299    HD3  PRO  43           2HD      PRO  43   7.883  14.523 -14.261
  300    H    SER  44           H        SER  44   8.152  10.529 -14.819
  301    HA   SER  44           HA       SER  44   6.857   8.759 -16.581
  302    HB2  SER  44           1HB      SER  44   8.929   7.525 -16.621
  303    HB3  SER  44           2HB      SER  44   9.319   9.243 -16.543
  304    HG   SER  44           HG       SER  44   9.278   8.696 -14.107
  305    H    SER  45           H        SER  45   6.284   6.579 -16.358
  306    HA   SER  45           HA       SER  45   5.153   4.887 -15.324
  307    HB2  SER  45           1HB      SER  45   7.627   5.276 -13.684
  308    HB3  SER  45           2HB      SER  45   6.412   4.119 -13.139
  309    HG   SER  45           HG       SER  45   7.072   3.944 -15.810
  310    H    GLY  46           H        GLY  46   4.022   7.374 -14.811
  311    HA2  GLY  46           1HA      GLY  46   2.147   7.897 -13.480
  312    HA3  GLY  46           2HA      GLY  46   2.762   6.823 -12.232
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1   1.811 -28.422   2.830
    2    HA2  GLY   1           1HA      GLY   1   0.928 -30.744   3.629
    3    HA3  GLY   1           2HA      GLY   1   1.450 -30.128   5.190
    4    H    SER   2           H        SER   2   0.444 -28.145   5.972
    5    HA   SER   2           HA       SER   2  -2.327 -27.915   5.001
    6    HB2  SER   2           1HB      SER   2  -2.351 -28.748   7.237
    7    HB3  SER   2           2HB      SER   2  -1.156 -27.564   7.763
    8    HG   SER   2           HG       SER   2  -2.884 -26.496   8.338
    9    H    SER   3           H        SER   3  -3.218 -25.915   4.640
   10    HA   SER   3           HA       SER   3  -1.329 -23.761   4.210
   11    HB2  SER   3           1HB      SER   3  -3.231 -22.618   3.125
   12    HB3  SER   3           2HB      SER   3  -2.997 -24.243   2.483
   13    HG   SER   3           HG       SER   3  -5.205 -23.275   3.423
   14    H    GLY   4           H        GLY   4  -4.385 -24.191   5.996
   15    HA2  GLY   4           1HA      GLY   4  -4.894 -23.353   8.117
   16    HA3  GLY   4           2HA      GLY   4  -3.409 -22.415   8.078
   17    H    SER   5           H        SER   5  -3.444 -20.628   6.337
   18    HA   SER   5           HA       SER   5  -5.750 -18.990   6.901
   19    HB2  SER   5           1HB      SER   5  -3.183 -18.490   5.389
   20    HB3  SER   5           2HB      SER   5  -4.465 -17.286   5.515
   21    HG   SER   5           HG       SER   5  -3.926 -16.920   7.522
   22    H    SER   6           H        SER   6  -7.496 -18.825   5.673
   23    HA   SER   6           HA       SER   6  -7.280 -19.222   2.782
   24    HB2  SER   6           1HB      SER   6  -8.876 -20.888   4.674
   25    HB3  SER   6           2HB      SER   6  -9.588 -20.507   3.106
   26    HG   SER   6           HG       SER   6  -6.966 -21.530   3.336
   27    H    GLY   7           H        GLY   7  -8.203 -17.566   1.782
   28    HA2  GLY   7           1HA      GLY   7 -10.443 -16.468   1.463
   29    HA3  GLY   7           2HA      GLY   7 -10.369 -16.127   3.186
   30    H    THR   8           H        THR   8  -8.033 -15.807   0.513
   31    HA   THR   8           HA       THR   8  -6.578 -13.699   1.322
   32    HB   THR   8           HB       THR   8  -6.171 -14.754  -0.827
   33    HG1  THR   8           HG1      THR   8  -6.147 -12.595  -2.087
   34   HG21  THR   8          3HG2      THR   8  -8.415 -15.100  -1.620
   35   HG22  THR   8          1HG2      THR   8  -7.557 -14.109  -2.799
   36   HG23  THR   8          2HG2      THR   8  -8.706 -13.362  -1.690
   37    H    GLY   9           H        GLY   9  -9.838 -13.505  -0.032
   38    HA2  GLY   9           1HA      GLY   9 -11.239 -11.735   1.020
   39    HA3  GLY   9           2HA      GLY   9  -9.885 -10.651   0.737
   40    H    GLU  10           H        GLU  10 -12.789 -10.818  -0.222
   41    HA   GLU  10           HA       GLU  10 -12.161 -10.342  -3.056
   42    HB2  GLU  10           1HB      GLU  10 -14.271 -11.350  -3.719
   43    HB3  GLU  10           2HB      GLU  10 -13.301 -12.513  -2.826
   44    HG2  GLU  10           1HG      GLU  10 -14.631 -12.148  -0.840
   45    HG3  GLU  10           2HG      GLU  10 -15.565 -10.904  -1.668
   46    H    LYS  11           H        LYS  11 -12.199  -8.349  -1.137
   47    HA   LYS  11           HA       LYS  11 -14.797  -7.055  -1.224
   48    HB2  LYS  11           1HB      LYS  11 -12.186  -6.486   0.129
   49    HB3  LYS  11           2HB      LYS  11 -13.368  -5.195  -0.048
   50    HG2  LYS  11           1HG      LYS  11 -14.830  -6.141   1.421
   51    HG3  LYS  11           2HG      LYS  11 -14.289  -7.785   1.074
   52    HD2  LYS  11           1HD      LYS  11 -12.373  -5.918   2.376
   53    HD3  LYS  11           2HD      LYS  11 -13.691  -6.573   3.351
   54    HE2  LYS  11           1HE      LYS  11 -12.985  -8.858   2.512
   55    HE3  LYS  11           2HE      LYS  11 -11.535  -8.076   1.887
   56    HZ1  LYS  11           3HZ      LYS  11 -12.299  -8.641   4.640
   57    HZ2  LYS  11           1HZ      LYS  11 -11.490  -7.181   4.368
   58    HZ3  LYS  11           2HZ      LYS  11 -10.769  -8.643   3.919
   59    HA   PRO  12           HA       PRO  12 -14.092  -4.433  -4.671
   60    HB2  PRO  12           1HB      PRO  12 -15.276  -2.124  -3.873
   61    HB3  PRO  12           2HB      PRO  12 -16.191  -3.571  -4.313
   62    HG2  PRO  12           1HG      PRO  12 -15.452  -2.549  -1.598
   63    HG3  PRO  12           2HG      PRO  12 -16.994  -3.223  -2.158
   64    HD2  PRO  12           1HD      PRO  12 -15.203  -4.670  -0.733
   65    HD3  PRO  12           2HD      PRO  12 -16.259  -5.399  -1.961
   66    H    TYR  13           H        TYR  13 -12.693  -3.759  -1.653
   67    HA   TYR  13           HA       TYR  13 -10.927  -1.748  -2.884
   68    HB2  TYR  13           1HB      TYR  13 -11.655  -1.856   0.046
   69    HB3  TYR  13           2HB      TYR  13 -10.739  -0.601  -0.780
   70    HD1  TYR  13           HD1      TYR  13 -11.973   0.724  -2.620
   71    HD2  TYR  13           HD2      TYR  13 -13.960  -1.637   0.309
   72    HE1  TYR  13           HE1      TYR  13 -14.049   1.980  -3.024
   73    HE2  TYR  13           HE2      TYR  13 -16.042  -0.389  -0.088
   74    HH   TYR  13           HH       TYR  13 -17.086   0.983  -1.703
   75    H    GLU  14           H        GLU  14  -8.987  -2.600  -3.198
   76    HA   GLU  14           HA       GLU  14  -7.732  -4.116  -1.039
   77    HB2  GLU  14           1HB      GLU  14  -8.814  -5.685  -2.739
   78    HB3  GLU  14           2HB      GLU  14  -7.605  -5.112  -3.880
   79    HG2  GLU  14           1HG      GLU  14  -5.965  -5.781  -1.917
   80    HG3  GLU  14           2HG      GLU  14  -7.300  -6.856  -1.504
   81    H    CYS  15           H        CYS  15  -5.641  -3.612  -0.758
   82    HA   CYS  15           HA       CYS  15  -4.496  -1.532  -2.383
   83    HB2  CYS  15           1HB      CYS  15  -4.285  -1.898   0.190
   84    HB3  CYS  15           2HB      CYS  15  -2.992  -3.011  -0.246
   85    H    LYS  16           H        LYS  16  -2.207  -1.703  -3.145
   86    HA   LYS  16           HA       LYS  16  -1.802  -4.311  -4.445
   87    HB2  LYS  16           1HB      LYS  16  -2.115  -2.023  -5.727
   88    HB3  LYS  16           2HB      LYS  16  -0.407  -1.829  -5.355
   89    HG2  LYS  16           1HG      LYS  16  -0.390  -2.795  -7.458
   90    HG3  LYS  16           2HG      LYS  16  -0.136  -4.172  -6.384
   91    HD2  LYS  16           1HD      LYS  16  -1.773  -5.037  -7.719
   92    HD3  LYS  16           2HD      LYS  16  -2.782  -4.271  -6.490
   93    HE2  LYS  16           1HE      LYS  16  -1.969  -2.948  -9.073
   94    HE3  LYS  16           2HE      LYS  16  -3.483  -3.823  -8.849
   95    HZ1  LYS  16           3HZ      LYS  16  -3.938  -1.547  -8.499
   96    HZ2  LYS  16           1HZ      LYS  16  -2.607  -1.348  -7.474
   97    HZ3  LYS  16           2HZ      LYS  16  -3.937  -2.261  -6.966
   98    H    VAL  17           H        VAL  17  -0.165  -1.713  -2.703
   99    HA   VAL  17           HA       VAL  17   2.427  -2.829  -2.767
  100    HB   VAL  17           HB       VAL  17   1.206  -0.958  -0.732
  101   HG11  VAL  17          1HG1      VAL  17   4.046  -1.819  -1.217
  102   HG12  VAL  17          2HG1      VAL  17   3.633  -0.336  -0.355
  103   HG13  VAL  17          3HG1      VAL  17   3.120  -1.899   0.281
  104   HG21  VAL  17          3HG2      VAL  17   1.264  -0.223  -3.153
  105   HG22  VAL  17          1HG2      VAL  17   2.095   0.827  -2.005
  106   HG23  VAL  17          2HG2      VAL  17   3.022  -0.267  -3.030
  107    H    CYS  18           H        CYS  18   0.269  -2.603   0.065
  108    HA   CYS  18           HA       CYS  18   1.649  -4.805   1.333
  109    HB2  CYS  18           1HB      CYS  18   0.287  -4.325   3.262
  110    HB3  CYS  18           2HB      CYS  18   0.863  -2.799   2.599
  111    H    SER  19           H        SER  19  -1.096  -4.374  -0.652
  112    HA   SER  19           HA       SER  19  -2.652  -5.814  -1.476
  113    HB2  SER  19           1HB      SER  19  -0.539  -7.644  -0.454
  114    HB3  SER  19           2HB      SER  19  -2.109  -8.354  -0.827
  115    HG   SER  19           HG       SER  19  -1.846  -7.895  -2.908
  116    H    LYS  20           H        LYS  20  -3.316  -4.528   0.844
  117    HA   LYS  20           HA       LYS  20  -4.700  -6.582   2.438
  118    HB2  LYS  20           1HB      LYS  20  -3.040  -4.806   3.458
  119    HB3  LYS  20           2HB      LYS  20  -4.440  -3.747   3.352
  120    HG2  LYS  20           1HG      LYS  20  -5.696  -5.574   4.619
  121    HG3  LYS  20           2HG      LYS  20  -4.102  -6.245   4.972
  122    HD2  LYS  20           1HD      LYS  20  -3.435  -4.161   6.030
  123    HD3  LYS  20           2HD      LYS  20  -4.990  -3.434   5.620
  124    HE2  LYS  20           1HE      LYS  20  -4.984  -4.142   7.937
  125    HE3  LYS  20           2HE      LYS  20  -6.122  -5.116   7.008
  126    HZ1  LYS  20           3HZ      LYS  20  -4.285  -6.132   8.656
  127    HZ2  LYS  20           1HZ      LYS  20  -3.440  -6.192   7.191
  128    HZ3  LYS  20           2HZ      LYS  20  -4.933  -6.973   7.339
  129    H    ALA  21           H        ALA  21  -6.854  -6.681   2.376
  130    HA   ALA  21           HA       ALA  21  -8.287  -4.704   0.779
  131    HB1  ALA  21           3HB      ALA  21  -9.280  -6.548   0.031
  132    HB2  ALA  21           1HB      ALA  21  -8.590  -7.523   1.329
  133    HB3  ALA  21           2HB      ALA  21 -10.101  -6.650   1.589
  134    H    PHE  22           H        PHE  22 -10.254  -3.739   1.507
  135    HA   PHE  22           HA       PHE  22 -10.627  -3.700   4.420
  136    HB2  PHE  22           1HB      PHE  22 -10.668  -1.218   2.695
  137    HB3  PHE  22           2HB      PHE  22 -10.818  -1.296   4.447
  138    HD1  PHE  22           HD1      PHE  22  -8.477  -1.991   1.654
  139    HD2  PHE  22           HD2      PHE  22  -8.933  -1.161   5.804
  140    HE1  PHE  22           HE1      PHE  22  -6.039  -1.737   1.868
  141    HE2  PHE  22           HE2      PHE  22  -6.496  -0.906   6.024
  142    HZ   PHE  22           HZ       PHE  22  -5.046  -1.193   4.054
  143    H    THR  23           H        THR  23 -12.720  -2.367   4.915
  144    HA   THR  23           HA       THR  23 -14.820  -3.531   3.245
  145    HB   THR  23           HB       THR  23 -16.344  -2.984   5.105
  146    HG1  THR  23           HG1      THR  23 -14.162  -2.321   6.742
  147   HG21  THR  23          3HG2      THR  23 -14.644  -4.321   6.848
  148   HG22  THR  23          1HG2      THR  23 -14.083  -4.795   5.246
  149   HG23  THR  23          2HG2      THR  23 -15.766  -5.058   5.705
  150    H    GLN  24           H        GLN  24 -13.866  -0.415   4.651
  151    HA   GLN  24           HA       GLN  24 -15.703   0.911   2.769
  152    HB2  GLN  24           1HB      GLN  24 -14.673   1.790   5.465
  153    HB3  GLN  24           2HB      GLN  24 -15.497   2.876   4.355
  154    HG2  GLN  24           1HG      GLN  24 -16.697   0.325   5.397
  155    HG3  GLN  24           2HG      GLN  24 -16.934   1.904   6.143
  156   HE21  GLN  24          1HE2      GLN  24 -18.837   2.705   5.661
  157   HE22  GLN  24          2HE2      GLN  24 -19.643   2.587   4.137
  158    H    LYS  25           H        LYS  25 -14.901   2.278   1.290
  159    HA   LYS  25           HA       LYS  25 -12.245   2.295   0.552
  160    HB2  LYS  25           1HB      LYS  25 -14.188   3.045  -0.844
  161    HB3  LYS  25           2HB      LYS  25 -14.193   4.553   0.061
  162    HG2  LYS  25           1HG      LYS  25 -12.004   5.113  -0.752
  163    HG3  LYS  25           2HG      LYS  25 -11.852   3.540  -1.538
  164    HD2  LYS  25           1HD      LYS  25 -13.681   4.082  -3.038
  165    HD3  LYS  25           2HD      LYS  25 -13.928   5.623  -2.214
  166    HE2  LYS  25           1HE      LYS  25 -12.669   6.281  -4.021
  167    HE3  LYS  25           2HE      LYS  25 -11.413   6.008  -2.815
  168    HZ1  LYS  25           3HZ      LYS  25 -11.679   4.805  -5.316
  169    HZ2  LYS  25           1HZ      LYS  25 -11.923   3.596  -4.157
  170    HZ3  LYS  25           2HZ      LYS  25 -10.500   4.509  -4.139
  171    H    ALA  26           H        ALA  26 -13.979   4.779   2.421
  172    HA   ALA  26           HA       ALA  26 -12.134   6.699   2.795
  173    HB1  ALA  26           3HB      ALA  26 -13.910   5.476   4.899
  174    HB2  ALA  26           1HB      ALA  26 -13.023   6.986   5.111
  175    HB3  ALA  26           2HB      ALA  26 -14.264   6.860   3.864
  176    H    HIS  27           H        HIS  27 -12.115   3.535   4.366
  177    HA   HIS  27           HA       HIS  27  -9.877   4.075   6.041
  178    HB2  HIS  27           1HB      HIS  27 -11.254   1.542   5.168
  179    HB3  HIS  27           2HB      HIS  27  -9.809   1.508   6.175
  180    HD1  HIS  27           HD1      HIS  27 -12.550   0.453   7.177
  181    HD2  HIS  27           HD2      HIS  27 -11.073   4.268   7.900
  182    HE1  HIS  27           HE1      HIS  27 -13.735   1.251   9.246
  183    H    LEU  28           H        LEU  28 -10.266   2.478   2.902
  184    HA   LEU  28           HA       LEU  28  -7.607   1.642   2.585
  185    HB2  LEU  28           1HB      LEU  28  -9.289   0.735   1.172
  186    HB3  LEU  28           2HB      LEU  28  -9.751   2.334   0.592
  187    HG   LEU  28           HG       LEU  28  -7.349   2.406  -0.383
  188   HD11  LEU  28          1HD1      LEU  28  -7.256  -0.351  -0.974
  189   HD12  LEU  28          2HD1      LEU  28  -7.386  -0.198   0.778
  190   HD13  LEU  28          3HD1      LEU  28  -6.080   0.616  -0.083
  191   HD21  LEU  28          3HD2      LEU  28  -9.544   2.229  -1.613
  192   HD22  LEU  28          1HD2      LEU  28  -9.295   0.483  -1.636
  193   HD23  LEU  28          2HD2      LEU  28  -8.144   1.549  -2.442
  194    H    ALA  29           H        ALA  29  -9.229   4.506   1.207
  195    HA   ALA  29           HA       ALA  29  -7.063   5.694  -0.008
  196    HB1  ALA  29           3HB      ALA  29  -9.152   6.659  -0.422
  197    HB2  ALA  29           1HB      ALA  29  -9.496   6.870   1.296
  198    HB3  ALA  29           2HB      ALA  29  -8.285   7.882   0.507
  199    H    GLN  30           H        GLN  30  -8.200   6.262   3.324
  200    HA   GLN  30           HA       GLN  30  -6.193   8.039   4.089
  201    HB2  GLN  30           1HB      GLN  30  -8.380   7.240   5.306
  202    HB3  GLN  30           2HB      GLN  30  -7.300   6.070   6.052
  203    HG2  GLN  30           1HG      GLN  30  -7.152   7.720   7.591
  204    HG3  GLN  30           2HG      GLN  30  -5.861   8.242   6.509
  205   HE21  GLN  30          1HE2      GLN  30  -6.549   9.775   4.775
  206   HE22  GLN  30          2HE2      GLN  30  -7.689  10.999   5.205
  207    H    HIS  31           H        HIS  31  -6.029   4.686   3.474
  208    HA   HIS  31           HA       HIS  31  -3.623   4.295   5.068
  209    HB2  HIS  31           1HB      HIS  31  -4.826   2.344   5.190
  210    HB3  HIS  31           2HB      HIS  31  -5.491   2.526   3.569
  211    HD1  HIS  31           HD1      HIS  31  -2.107   1.759   5.139
  212    HD2  HIS  31           HD2      HIS  31  -4.377   0.830   1.786
  213    HE1  HIS  31           HE1      HIS  31  -0.764   0.055   3.869
  214    H    GLN  32           H        GLN  32  -4.579   4.055   1.644
  215    HA   GLN  32           HA       GLN  32  -2.198   3.467   0.465
  216    HB2  GLN  32           1HB      GLN  32  -4.431   5.274  -0.414
  217    HB3  GLN  32           2HB      GLN  32  -3.017   5.030  -1.431
  218    HG2  GLN  32           1HG      GLN  32  -3.474   2.561  -1.279
  219    HG3  GLN  32           2HG      GLN  32  -5.011   2.976  -0.522
  220   HE21  GLN  32          1HE2      GLN  32  -6.310   4.625  -1.791
  221   HE22  GLN  32          2HE2      GLN  32  -6.388   4.387  -3.500
  222    H    LYS  33           H        LYS  33  -3.034   6.376   2.116
  223    HA   LYS  33           HA       LYS  33  -0.831   7.897   0.998
  224    HB2  LYS  33           1HB      LYS  33  -1.644   9.737   2.251
  225    HB3  LYS  33           2HB      LYS  33  -3.067   8.900   1.646
  226    HG2  LYS  33           1HG      LYS  33  -3.656   8.112   3.731
  227    HG3  LYS  33           2HG      LYS  33  -2.015   8.262   4.366
  228    HD2  LYS  33           1HD      LYS  33  -2.255  10.738   4.215
  229    HD3  LYS  33           2HD      LYS  33  -3.942  10.501   3.754
  230    HE2  LYS  33           1HE      LYS  33  -3.931  10.938   6.083
  231    HE3  LYS  33           2HE      LYS  33  -4.229   9.210   5.897
  232    HZ1  LYS  33           3HZ      LYS  33  -1.491   9.488   6.057
  233    HZ2  LYS  33           1HZ      LYS  33  -2.524   8.883   7.253
  234    HZ3  LYS  33           2HZ      LYS  33  -2.107  10.522   7.246
  235    H    THR  34           H        THR  34  -1.599   6.092   3.893
  236    HA   THR  34           HA       THR  34   0.457   7.023   5.560
  237    HB   THR  34           HB       THR  34  -1.574   5.408   6.041
  238    HG1  THR  34           HG1      THR  34  -0.596   5.899   7.865
  239   HG21  THR  34          3HG2      THR  34  -0.353   3.655   4.538
  240   HG22  THR  34          1HG2      THR  34  -1.152   3.133   6.020
  241   HG23  THR  34          2HG2      THR  34   0.598   3.352   5.992
  242    H    HIS  35           H        HIS  35   0.435   4.656   2.984
  243    HA   HIS  35           HA       HIS  35   2.770   3.262   3.500
  244    HB2  HIS  35           1HB      HIS  35   1.246   3.952   1.040
  245    HB3  HIS  35           2HB      HIS  35   2.884   3.339   0.829
  246    HD1  HIS  35           HD1      HIS  35   3.033   1.143   2.882
  247    HD2  HIS  35           HD2      HIS  35  -0.336   1.816   0.547
  248    HE1  HIS  35           HE1      HIS  35   1.788  -1.041   2.854
  249    H    THR  36           H        THR  36   4.675   4.113   4.014
  250    HA   THR  36           HA       THR  36   5.625   6.451   2.490
  251    HB   THR  36           HB       THR  36   6.478   5.589   5.261
  252    HG1  THR  36           HG1      THR  36   5.055   7.019   6.006
  253   HG21  THR  36          3HG2      THR  36   8.067   7.176   5.207
  254   HG22  THR  36          1HG2      THR  36   7.026   8.322   4.364
  255   HG23  THR  36          2HG2      THR  36   7.892   7.084   3.454
  256    H    GLY  37           H        GLY  37   7.489   6.303   1.376
  257    HA2  GLY  37           1HA      GLY  37   9.309   4.071   1.935
  258    HA3  GLY  37           2HA      GLY  37   8.639   4.211   0.316
  259    H    GLU  38           H        GLU  38   8.914   6.502  -0.643
  260    HA   GLU  38           HA       GLU  38  10.392   7.977  -1.555
  261    HB2  GLU  38           1HB      GLU  38  11.100   8.160   1.369
  262    HB3  GLU  38           2HB      GLU  38  11.837   9.196   0.155
  263    HG2  GLU  38           1HG      GLU  38   9.375   9.741  -0.482
  264    HG3  GLU  38           2HG      GLU  38   9.023   9.137   1.136
  265    H    LYS  39           H        LYS  39  11.163   5.247  -1.669
  266    HA   LYS  39           HA       LYS  39  13.942   5.573  -2.287
  267    HB2  LYS  39           1HB      LYS  39  14.761   3.759  -0.827
  268    HB3  LYS  39           2HB      LYS  39  14.171   5.138   0.092
  269    HG2  LYS  39           1HG      LYS  39  12.343   4.001   0.889
  270    HG3  LYS  39           2HG      LYS  39  12.324   2.867  -0.463
  271    HD2  LYS  39           1HD      LYS  39  13.061   1.643   1.428
  272    HD3  LYS  39           2HD      LYS  39  14.494   1.942   0.441
  273    HE2  LYS  39           1HE      LYS  39  15.101   2.369   2.699
  274    HE3  LYS  39           2HE      LYS  39  14.959   3.933   1.898
  275    HZ1  LYS  39           3HZ      LYS  39  13.886   4.124   3.975
  276    HZ2  LYS  39           1HZ      LYS  39  13.035   2.676   3.769
  277    HZ3  LYS  39           2HZ      LYS  39  12.648   4.026   2.826
  278    HA   PRO  40           HA       PRO  40  12.931   2.491  -5.248
  279    HB2  PRO  40           1HB      PRO  40  15.381   1.420  -5.719
  280    HB3  PRO  40           2HB      PRO  40  14.908   3.025  -6.290
  281    HG2  PRO  40           1HG      PRO  40  16.530   2.270  -3.890
  282    HG3  PRO  40           2HG      PRO  40  16.803   3.574  -5.059
  283    HD2  PRO  40           1HD      PRO  40  15.694   4.007  -2.627
  284    HD3  PRO  40           2HD      PRO  40  15.262   4.965  -4.058
  285    H    SER  41           H        SER  41  11.717   1.263  -3.579
  286    HA   SER  41           HA       SER  41  13.128  -1.004  -2.412
  287    HB2  SER  41           1HB      SER  41  10.328   0.077  -2.108
  288    HB3  SER  41           2HB      SER  41  10.804  -1.484  -1.441
  289    HG   SER  41           HG       SER  41  12.666   0.073  -0.633
  290    H    GLY  42           H        GLY  42  13.620  -2.177  -4.305
  291    HA2  GLY  42           1HA      GLY  42  13.220  -3.963  -5.709
  292    HA3  GLY  42           2HA      GLY  42  11.577  -4.020  -5.088
  293    HA   PRO  43           HA       PRO  43  12.042  -1.808  -9.368
  294    HB2  PRO  43           1HB      PRO  43  12.208  -3.886 -11.107
  295    HB3  PRO  43           2HB      PRO  43  13.630  -3.077 -10.438
  296    HG2  PRO  43           1HG      PRO  43  12.337  -5.642  -9.594
  297    HG3  PRO  43           2HG      PRO  43  14.060  -5.265  -9.779
  298    HD2  PRO  43           1HD      PRO  43  12.826  -5.298  -7.369
  299    HD3  PRO  43           2HD      PRO  43  14.176  -4.205  -7.735
  300    H    SER  44           H        SER  44  10.186  -4.097  -7.793
  301    HA   SER  44           HA       SER  44   8.187  -4.621  -9.739
  302    HB2  SER  44           1HB      SER  44   6.818  -5.351  -7.788
  303    HB3  SER  44           2HB      SER  44   8.426  -6.076  -7.810
  304    HG   SER  44           HG       SER  44   8.300  -3.697  -6.451
  305    H    SER  45           H        SER  45   7.909  -2.451 -10.593
  306    HA   SER  45           HA       SER  45   5.876  -0.978  -9.079
  307    HB2  SER  45           1HB      SER  45   6.900   1.173  -9.754
  308    HB3  SER  45           2HB      SER  45   7.969   0.230  -8.716
  309    HG   SER  45           HG       SER  45   9.235  -0.245 -10.430
  310    H    GLY  46           H        GLY  46   4.102  -1.062 -10.286
  311    HA2  GLY  46           1HA      GLY  46   4.332  -1.210 -13.196
  312    HA3  GLY  46           2HA      GLY  46   2.880  -1.508 -12.253
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1  -2.488 -18.476 -11.011
    2    HA2  GLY   1           1HA      GLY   1  -1.914 -17.745  -8.242
    3    HA3  GLY   1           2HA      GLY   1  -3.353 -18.569  -8.823
    4    H    SER   2           H        SER   2  -2.249 -19.530  -6.586
    5    HA   SER   2           HA       SER   2  -0.378 -21.651  -7.213
    6    HB2  SER   2           1HB      SER   2  -0.524 -20.246  -5.016
    7    HB3  SER   2           2HB      SER   2  -1.794 -21.389  -4.577
    8    HG   SER   2           HG       SER   2   0.749 -21.742  -4.266
    9    H    SER   3           H        SER   3  -0.955 -23.858  -6.110
   10    HA   SER   3           HA       SER   3  -3.106 -24.958  -7.581
   11    HB2  SER   3           1HB      SER   3  -2.612 -27.034  -6.242
   12    HB3  SER   3           2HB      SER   3  -1.214 -26.351  -7.071
   13    HG   SER   3           HG       SER   3  -0.921 -26.968  -4.796
   14    H    GLY   4           H        GLY   4  -5.088 -24.139  -7.081
   15    HA2  GLY   4           1HA      GLY   4  -6.937 -25.014  -5.567
   16    HA3  GLY   4           2HA      GLY   4  -5.958 -24.347  -4.269
   17    H    SER   5           H        SER   5  -8.659 -23.779  -5.884
   18    HA   SER   5           HA       SER   5  -8.314 -20.853  -5.792
   19    HB2  SER   5           1HB      SER   5  -8.668 -21.917  -8.104
   20    HB3  SER   5           2HB      SER   5 -10.316 -22.241  -7.568
   21    HG   SER   5           HG       SER   5  -9.144 -19.878  -8.322
   22    H    SER   6           H        SER   6  -9.293 -20.133  -4.022
   23    HA   SER   6           HA       SER   6 -11.813 -21.394  -3.180
   24    HB2  SER   6           1HB      SER   6 -11.374 -20.387  -0.968
   25    HB3  SER   6           2HB      SER   6 -10.046 -21.428  -1.483
   26    HG   SER   6           HG       SER   6  -9.922 -18.709  -2.119
   27    H    GLY   7           H        GLY   7 -10.323 -18.378  -4.119
   28    HA2  GLY   7           1HA      GLY   7 -11.191 -16.288  -4.521
   29    HA3  GLY   7           2HA      GLY   7 -12.625 -17.164  -5.034
   30    H    THR   8           H        THR   8 -11.159 -16.843  -1.815
   31    HA   THR   8           HA       THR   8 -13.767 -16.042  -0.771
   32    HB   THR   8           HB       THR   8 -12.676 -17.834   0.435
   33    HG1  THR   8           HG1      THR   8 -13.512 -15.588   1.524
   34   HG21  THR   8          3HG2      THR   8 -10.381 -15.897   0.618
   35   HG22  THR   8          1HG2      THR   8 -10.377 -17.544  -0.012
   36   HG23  THR   8          2HG2      THR   8 -10.548 -17.263   1.721
   37    H    GLY   9           H        GLY   9 -10.503 -14.826  -1.188
   38    HA2  GLY   9           1HA      GLY   9 -10.972 -12.455   0.394
   39    HA3  GLY   9           2HA      GLY   9  -9.544 -12.805  -0.569
   40    H    GLU  10           H        GLU  10 -13.001 -12.051  -1.002
   41    HA   GLU  10           HA       GLU  10 -12.243 -10.432  -3.343
   42    HB2  GLU  10           1HB      GLU  10 -14.501 -10.794  -4.195
   43    HB3  GLU  10           2HB      GLU  10 -13.695 -12.329  -3.901
   44    HG2  GLU  10           1HG      GLU  10 -14.895 -12.315  -1.644
   45    HG3  GLU  10           2HG      GLU  10 -15.897 -11.040  -2.334
   46    H    LYS  11           H        LYS  11 -12.295  -8.325  -2.981
   47    HA   LYS  11           HA       LYS  11 -14.510  -7.178  -1.463
   48    HB2  LYS  11           1HB      LYS  11 -11.618  -6.525  -0.866
   49    HB3  LYS  11           2HB      LYS  11 -13.023  -5.773  -0.122
   50    HG2  LYS  11           1HG      LYS  11 -12.475  -8.719   0.076
   51    HG3  LYS  11           2HG      LYS  11 -11.834  -7.546   1.229
   52    HD2  LYS  11           1HD      LYS  11 -14.766  -7.752   0.583
   53    HD3  LYS  11           2HD      LYS  11 -14.007  -8.695   1.867
   54    HE2  LYS  11           1HE      LYS  11 -13.630  -6.856   3.182
   55    HE3  LYS  11           2HE      LYS  11 -13.551  -5.755   1.807
   56    HZ1  LYS  11           3HZ      LYS  11 -15.827  -5.590   1.694
   57    HZ2  LYS  11           1HZ      LYS  11 -15.595  -5.711   3.366
   58    HZ3  LYS  11           2HZ      LYS  11 -16.098  -7.063   2.482
   59    HA   PRO  12           HA       PRO  12 -14.426  -4.097  -4.591
   60    HB2  PRO  12           1HB      PRO  12 -15.408  -1.961  -3.233
   61    HB3  PRO  12           2HB      PRO  12 -16.410  -3.334  -3.718
   62    HG2  PRO  12           1HG      PRO  12 -15.165  -2.743  -1.060
   63    HG3  PRO  12           2HG      PRO  12 -16.793  -3.342  -1.424
   64    HD2  PRO  12           1HD      PRO  12 -14.791  -4.970  -0.603
   65    HD3  PRO  12           2HD      PRO  12 -16.067  -5.510  -1.713
   66    H    TYR  13           H        TYR  13 -12.607  -3.732  -1.692
   67    HA   TYR  13           HA       TYR  13 -10.868  -1.788  -3.045
   68    HB2  TYR  13           1HB      TYR  13 -11.512  -1.664  -0.097
   69    HB3  TYR  13           2HB      TYR  13 -10.575  -0.507  -1.036
   70    HD1  TYR  13           HD1      TYR  13 -11.733   0.939  -2.710
   71    HD2  TYR  13           HD2      TYR  13 -13.882  -1.537   0.003
   72    HE1  TYR  13           HE1      TYR  13 -13.771   2.247  -3.140
   73    HE2  TYR  13           HE2      TYR  13 -15.926  -0.236  -0.421
   74    HH   TYR  13           HH       TYR  13 -15.919   2.750  -1.957
   75    H    GLU  14           H        GLU  14  -8.923  -2.645  -3.285
   76    HA   GLU  14           HA       GLU  14  -7.743  -4.170  -1.087
   77    HB2  GLU  14           1HB      GLU  14  -8.848  -5.635  -2.960
   78    HB3  GLU  14           2HB      GLU  14  -7.409  -5.209  -3.875
   79    HG2  GLU  14           1HG      GLU  14  -5.987  -6.236  -2.270
   80    HG3  GLU  14           2HG      GLU  14  -7.325  -6.463  -1.145
   81    H    CYS  15           H        CYS  15  -5.826  -3.336  -0.635
   82    HA   CYS  15           HA       CYS  15  -4.559  -1.398  -2.248
   83    HB2  CYS  15           1HB      CYS  15  -4.332  -1.581   0.236
   84    HB3  CYS  15           2HB      CYS  15  -3.326  -3.006  -0.003
   85    H    LYS  16           H        LYS  16  -2.279  -1.555  -3.010
   86    HA   LYS  16           HA       LYS  16  -1.862  -4.137  -4.358
   87    HB2  LYS  16           1HB      LYS  16  -2.193  -1.850  -5.615
   88    HB3  LYS  16           2HB      LYS  16  -0.497  -1.616  -5.216
   89    HG2  LYS  16           1HG      LYS  16   0.179  -3.443  -6.508
   90    HG3  LYS  16           2HG      LYS  16  -1.457  -4.101  -6.591
   91    HD2  LYS  16           1HD      LYS  16  -0.968  -1.390  -7.716
   92    HD3  LYS  16           2HD      LYS  16  -0.381  -2.787  -8.621
   93    HE2  LYS  16           1HE      LYS  16  -2.632  -3.743  -8.602
   94    HE3  LYS  16           2HE      LYS  16  -3.218  -2.354  -7.687
   95    HZ1  LYS  16           3HZ      LYS  16  -3.509  -1.258  -9.572
   96    HZ2  LYS  16           1HZ      LYS  16  -3.012  -2.615 -10.450
   97    HZ3  LYS  16           2HZ      LYS  16  -1.880  -1.447  -9.988
   98    H    VAL  17           H        VAL  17  -0.363  -1.685  -2.366
   99    HA   VAL  17           HA       VAL  17   2.293  -2.662  -2.516
  100    HB   VAL  17           HB       VAL  17   0.969  -1.043  -0.336
  101   HG11  VAL  17          1HG1      VAL  17   3.307  -0.371   0.211
  102   HG12  VAL  17          2HG1      VAL  17   2.947  -2.066   0.546
  103   HG13  VAL  17          3HG1      VAL  17   3.873  -1.627  -0.890
  104   HG21  VAL  17          3HG2      VAL  17   1.126   0.720  -1.680
  105   HG22  VAL  17          1HG2      VAL  17   2.834   0.393  -1.974
  106   HG23  VAL  17          2HG2      VAL  17   1.604  -0.363  -2.986
  107    H    CYS  18           H        CYS  18  -0.050  -2.884   0.169
  108    HA   CYS  18           HA       CYS  18   1.368  -5.280   1.107
  109    HB2  CYS  18           1HB      CYS  18   0.182  -4.881   3.254
  110    HB3  CYS  18           2HB      CYS  18   1.209  -3.533   2.777
  111    H    SER  19           H        SER  19  -0.715  -5.038  -1.076
  112    HA   SER  19           HA       SER  19  -2.757  -5.953  -1.677
  113    HB2  SER  19           1HB      SER  19  -2.656  -8.433  -1.511
  114    HB3  SER  19           2HB      SER  19  -1.152  -7.729  -2.106
  115    HG   SER  19           HG       SER  19  -0.771  -9.306  -0.499
  116    H    LYS  20           H        LYS  20  -2.974  -4.667   0.849
  117    HA   LYS  20           HA       LYS  20  -4.362  -6.401   2.671
  118    HB2  LYS  20           1HB      LYS  20  -3.095  -4.440   3.458
  119    HB3  LYS  20           2HB      LYS  20  -4.202  -3.382   2.593
  120    HG2  LYS  20           1HG      LYS  20  -6.020  -4.015   4.018
  121    HG3  LYS  20           2HG      LYS  20  -5.032  -5.251   4.801
  122    HD2  LYS  20           1HD      LYS  20  -4.044  -2.447   4.826
  123    HD3  LYS  20           2HD      LYS  20  -5.398  -2.857   5.881
  124    HE2  LYS  20           1HE      LYS  20  -3.671  -3.340   7.288
  125    HE3  LYS  20           2HE      LYS  20  -3.832  -4.902   6.487
  126    HZ1  LYS  20           3HZ      LYS  20  -1.926  -2.782   5.660
  127    HZ2  LYS  20           1HZ      LYS  20  -2.030  -4.349   5.030
  128    HZ3  LYS  20           2HZ      LYS  20  -1.520  -4.110   6.625
  129    H    ALA  21           H        ALA  21  -6.603  -5.933   3.388
  130    HA   ALA  21           HA       ALA  21  -8.305  -5.044   1.153
  131    HB1  ALA  21           3HB      ALA  21  -8.406  -7.559   2.732
  132    HB2  ALA  21           1HB      ALA  21  -9.930  -6.832   2.222
  133    HB3  ALA  21           2HB      ALA  21  -8.722  -7.283   1.019
  134    H    PHE  22           H        PHE  22  -9.983  -3.732   1.652
  135    HA   PHE  22           HA       PHE  22 -10.514  -3.223   4.503
  136    HB2  PHE  22           1HB      PHE  22 -10.573  -1.085   2.374
  137    HB3  PHE  22           2HB      PHE  22 -10.641  -0.873   4.120
  138    HD1  PHE  22           HD1      PHE  22  -8.478  -1.581   1.256
  139    HD2  PHE  22           HD2      PHE  22  -8.647  -0.966   5.465
  140    HE1  PHE  22           HE1      PHE  22  -6.034  -1.303   1.311
  141    HE2  PHE  22           HE2      PHE  22  -6.204  -0.686   5.525
  142    HZ   PHE  22           HZ       PHE  22  -4.894  -0.853   3.447
  143    H    THR  23           H        THR  23 -12.636  -2.641   5.053
  144    HA   THR  23           HA       THR  23 -14.648  -3.793   3.365
  145    HB   THR  23           HB       THR  23 -14.835  -4.063   5.769
  146    HG1  THR  23           HG1      THR  23 -16.791  -3.917   4.550
  147   HG21  THR  23          3HG2      THR  23 -14.756  -2.392   7.300
  148   HG22  THR  23          1HG2      THR  23 -15.601  -1.249   6.257
  149   HG23  THR  23          2HG2      THR  23 -13.881  -1.558   6.016
  150    H    GLN  24           H        GLN  24 -13.715  -0.532   4.326
  151    HA   GLN  24           HA       GLN  24 -15.605   0.516   2.324
  152    HB2  GLN  24           1HB      GLN  24 -14.914   1.550   5.057
  153    HB3  GLN  24           2HB      GLN  24 -15.503   2.641   3.810
  154    HG2  GLN  24           1HG      GLN  24 -17.408   0.840   3.604
  155    HG3  GLN  24           2HG      GLN  24 -16.917   0.466   5.255
  156   HE21  GLN  24          1HE2      GLN  24 -17.548   1.768   6.872
  157   HE22  GLN  24          2HE2      GLN  24 -18.466   3.217   6.666
  158    H    LYS  25           H        LYS  25 -14.950   2.476   1.246
  159    HA   LYS  25           HA       LYS  25 -12.255   2.411   0.396
  160    HB2  LYS  25           1HB      LYS  25 -12.808   4.273  -1.001
  161    HB3  LYS  25           2HB      LYS  25 -14.201   3.199  -0.973
  162    HG2  LYS  25           1HG      LYS  25 -15.264   5.180  -0.683
  163    HG3  LYS  25           2HG      LYS  25 -14.930   4.797   1.008
  164    HD2  LYS  25           1HD      LYS  25 -14.233   7.006   0.825
  165    HD3  LYS  25           2HD      LYS  25 -12.730   6.101   0.627
  166    HE2  LYS  25           1HE      LYS  25 -13.111   6.246  -1.861
  167    HE3  LYS  25           2HE      LYS  25 -14.417   7.379  -1.516
  168    HZ1  LYS  25           3HZ      LYS  25 -12.587   8.727  -1.908
  169    HZ2  LYS  25           1HZ      LYS  25 -11.519   7.718  -1.069
  170    HZ3  LYS  25           2HZ      LYS  25 -12.642   8.653  -0.219
  171    H    ALA  26           H        ALA  26 -14.017   4.482   2.643
  172    HA   ALA  26           HA       ALA  26 -12.283   6.540   3.075
  173    HB1  ALA  26           3HB      ALA  26 -13.092   6.554   5.432
  174    HB2  ALA  26           1HB      ALA  26 -14.377   6.454   4.228
  175    HB3  ALA  26           2HB      ALA  26 -13.887   5.011   5.116
  176    H    HIS  27           H        HIS  27 -12.029   3.254   4.356
  177    HA   HIS  27           HA       HIS  27  -9.758   3.759   5.987
  178    HB2  HIS  27           1HB      HIS  27 -11.011   1.246   4.898
  179    HB3  HIS  27           2HB      HIS  27  -9.527   1.201   5.846
  180    HD1  HIS  27           HD1      HIS  27 -12.886   0.580   6.350
  181    HD2  HIS  27           HD2      HIS  27 -10.153   2.971   8.370
  182    HE1  HIS  27           HE1      HIS  27 -13.847   0.903   8.651
  183    H    LEU  28           H        LEU  28 -10.149   2.374   2.740
  184    HA   LEU  28           HA       LEU  28  -7.427   1.841   2.278
  185    HB2  LEU  28           1HB      LEU  28  -9.003   0.797   0.873
  186    HB3  LEU  28           2HB      LEU  28  -9.758   2.332   0.449
  187    HG   LEU  28           HG       LEU  28  -7.459   2.853  -0.655
  188   HD11  LEU  28          1HD1      LEU  28  -7.251  -0.012   0.009
  189   HD12  LEU  28          2HD1      LEU  28  -5.989   1.197  -0.226
  190   HD13  LEU  28          3HD1      LEU  28  -6.763   0.448  -1.622
  191   HD21  LEU  28          3HD2      LEU  28  -9.612   2.557  -1.824
  192   HD22  LEU  28          1HD2      LEU  28  -9.320   0.819  -1.877
  193   HD23  LEU  28          2HD2      LEU  28  -8.246   1.920  -2.741
  194    H    ALA  29           H        ALA  29  -9.407   4.526   1.006
  195    HA   ALA  29           HA       ALA  29  -7.521   6.025  -0.241
  196    HB1  ALA  29           3HB      ALA  29  -9.206   7.459  -0.410
  197    HB2  ALA  29           1HB      ALA  29 -10.117   6.467   0.727
  198    HB3  ALA  29           2HB      ALA  29  -9.137   7.810   1.317
  199    H    GLN  30           H        GLN  30  -8.329   6.324   3.222
  200    HA   GLN  30           HA       GLN  30  -6.286   8.168   3.820
  201    HB2  GLN  30           1HB      GLN  30  -8.271   7.756   5.251
  202    HB3  GLN  30           2HB      GLN  30  -7.606   6.186   5.682
  203    HG2  GLN  30           1HG      GLN  30  -7.193   7.805   7.431
  204    HG3  GLN  30           2HG      GLN  30  -5.677   7.277   6.702
  205   HE21  GLN  30          1HE2      GLN  30  -4.552   9.093   7.325
  206   HE22  GLN  30          2HE2      GLN  30  -4.822  10.648   6.623
  207    H    HIS  31           H        HIS  31  -6.410   4.638   3.977
  208    HA   HIS  31           HA       HIS  31  -3.990   4.160   5.261
  209    HB2  HIS  31           1HB      HIS  31  -5.252   2.243   5.008
  210    HB3  HIS  31           2HB      HIS  31  -5.674   2.613   3.339
  211    HD1  HIS  31           HD1      HIS  31  -2.572   1.595   5.298
  212    HD2  HIS  31           HD2      HIS  31  -4.297   1.130   1.547
  213    HE1  HIS  31           HE1      HIS  31  -1.055   0.025   4.051
  214    H    GLN  32           H        GLN  32  -4.570   4.102   1.738
  215    HA   GLN  32           HA       GLN  32  -2.119   3.725   0.729
  216    HB2  GLN  32           1HB      GLN  32  -4.205   5.716  -0.132
  217    HB3  GLN  32           2HB      GLN  32  -2.726   5.472  -1.052
  218    HG2  GLN  32           1HG      GLN  32  -3.409   2.974  -1.006
  219    HG3  GLN  32           2HG      GLN  32  -5.008   3.601  -0.612
  220   HE21  GLN  32          1HE2      GLN  32  -6.123   4.824  -2.138
  221   HE22  GLN  32          2HE2      GLN  32  -5.684   4.825  -3.809
  222    H    LYS  33           H        LYS  33  -3.201   6.650   2.337
  223    HA   LYS  33           HA       LYS  33  -1.281   8.479   1.698
  224    HB2  LYS  33           1HB      LYS  33  -2.346   7.953   4.480
  225    HB3  LYS  33           2HB      LYS  33  -1.598   9.446   3.930
  226    HG2  LYS  33           1HG      LYS  33  -3.986   8.418   2.482
  227    HG3  LYS  33           2HG      LYS  33  -4.200   9.204   4.047
  228    HD2  LYS  33           1HD      LYS  33  -3.088  11.196   3.237
  229    HD3  LYS  33           2HD      LYS  33  -2.742  10.409   1.696
  230    HE2  LYS  33           1HE      LYS  33  -4.614  11.690   1.212
  231    HE3  LYS  33           2HE      LYS  33  -5.302  10.101   1.544
  232    HZ1  LYS  33           3HZ      LYS  33  -5.077  12.196   3.624
  233    HZ2  LYS  33           1HZ      LYS  33  -6.014  10.788   3.658
  234    HZ3  LYS  33           2HZ      LYS  33  -6.434  12.057   2.623
  235    H    THR  34           H        THR  34  -1.012   6.024   4.266
  236    HA   THR  34           HA       THR  34   1.572   6.635   5.105
  237    HB   THR  34           HB       THR  34   0.104   5.107   6.344
  238    HG1  THR  34           HG1      THR  34   2.491   3.774   5.541
  239   HG21  THR  34          3HG2      THR  34  -0.882   3.353   5.388
  240   HG22  THR  34          1HG2      THR  34   0.680   2.675   4.932
  241   HG23  THR  34          2HG2      THR  34  -0.136   3.810   3.857
  242    H    HIS  35           H        HIS  35   0.453   4.802   2.348
  243    HA   HIS  35           HA       HIS  35   3.001   3.645   1.733
  244    HB2  HIS  35           1HB      HIS  35   0.368   3.842   0.310
  245    HB3  HIS  35           2HB      HIS  35   1.798   3.290  -0.557
  246    HD1  HIS  35           HD1      HIS  35   3.072   1.519   1.605
  247    HD2  HIS  35           HD2      HIS  35  -0.976   1.505   0.672
  248    HE1  HIS  35           HE1      HIS  35   2.218  -0.723   2.356
  249    H    THR  36           H        THR  36   4.675   4.803   1.065
  250    HA   THR  36           HA       THR  36   4.605   7.437   0.169
  251    HB   THR  36           HB       THR  36   6.919   7.005  -0.711
  252    HG1  THR  36           HG1      THR  36   7.611   4.763   0.162
  253   HG21  THR  36          3HG2      THR  36   7.255   5.794   1.862
  254   HG22  THR  36          1HG2      THR  36   5.966   6.994   1.944
  255   HG23  THR  36          2HG2      THR  36   7.568   7.458   1.371
  256    H    GLY  37           H        GLY  37   5.579   8.110  -2.032
  257    HA2  GLY  37           1HA      GLY  37   5.217   6.558  -4.336
  258    HA3  GLY  37           2HA      GLY  37   3.726   7.442  -4.044
  259    H    GLU  38           H        GLU  38   4.999   9.775  -2.923
  260    HA   GLU  38           HA       GLU  38   5.198  11.448  -5.039
  261    HB2  GLU  38           1HB      GLU  38   5.364  11.930  -2.492
  262    HB3  GLU  38           2HB      GLU  38   7.099  11.806  -2.743
  263    HG2  GLU  38           1HG      GLU  38   7.053  13.620  -4.318
  264    HG3  GLU  38           2HG      GLU  38   5.294  13.692  -4.238
  265    H    LYS  39           H        LYS  39   6.276  10.939  -6.857
  266    HA   LYS  39           HA       LYS  39   9.156  11.062  -6.808
  267    HB2  LYS  39           1HB      LYS  39   7.755   8.555  -7.753
  268    HB3  LYS  39           2HB      LYS  39   9.451   8.920  -8.044
  269    HG2  LYS  39           1HG      LYS  39   9.836   8.958  -5.613
  270    HG3  LYS  39           2HG      LYS  39   8.146   8.516  -5.360
  271    HD2  LYS  39           1HD      LYS  39   9.779   6.813  -7.169
  272    HD3  LYS  39           2HD      LYS  39  10.075   6.698  -5.432
  273    HE2  LYS  39           1HE      LYS  39   8.456   5.045  -5.974
  274    HE3  LYS  39           2HE      LYS  39   7.607   6.343  -5.136
  275    HZ1  LYS  39           3HZ      LYS  39   6.418   6.849  -6.953
  276    HZ2  LYS  39           1HZ      LYS  39   6.806   5.279  -7.450
  277    HZ3  LYS  39           2HZ      LYS  39   7.705   6.593  -8.019
  278    HA   PRO  40           HA       PRO  40   8.198  13.086 -10.619
  279    HB2  PRO  40           1HB      PRO  40  10.740  13.346 -11.536
  280    HB3  PRO  40           2HB      PRO  40  10.081  14.346 -10.236
  281    HG2  PRO  40           1HG      PRO  40  11.827  11.920 -10.061
  282    HG3  PRO  40           2HG      PRO  40  11.930  13.441  -9.154
  283    HD2  PRO  40           1HD      PRO  40  10.832  11.195  -8.113
  284    HD3  PRO  40           2HD      PRO  40  10.267  12.822  -7.683
  285    H    SER  41           H        SER  41  10.581  10.439 -10.692
  286    HA   SER  41           HA       SER  41   9.650   9.734 -13.387
  287    HB2  SER  41           1HB      SER  41  11.710   8.404 -13.562
  288    HB3  SER  41           2HB      SER  41  12.075  10.076 -13.137
  289    HG   SER  41           HG       SER  41  11.951   9.138 -10.862
  290    H    GLY  42           H        GLY  42  10.387   8.270 -10.230
  291    HA2  GLY  42           1HA      GLY  42   9.245   6.565  -9.144
  292    HA3  GLY  42           2HA      GLY  42   8.184   6.428 -10.539
  293    HA   PRO  43           HA       PRO  43  11.130   2.785 -10.343
  294    HB2  PRO  43           1HB      PRO  43   9.207   0.871 -10.247
  295    HB3  PRO  43           2HB      PRO  43   9.873   1.637  -8.800
  296    HG2  PRO  43           1HG      PRO  43   7.320   2.223 -10.249
  297    HG3  PRO  43           2HG      PRO  43   7.615   2.106  -8.504
  298    HD2  PRO  43           1HD      PRO  43   7.438   4.479  -9.796
  299    HD3  PRO  43           2HD      PRO  43   8.482   4.238  -8.381
  300    H    SER  44           H        SER  44   8.016   3.122 -12.028
  301    HA   SER  44           HA       SER  44   9.339   2.172 -14.481
  302    HB2  SER  44           1HB      SER  44   7.749   0.480 -13.424
  303    HB3  SER  44           2HB      SER  44   6.447   1.598 -13.828
  304    HG   SER  44           HG       SER  44   6.550   0.338 -15.578
  305    H    SER  45           H        SER  45   8.740   3.170 -16.394
  306    HA   SER  45           HA       SER  45   7.933   5.864 -16.215
  307    HB2  SER  45           1HB      SER  45   8.296   3.978 -18.538
  308    HB3  SER  45           2HB      SER  45   7.758   5.641 -18.771
  309    HG   SER  45           HG       SER  45  10.234   4.666 -17.913
  310    H    GLY  46           H        GLY  46   6.080   6.870 -17.268
  311    HA2  GLY  46           1HA      GLY  46   3.807   5.484 -18.135
  312    HA3  GLY  46           2HA      GLY  46   3.637   5.761 -16.408
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -11.772 -39.770  -5.024
    2    HA2  GLY   1           1HA      GLY   1 -12.912 -38.821  -2.900
    3    HA3  GLY   1           2HA      GLY   1 -11.753 -37.786  -3.720
    4    H    SER   2           H        SER   2 -13.090 -36.131  -2.569
    5    HA   SER   2           HA       SER   2 -15.268 -35.267  -4.341
    6    HB2  SER   2           1HB      SER   2 -16.482 -34.414  -2.312
    7    HB3  SER   2           2HB      SER   2 -16.388 -36.172  -2.410
    8    HG   SER   2           HG       SER   2 -15.287 -36.182  -0.625
    9    H    SER   3           H        SER   3 -15.865 -32.892  -3.760
   10    HA   SER   3           HA       SER   3 -13.692 -31.284  -2.761
   11    HB2  SER   3           1HB      SER   3 -13.160 -30.126  -4.788
   12    HB3  SER   3           2HB      SER   3 -13.040 -31.850  -5.141
   13    HG   SER   3           HG       SER   3 -15.501 -31.272  -5.665
   14    H    GLY   4           H        GLY   4 -14.269 -29.095  -2.443
   15    HA2  GLY   4           1HA      GLY   4 -16.523 -27.783  -3.347
   16    HA3  GLY   4           2HA      GLY   4 -17.047 -28.694  -1.939
   17    H    SER   5           H        SER   5 -16.893 -25.793  -2.352
   18    HA   SER   5           HA       SER   5 -15.424 -25.167   0.084
   19    HB2  SER   5           1HB      SER   5 -14.395 -23.147  -1.009
   20    HB3  SER   5           2HB      SER   5 -13.747 -24.687  -1.574
   21    HG   SER   5           HG       SER   5 -15.630 -24.311  -3.213
   22    H    SER   6           H        SER   6 -16.695 -24.008   1.358
   23    HA   SER   6           HA       SER   6 -19.233 -23.112   0.667
   24    HB2  SER   6           1HB      SER   6 -17.385 -22.532   2.954
   25    HB3  SER   6           2HB      SER   6 -18.880 -21.609   2.794
   26    HG   SER   6           HG       SER   6 -18.827 -23.732   4.034
   27    H    GLY   7           H        GLY   7 -16.258 -21.192   1.089
   28    HA2  GLY   7           1HA      GLY   7 -15.607 -19.358  -0.222
   29    HA3  GLY   7           2HA      GLY   7 -17.219 -19.315  -0.921
   30    H    THR   8           H        THR   8 -15.883 -17.018  -0.085
   31    HA   THR   8           HA       THR   8 -17.737 -16.085   1.969
   32    HB   THR   8           HB       THR   8 -15.638 -16.711   3.157
   33    HG1  THR   8           HG1      THR   8 -15.351 -14.346   3.926
   34   HG21  THR   8          3HG2      THR   8 -14.408 -15.486   0.956
   35   HG22  THR   8          1HG2      THR   8 -13.623 -16.132   2.396
   36   HG23  THR   8          2HG2      THR   8 -14.083 -14.431   2.331
   37    H    GLY   9           H        GLY   9 -18.050 -13.801   1.979
   38    HA2  GLY   9           1HA      GLY   9 -18.080 -12.615  -0.562
   39    HA3  GLY   9           2HA      GLY   9 -18.341 -11.769   0.956
   40    H    GLU  10           H        GLU  10 -16.691 -11.389  -1.675
   41    HA   GLU  10           HA       GLU  10 -14.067 -10.894  -0.485
   42    HB2  GLU  10           1HB      GLU  10 -15.110 -11.097  -3.277
   43    HB3  GLU  10           2HB      GLU  10 -13.652 -10.157  -2.989
   44    HG2  GLU  10           1HG      GLU  10 -12.435 -12.002  -2.315
   45    HG3  GLU  10           2HG      GLU  10 -13.877 -12.940  -1.931
   46    H    LYS  11           H        LYS  11 -13.088  -8.867  -0.459
   47    HA   LYS  11           HA       LYS  11 -14.951  -6.644  -0.317
   48    HB2  LYS  11           1HB      LYS  11 -12.125  -7.106   0.553
   49    HB3  LYS  11           2HB      LYS  11 -12.713  -5.457   0.383
   50    HG2  LYS  11           1HG      LYS  11 -14.416  -5.821   2.017
   51    HG3  LYS  11           2HG      LYS  11 -14.056  -7.548   2.079
   52    HD2  LYS  11           1HD      LYS  11 -11.978  -5.485   2.742
   53    HD3  LYS  11           2HD      LYS  11 -13.129  -6.057   3.952
   54    HE2  LYS  11           1HE      LYS  11 -11.338  -7.866   2.338
   55    HE3  LYS  11           2HE      LYS  11 -10.932  -7.256   3.941
   56    HZ1  LYS  11           3HZ      LYS  11 -12.811  -8.384   4.861
   57    HZ2  LYS  11           1HZ      LYS  11 -11.924  -9.502   3.953
   58    HZ3  LYS  11           2HZ      LYS  11 -13.357  -8.855   3.331
   59    HA   PRO  12           HA       PRO  12 -13.974  -5.183  -4.379
   60    HB2  PRO  12           1HB      PRO  12 -15.113  -2.730  -4.141
   61    HB3  PRO  12           2HB      PRO  12 -16.056  -4.210  -4.352
   62    HG2  PRO  12           1HG      PRO  12 -15.456  -2.687  -1.846
   63    HG3  PRO  12           2HG      PRO  12 -16.984  -3.417  -2.373
   64    HD2  PRO  12           1HD      PRO  12 -15.353  -4.599  -0.563
   65    HD3  PRO  12           2HD      PRO  12 -16.354  -5.529  -1.698
   66    H    TYR  13           H        TYR  13 -13.102  -3.489  -1.443
   67    HA   TYR  13           HA       TYR  13 -11.151  -1.859  -2.901
   68    HB2  TYR  13           1HB      TYR  13 -11.862  -1.692   0.030
   69    HB3  TYR  13           2HB      TYR  13 -10.989  -0.502  -0.930
   70    HD1  TYR  13           HD1      TYR  13 -12.193   0.881  -2.583
   71    HD2  TYR  13           HD2      TYR  13 -14.255  -1.795   0.004
   72    HE1  TYR  13           HE1      TYR  13 -14.307   2.034  -3.086
   73    HE2  TYR  13           HE2      TYR  13 -16.375  -0.650  -0.493
   74    HH   TYR  13           HH       TYR  13 -17.387   0.805  -1.940
   75    H    GLU  14           H        GLU  14  -9.162  -2.623  -3.090
   76    HA   GLU  14           HA       GLU  14  -7.914  -3.962  -0.813
   77    HB2  GLU  14           1HB      GLU  14  -8.835  -5.746  -2.270
   78    HB3  GLU  14           2HB      GLU  14  -7.881  -5.119  -3.606
   79    HG2  GLU  14           1HG      GLU  14  -5.892  -5.854  -2.713
   80    HG3  GLU  14           2HG      GLU  14  -6.525  -5.898  -1.069
   81    H    CYS  15           H        CYS  15  -5.712  -3.673  -0.667
   82    HA   CYS  15           HA       CYS  15  -4.633  -1.519  -2.272
   83    HB2  CYS  15           1HB      CYS  15  -4.362  -2.006   0.319
   84    HB3  CYS  15           2HB      CYS  15  -2.995  -2.966  -0.237
   85    H    LYS  16           H        LYS  16  -2.364  -1.685  -3.090
   86    HA   LYS  16           HA       LYS  16  -1.965  -4.304  -4.375
   87    HB2  LYS  16           1HB      LYS  16  -1.503  -1.494  -5.292
   88    HB3  LYS  16           2HB      LYS  16  -0.509  -2.784  -5.956
   89    HG2  LYS  16           1HG      LYS  16  -3.497  -2.974  -5.962
   90    HG3  LYS  16           2HG      LYS  16  -2.627  -2.098  -7.223
   91    HD2  LYS  16           1HD      LYS  16  -1.803  -4.883  -6.520
   92    HD3  LYS  16           2HD      LYS  16  -3.218  -4.624  -7.543
   93    HE2  LYS  16           1HE      LYS  16  -0.667  -3.213  -8.182
   94    HE3  LYS  16           2HE      LYS  16  -0.839  -4.917  -8.601
   95    HZ1  LYS  16           3HZ      LYS  16  -2.637  -2.720  -9.474
   96    HZ2  LYS  16           1HZ      LYS  16  -2.841  -4.357  -9.851
   97    HZ3  LYS  16           2HZ      LYS  16  -1.497  -3.515 -10.438
   98    H    VAL  17           H        VAL  17  -0.321  -1.613  -2.782
   99    HA   VAL  17           HA       VAL  17   2.286  -2.719  -2.918
  100    HB   VAL  17           HB       VAL  17   1.141  -0.680  -1.006
  101   HG11  VAL  17          1HG1      VAL  17   3.478  -0.072  -0.552
  102   HG12  VAL  17          2HG1      VAL  17   3.115  -1.724  -0.047
  103   HG13  VAL  17          3HG1      VAL  17   4.014  -1.433  -1.537
  104   HG21  VAL  17          3HG2      VAL  17   1.297  -0.294  -3.590
  105   HG22  VAL  17          1HG2      VAL  17   1.808   0.967  -2.469
  106   HG23  VAL  17          2HG2      VAL  17   3.011  -0.060  -3.249
  107    H    CYS  18           H        CYS  18  -0.043  -2.524  -0.223
  108    HA   CYS  18           HA       CYS  18   1.509  -4.500   1.259
  109    HB2  CYS  18           1HB      CYS  18   0.185  -3.921   3.157
  110    HB3  CYS  18           2HB      CYS  18   0.590  -2.412   2.346
  111    H    SER  19           H        SER  19  -1.281  -4.289  -0.719
  112    HA   SER  19           HA       SER  19  -2.785  -5.836  -1.442
  113    HB2  SER  19           1HB      SER  19  -0.890  -7.779  -0.100
  114    HB3  SER  19           2HB      SER  19  -2.210  -8.236  -1.176
  115    HG   SER  19           HG       SER  19   0.011  -6.602  -1.854
  116    H    LYS  20           H        LYS  20  -3.547  -4.479   0.760
  117    HA   LYS  20           HA       LYS  20  -4.743  -6.510   2.526
  118    HB2  LYS  20           1HB      LYS  20  -3.225  -4.674   3.492
  119    HB3  LYS  20           2HB      LYS  20  -4.551  -3.571   3.150
  120    HG2  LYS  20           1HG      LYS  20  -6.010  -4.785   4.625
  121    HG3  LYS  20           2HG      LYS  20  -4.778  -6.022   4.883
  122    HD2  LYS  20           1HD      LYS  20  -4.265  -3.136   5.534
  123    HD3  LYS  20           2HD      LYS  20  -5.067  -4.211   6.682
  124    HE2  LYS  20           1HE      LYS  20  -3.069  -5.775   6.308
  125    HE3  LYS  20           2HE      LYS  20  -2.279  -4.378   5.578
  126    HZ1  LYS  20           3HZ      LYS  20  -3.344  -3.502   7.973
  127    HZ2  LYS  20           1HZ      LYS  20  -1.711  -3.758   7.612
  128    HZ3  LYS  20           2HZ      LYS  20  -2.624  -4.994   8.317
  129    H    ALA  21           H        ALA  21  -6.891  -6.754   2.548
  130    HA   ALA  21           HA       ALA  21  -8.486  -5.068   0.786
  131    HB1  ALA  21           3HB      ALA  21  -9.192  -7.618   2.235
  132    HB2  ALA  21           1HB      ALA  21 -10.231  -6.769   1.089
  133    HB3  ALA  21           2HB      ALA  21  -8.708  -7.474   0.545
  134    H    PHE  22           H        PHE  22  -9.983  -3.640   1.447
  135    HA   PHE  22           HA       PHE  22 -10.500  -3.457   4.342
  136    HB2  PHE  22           1HB      PHE  22 -10.486  -1.207   2.319
  137    HB3  PHE  22           2HB      PHE  22 -10.765  -1.044   4.050
  138    HD1  PHE  22           HD1      PHE  22  -8.257  -1.768   1.466
  139    HD2  PHE  22           HD2      PHE  22  -8.957  -1.055   5.603
  140    HE1  PHE  22           HE1      PHE  22  -5.839  -1.478   1.822
  141    HE2  PHE  22           HE2      PHE  22  -6.541  -0.763   5.966
  142    HZ   PHE  22           HZ       PHE  22  -4.979  -0.973   4.073
  143    H    THR  23           H        THR  23 -12.598  -2.599   4.963
  144    HA   THR  23           HA       THR  23 -14.704  -3.778   3.399
  145    HB   THR  23           HB       THR  23 -14.790  -3.942   5.830
  146    HG1  THR  23           HG1      THR  23 -16.909  -2.192   5.263
  147   HG21  THR  23          3HG2      THR  23 -15.489  -1.074   6.149
  148   HG22  THR  23          1HG2      THR  23 -13.782  -1.477   5.964
  149   HG23  THR  23          2HG2      THR  23 -14.718  -2.183   7.282
  150    H    GLN  24           H        GLN  24 -13.701  -0.504   4.281
  151    HA   GLN  24           HA       GLN  24 -15.606   0.530   2.285
  152    HB2  GLN  24           1HB      GLN  24 -14.718   1.724   4.907
  153    HB3  GLN  24           2HB      GLN  24 -15.499   2.677   3.653
  154    HG2  GLN  24           1HG      GLN  24 -16.752   0.192   4.769
  155    HG3  GLN  24           2HG      GLN  24 -16.957   1.771   5.527
  156   HE21  GLN  24          1HE2      GLN  24 -18.886  -0.040   4.216
  157   HE22  GLN  24          2HE2      GLN  24 -19.651   0.912   2.994
  158    H    LYS  25           H        LYS  25 -14.934   2.575   1.255
  159    HA   LYS  25           HA       LYS  25 -12.294   2.357   0.228
  160    HB2  LYS  25           1HB      LYS  25 -14.026   3.199  -1.202
  161    HB3  LYS  25           2HB      LYS  25 -14.414   4.486  -0.068
  162    HG2  LYS  25           1HG      LYS  25 -12.475   5.684  -0.585
  163    HG3  LYS  25           2HG      LYS  25 -11.713   4.290  -1.352
  164    HD2  LYS  25           1HD      LYS  25 -13.606   4.398  -3.055
  165    HD3  LYS  25           2HD      LYS  25 -13.971   5.988  -2.382
  166    HE2  LYS  25           1HE      LYS  25 -11.185   5.335  -3.243
  167    HE3  LYS  25           2HE      LYS  25 -12.395   5.772  -4.448
  168    HZ1  LYS  25           3HZ      LYS  25 -11.317   7.409  -2.241
  169    HZ2  LYS  25           1HZ      LYS  25 -12.812   7.779  -2.944
  170    HZ3  LYS  25           2HZ      LYS  25 -11.410   7.780  -3.890
  171    H    ALA  26           H        ALA  26 -13.862   4.917   2.157
  172    HA   ALA  26           HA       ALA  26 -11.895   6.682   2.584
  173    HB1  ALA  26           3HB      ALA  26 -13.169   5.818   5.100
  174    HB2  ALA  26           1HB      ALA  26 -13.075   7.418   4.362
  175    HB3  ALA  26           2HB      ALA  26 -14.261   6.247   3.782
  176    H    HIS  27           H        HIS  27 -12.152   3.572   4.279
  177    HA   HIS  27           HA       HIS  27  -9.951   3.852   5.967
  178    HB2  HIS  27           1HB      HIS  27 -11.195   1.401   4.718
  179    HB3  HIS  27           2HB      HIS  27  -9.899   1.314   5.907
  180    HD1  HIS  27           HD1      HIS  27 -11.252   0.255   7.767
  181    HD2  HIS  27           HD2      HIS  27 -12.942   3.763   6.319
  182    HE1  HIS  27           HE1      HIS  27 -13.103   0.822   9.372
  183    H    LEU  28           H        LEU  28 -10.131   2.502   2.686
  184    HA   LEU  28           HA       LEU  28  -7.372   1.861   2.517
  185    HB2  LEU  28           1HB      LEU  28  -8.929   0.754   1.081
  186    HB3  LEU  28           2HB      LEU  28  -9.484   2.288   0.413
  187    HG   LEU  28           HG       LEU  28  -7.080   2.534  -0.473
  188   HD11  LEU  28          1HD1      LEU  28  -7.146  -0.420   0.125
  189   HD12  LEU  28          2HD1      LEU  28  -6.038   0.773   0.804
  190   HD13  LEU  28          3HD1      LEU  28  -5.963   0.377  -0.913
  191   HD21  LEU  28          3HD2      LEU  28  -9.257   0.777  -1.471
  192   HD22  LEU  28          1HD2      LEU  28  -7.712   0.749  -2.322
  193   HD23  LEU  28          2HD2      LEU  28  -8.597   2.265  -2.152
  194    H    ALA  29           H        ALA  29  -9.274   4.550   1.157
  195    HA   ALA  29           HA       ALA  29  -7.286   5.946  -0.125
  196    HB1  ALA  29           3HB      ALA  29  -9.932   6.481   0.766
  197    HB2  ALA  29           1HB      ALA  29  -8.918   7.867   1.169
  198    HB3  ALA  29           2HB      ALA  29  -9.007   7.293  -0.497
  199    H    GLN  30           H        GLN  30  -8.239   6.261   3.292
  200    HA   GLN  30           HA       GLN  30  -6.251   8.176   3.930
  201    HB2  GLN  30           1HB      GLN  30  -8.285   7.862   5.278
  202    HB3  GLN  30           2HB      GLN  30  -7.725   6.263   5.749
  203    HG2  GLN  30           1HG      GLN  30  -7.137   7.519   7.573
  204    HG3  GLN  30           2HG      GLN  30  -5.645   7.539   6.633
  205   HE21  GLN  30          1HE2      GLN  30  -8.688   9.369   6.572
  206   HE22  GLN  30          2HE2      GLN  30  -7.947  10.930   6.593
  207    H    HIS  31           H        HIS  31  -6.353   4.662   4.035
  208    HA   HIS  31           HA       HIS  31  -3.995   4.240   5.508
  209    HB2  HIS  31           1HB      HIS  31  -5.276   2.323   5.314
  210    HB3  HIS  31           2HB      HIS  31  -5.616   2.596   3.607
  211    HD1  HIS  31           HD1      HIS  31  -2.630   1.664   5.775
  212    HD2  HIS  31           HD2      HIS  31  -4.155   1.022   1.964
  213    HE1  HIS  31           HE1      HIS  31  -1.064   0.021   4.692
  214    H    GLN  32           H        GLN  32  -4.491   4.075   1.977
  215    HA   GLN  32           HA       GLN  32  -1.999   3.618   1.066
  216    HB2  GLN  32           1HB      GLN  32  -4.152   5.433   0.050
  217    HB3  GLN  32           2HB      GLN  32  -2.601   5.384  -0.777
  218    HG2  GLN  32           1HG      GLN  32  -2.963   2.825  -0.800
  219    HG3  GLN  32           2HG      GLN  32  -4.649   3.231  -0.478
  220   HE21  GLN  32          1HE2      GLN  32  -5.884   3.486  -2.188
  221   HE22  GLN  32          2HE2      GLN  32  -5.353   3.898  -3.779
  222    H    LYS  33           H        LYS  33  -3.123   6.582   2.543
  223    HA   LYS  33           HA       LYS  33  -1.278   8.447   1.859
  224    HB2  LYS  33           1HB      LYS  33  -2.193   7.904   4.690
  225    HB3  LYS  33           2HB      LYS  33  -1.545   9.423   4.085
  226    HG2  LYS  33           1HG      LYS  33  -3.934   8.291   2.734
  227    HG3  LYS  33           2HG      LYS  33  -4.138   9.012   4.332
  228    HD2  LYS  33           1HD      LYS  33  -2.606  10.502   2.250
  229    HD3  LYS  33           2HD      LYS  33  -4.368  10.469   2.160
  230    HE2  LYS  33           1HE      LYS  33  -2.911  11.217   4.679
  231    HE3  LYS  33           2HE      LYS  33  -3.286  12.404   3.431
  232    HZ1  LYS  33           3HZ      LYS  33  -5.381  10.678   4.599
  233    HZ2  LYS  33           1HZ      LYS  33  -5.563  12.135   3.759
  234    HZ3  LYS  33           2HZ      LYS  33  -4.932  12.137   5.328
  235    H    THR  34           H        THR  34  -0.806   5.824   4.192
  236    HA   THR  34           HA       THR  34   1.749   6.548   5.079
  237    HB   THR  34           HB       THR  34   2.019   4.133   5.673
  238    HG1  THR  34           HG1      THR  34  -0.287   3.978   4.079
  239   HG21  THR  34          3HG2      THR  34  -0.735   4.849   6.528
  240   HG22  THR  34          1HG2      THR  34   0.561   5.980   6.912
  241   HG23  THR  34          2HG2      THR  34   0.644   4.315   7.489
  242    H    HIS  35           H        HIS  35   0.778   4.344   2.459
  243    HA   HIS  35           HA       HIS  35   3.333   3.571   1.648
  244    HB2  HIS  35           1HB      HIS  35   0.773   3.853   0.068
  245    HB3  HIS  35           2HB      HIS  35   2.236   3.115  -0.576
  246    HD1  HIS  35           HD1      HIS  35   3.120   1.285   1.616
  247    HD2  HIS  35           HD2      HIS  35  -0.881   1.791   0.617
  248    HE1  HIS  35           HE1      HIS  35   1.953  -0.784   2.443
  249    H    THR  36           H        THR  36   4.188   4.141  -0.637
  250    HA   THR  36           HA       THR  36   5.539   5.752  -1.609
  251    HB   THR  36           HB       THR  36   4.187   7.329  -2.983
  252    HG1  THR  36           HG1      THR  36   2.078   6.226  -1.424
  253   HG21  THR  36          3HG2      THR  36   2.936   5.568  -4.232
  254   HG22  THR  36          1HG2      THR  36   3.287   4.448  -2.917
  255   HG23  THR  36          2HG2      THR  36   4.606   5.131  -3.868
  256    H    GLY  37           H        GLY  37   5.506   6.273   1.108
  257    HA2  GLY  37           1HA      GLY  37   4.928   9.121   1.421
  258    HA3  GLY  37           2HA      GLY  37   5.402   8.010   2.698
  259    H    GLU  38           H        GLU  38   7.683   7.194   2.569
  260    HA   GLU  38           HA       GLU  38   9.538   9.122   2.868
  261    HB2  GLU  38           1HB      GLU  38   9.890   6.342   1.759
  262    HB3  GLU  38           2HB      GLU  38  11.257   7.391   2.106
  263    HG2  GLU  38           1HG      GLU  38  11.128   6.183   4.040
  264    HG3  GLU  38           2HG      GLU  38  10.147   7.587   4.456
  265    H    LYS  39           H        LYS  39  10.835  10.402   1.655
  266    HA   LYS  39           HA       LYS  39  10.363  10.372  -1.248
  267    HB2  LYS  39           1HB      LYS  39  11.252  12.590   0.601
  268    HB3  LYS  39           2HB      LYS  39  11.216  12.737  -1.151
  269    HG2  LYS  39           1HG      LYS  39   8.716  11.973  -0.824
  270    HG3  LYS  39           2HG      LYS  39   8.974  12.631   0.793
  271    HD2  LYS  39           1HD      LYS  39   9.779  14.740  -0.278
  272    HD3  LYS  39           2HD      LYS  39   9.298  14.069  -1.838
  273    HE2  LYS  39           1HE      LYS  39   7.046  14.182  -1.338
  274    HE3  LYS  39           2HE      LYS  39   7.325  14.162   0.402
  275    HZ1  LYS  39           3HZ      LYS  39   7.586  16.416  -1.481
  276    HZ2  LYS  39           1HZ      LYS  39   8.409  16.431  -0.003
  277    HZ3  LYS  39           2HZ      LYS  39   6.720  16.339  -0.030
  278    HA   PRO  40           HA       PRO  40  14.530   9.297  -2.117
  279    HB2  PRO  40           1HB      PRO  40  14.954  10.668  -4.422
  280    HB3  PRO  40           2HB      PRO  40  13.924   9.234  -4.333
  281    HG2  PRO  40           1HG      PRO  40  13.148  12.125  -4.340
  282    HG3  PRO  40           2HG      PRO  40  12.410  10.766  -5.207
  283    HD2  PRO  40           1HD      PRO  40  11.366  11.776  -2.922
  284    HD3  PRO  40           2HD      PRO  40  11.234  10.059  -3.355
  285    H    SER  41           H        SER  41  16.230  10.001  -1.001
  286    HA   SER  41           HA       SER  41  16.676  12.856  -0.647
  287    HB2  SER  41           1HB      SER  41  16.814  11.349   1.309
  288    HB3  SER  41           2HB      SER  41  18.157  10.498   0.546
  289    HG   SER  41           HG       SER  41  19.397  12.338   0.714
  290    H    GLY  42           H        GLY  42  17.069  12.075  -3.267
  291    HA2  GLY  42           1HA      GLY  42  18.873  13.099  -4.587
  292    HA3  GLY  42           2HA      GLY  42  20.006  12.292  -3.512
  293    HA   PRO  43           HA       PRO  43  20.251   8.866  -6.228
  294    HB2  PRO  43           1HB      PRO  43  20.469   6.775  -4.510
  295    HB3  PRO  43           2HB      PRO  43  21.770   7.942  -4.773
  296    HG2  PRO  43           1HG      PRO  43  19.764   7.809  -2.556
  297    HG3  PRO  43           2HG      PRO  43  21.503   8.144  -2.472
  298    HD2  PRO  43           1HD      PRO  43  19.636  10.103  -2.369
  299    HD3  PRO  43           2HD      PRO  43  21.237  10.346  -3.097
  300    H    SER  44           H        SER  44  18.247   8.802  -7.249
  301    HA   SER  44           HA       SER  44  15.803   8.075  -6.253
  302    HB2  SER  44           1HB      SER  44  15.903   8.867  -8.491
  303    HB3  SER  44           2HB      SER  44  17.017   7.588  -8.974
  304    HG   SER  44           HG       SER  44  15.318   6.483  -9.486
  305    H    SER  45           H        SER  45  15.011   6.311  -5.334
  306    HA   SER  45           HA       SER  45  16.152   3.696  -6.044
  307    HB2  SER  45           1HB      SER  45  16.974   4.694  -3.793
  308    HB3  SER  45           2HB      SER  45  15.354   4.316  -3.210
  309    HG   SER  45           HG       SER  45  17.434   2.677  -3.505
  310    H    GLY  46           H        GLY  46  14.725   1.870  -5.287
  311    HA2  GLY  46           1HA      GLY  46  11.926   2.619  -5.802
  312    HA3  GLY  46           2HA      GLY  46  12.627   1.033  -6.092
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1   1.958 -16.940  17.831
    2    HA2  GLY   1           1HA      GLY   1   1.920 -18.108  15.613
    3    HA3  GLY   1           2HA      GLY   1   2.221 -19.203  16.955
    4    H    SER   2           H        SER   2  -0.012 -19.846  18.059
    5    HA   SER   2           HA       SER   2  -1.391 -21.370  16.080
    6    HB2  SER   2           1HB      SER   2  -1.013 -22.212  18.371
    7    HB3  SER   2           2HB      SER   2  -2.075 -20.952  19.001
    8    HG   SER   2           HG       SER   2  -3.794 -21.898  17.952
    9    H    SER   3           H        SER   3  -2.463 -18.801  18.309
   10    HA   SER   3           HA       SER   3  -5.050 -18.471  17.645
   11    HB2  SER   3           1HB      SER   3  -3.074 -16.190  17.904
   12    HB3  SER   3           2HB      SER   3  -4.820 -16.080  18.127
   13    HG   SER   3           HG       SER   3  -3.807 -16.294  20.128
   14    H    GLY   4           H        GLY   4  -6.246 -17.955  15.917
   15    HA2  GLY   4           1HA      GLY   4  -6.378 -16.381  13.960
   16    HA3  GLY   4           2HA      GLY   4  -4.809 -17.030  13.507
   17    H    SER   5           H        SER   5  -7.450 -17.019  12.117
   18    HA   SER   5           HA       SER   5  -7.321 -19.704  11.129
   19    HB2  SER   5           1HB      SER   5  -9.540 -20.433  11.703
   20    HB3  SER   5           2HB      SER   5  -8.740 -19.941  13.196
   21    HG   SER   5           HG       SER   5 -10.934 -18.874  11.943
   22    H    SER   6           H        SER   6  -7.421 -19.372   9.018
   23    HA   SER   6           HA       SER   6  -8.208 -17.108   7.697
   24    HB2  SER   6           1HB      SER   6  -8.000 -19.976   6.872
   25    HB3  SER   6           2HB      SER   6  -8.706 -18.817   5.745
   26    HG   SER   6           HG       SER   6  -6.249 -19.247   5.878
   27    H    GLY   7           H        GLY   7 -10.083 -16.094   7.475
   28    HA2  GLY   7           1HA      GLY   7 -12.561 -17.690   7.694
   29    HA3  GLY   7           2HA      GLY   7 -12.410 -16.035   8.267
   30    H    THR   8           H        THR   8 -13.608 -14.752   7.038
   31    HA   THR   8           HA       THR   8 -13.672 -15.243   4.136
   32    HB   THR   8           HB       THR   8 -15.762 -13.910   4.116
   33    HG1  THR   8           HG1      THR   8 -16.618 -13.148   5.981
   34   HG21  THR   8          3HG2      THR   8 -16.695 -15.930   4.244
   35   HG22  THR   8          1HG2      THR   8 -16.781 -15.734   5.994
   36   HG23  THR   8          2HG2      THR   8 -15.381 -16.519   5.263
   37    H    GLY   9           H        GLY   9 -13.347 -13.550   2.693
   38    HA2  GLY   9           1HA      GLY   9 -12.789 -10.884   3.694
   39    HA3  GLY   9           2HA      GLY   9 -11.394 -11.744   3.060
   40    H    GLU  10           H        GLU  10 -14.566 -10.445   2.253
   41    HA   GLU  10           HA       GLU  10 -13.704 -10.328  -0.562
   42    HB2  GLU  10           1HB      GLU  10 -16.158 -10.485  -1.138
   43    HB3  GLU  10           2HB      GLU  10 -15.435 -11.954  -0.498
   44    HG2  GLU  10           1HG      GLU  10 -16.597 -11.841   1.467
   45    HG3  GLU  10           2HG      GLU  10 -16.772 -10.089   1.391
   46    H    LYS  11           H        LYS  11 -13.523  -8.331  -1.312
   47    HA   LYS  11           HA       LYS  11 -15.438  -6.288  -0.765
   48    HB2  LYS  11           1HB      LYS  11 -13.900  -4.704   0.334
   49    HB3  LYS  11           2HB      LYS  11 -14.208  -6.124   1.325
   50    HG2  LYS  11           1HG      LYS  11 -11.811  -6.058  -0.450
   51    HG3  LYS  11           2HG      LYS  11 -11.794  -5.189   1.087
   52    HD2  LYS  11           1HD      LYS  11 -12.687  -8.041   1.003
   53    HD3  LYS  11           2HD      LYS  11 -10.964  -7.662   0.972
   54    HE2  LYS  11           1HE      LYS  11 -11.418  -6.213   3.020
   55    HE3  LYS  11           2HE      LYS  11 -12.982  -7.022   3.105
   56    HZ1  LYS  11           3HZ      LYS  11 -12.040  -8.776   4.045
   57    HZ2  LYS  11           1HZ      LYS  11 -10.584  -7.919   4.133
   58    HZ3  LYS  11           2HZ      LYS  11 -10.899  -8.917   2.805
   59    HA   PRO  12           HA       PRO  12 -13.898  -4.980  -4.676
   60    HB2  PRO  12           1HB      PRO  12 -14.896  -2.455  -4.712
   61    HB3  PRO  12           2HB      PRO  12 -15.905  -3.889  -4.933
   62    HG2  PRO  12           1HG      PRO  12 -15.473  -2.239  -2.473
   63    HG3  PRO  12           2HG      PRO  12 -16.981  -2.913  -3.117
   64    HD2  PRO  12           1HD      PRO  12 -15.626  -4.063  -1.074
   65    HD3  PRO  12           2HD      PRO  12 -16.561  -5.008  -2.251
   66    H    TYR  13           H        TYR  13 -13.012  -3.483  -1.718
   67    HA   TYR  13           HA       TYR  13 -10.988  -1.817  -3.036
   68    HB2  TYR  13           1HB      TYR  13 -11.718  -1.848  -0.105
   69    HB3  TYR  13           2HB      TYR  13 -10.777  -0.631  -0.960
   70    HD1  TYR  13           HD1      TYR  13 -11.977   0.712  -2.793
   71    HD2  TYR  13           HD2      TYR  13 -14.029  -1.602   0.130
   72    HE1  TYR  13           HE1      TYR  13 -14.026   2.004  -3.217
   73    HE2  TYR  13           HE2      TYR  13 -16.084  -0.317  -0.288
   74    HH   TYR  13           HH       TYR  13 -16.495   2.227  -1.269
   75    H    GLU  14           H        GLU  14  -9.082  -2.747  -3.338
   76    HA   GLU  14           HA       GLU  14  -7.869  -4.243  -1.142
   77    HB2  GLU  14           1HB      GLU  14  -8.813  -6.005  -2.465
   78    HB3  GLU  14           2HB      GLU  14  -8.207  -5.290  -3.952
   79    HG2  GLU  14           1HG      GLU  14  -6.238  -6.044  -1.865
   80    HG3  GLU  14           2HG      GLU  14  -7.007  -7.330  -2.794
   81    H    CYS  15           H        CYS  15  -5.747  -3.836  -0.897
   82    HA   CYS  15           HA       CYS  15  -4.537  -1.881  -2.664
   83    HB2  CYS  15           1HB      CYS  15  -4.425  -1.852  -0.101
   84    HB3  CYS  15           2HB      CYS  15  -3.239  -3.143  -0.255
   85    H    LYS  16           H        LYS  16  -2.227  -2.165  -3.310
   86    HA   LYS  16           HA       LYS  16  -1.736  -4.950  -4.141
   87    HB2  LYS  16           1HB      LYS  16  -2.271  -3.048  -5.878
   88    HB3  LYS  16           2HB      LYS  16  -0.584  -2.621  -5.626
   89    HG2  LYS  16           1HG      LYS  16  -0.442  -4.023  -7.435
   90    HG3  LYS  16           2HG      LYS  16  -0.158  -5.145  -6.102
   91    HD2  LYS  16           1HD      LYS  16  -1.708  -6.267  -7.427
   92    HD3  LYS  16           2HD      LYS  16  -2.707  -5.529  -6.173
   93    HE2  LYS  16           1HE      LYS  16  -3.506  -3.878  -7.619
   94    HE3  LYS  16           2HE      LYS  16  -2.200  -4.130  -8.776
   95    HZ1  LYS  16           3HZ      LYS  16  -4.262  -6.181  -8.208
   96    HZ2  LYS  16           1HZ      LYS  16  -3.157  -6.148  -9.489
   97    HZ3  LYS  16           2HZ      LYS  16  -4.425  -5.031  -9.438
   98    H    VAL  17           H        VAL  17  -0.328  -1.978  -2.918
   99    HA   VAL  17           HA       VAL  17   2.375  -2.770  -2.950
  100    HB   VAL  17           HB       VAL  17   0.992  -0.845  -1.075
  101   HG11  VAL  17          1HG1      VAL  17   3.287   0.123  -0.842
  102   HG12  VAL  17          2HG1      VAL  17   3.088  -1.475  -0.118
  103   HG13  VAL  17          3HG1      VAL  17   3.910  -1.304  -1.670
  104   HG21  VAL  17          3HG2      VAL  17   2.684   0.166  -3.254
  105   HG22  VAL  17          1HG2      VAL  17   1.192  -0.620  -3.771
  106   HG23  VAL  17          2HG2      VAL  17   1.129   0.748  -2.659
  107    H    CYS  18           H        CYS  18  -0.068  -2.914  -0.366
  108    HA   CYS  18           HA       CYS  18   1.701  -4.753   1.102
  109    HB2  CYS  18           1HB      CYS  18   0.498  -4.124   3.118
  110    HB3  CYS  18           2HB      CYS  18   1.089  -2.678   2.306
  111    H    SER  19           H        SER  19  -1.241  -4.490  -0.605
  112    HA   SER  19           HA       SER  19  -2.743  -6.093  -1.237
  113    HB2  SER  19           1HB      SER  19  -0.716  -7.650  -0.966
  114    HB3  SER  19           2HB      SER  19  -1.396  -8.062   0.608
  115    HG   SER  19           HG       SER  19  -3.108  -8.160  -1.586
  116    H    LYS  20           H        LYS  20  -2.923  -4.368   1.170
  117    HA   LYS  20           HA       LYS  20  -4.599  -5.950   2.963
  118    HB2  LYS  20           1HB      LYS  20  -2.892  -4.344   3.856
  119    HB3  LYS  20           2HB      LYS  20  -3.843  -3.031   3.173
  120    HG2  LYS  20           1HG      LYS  20  -5.482  -3.213   4.743
  121    HG3  LYS  20           2HG      LYS  20  -5.214  -4.941   4.984
  122    HD2  LYS  20           1HD      LYS  20  -4.433  -3.965   6.960
  123    HD3  LYS  20           2HD      LYS  20  -2.968  -4.246   6.016
  124    HE2  LYS  20           1HE      LYS  20  -2.662  -2.008   5.577
  125    HE3  LYS  20           2HE      LYS  20  -4.374  -1.629   5.764
  126    HZ1  LYS  20           3HZ      LYS  20  -2.753  -2.498   8.073
  127    HZ2  LYS  20           1HZ      LYS  20  -4.203  -1.626   8.063
  128    HZ3  LYS  20           2HZ      LYS  20  -2.764  -0.879   7.581
  129    H    ALA  21           H        ALA  21  -6.699  -6.116   2.581
  130    HA   ALA  21           HA       ALA  21  -8.021  -4.163   0.863
  131    HB1  ALA  21           3HB      ALA  21  -8.396  -6.974   1.482
  132    HB2  ALA  21           1HB      ALA  21  -9.906  -6.064   1.544
  133    HB3  ALA  21           2HB      ALA  21  -8.923  -6.044   0.079
  134    H    PHE  22           H        PHE  22 -10.175  -3.364   1.453
  135    HA   PHE  22           HA       PHE  22 -10.701  -3.234   4.327
  136    HB2  PHE  22           1HB      PHE  22 -10.645  -0.735   2.633
  137    HB3  PHE  22           2HB      PHE  22 -10.826  -0.848   4.381
  138    HD1  PHE  22           HD1      PHE  22  -8.449  -1.356   1.594
  139    HD2  PHE  22           HD2      PHE  22  -8.953  -0.884   5.794
  140    HE1  PHE  22           HE1      PHE  22  -6.015  -1.114   1.856
  141    HE2  PHE  22           HE2      PHE  22  -6.519  -0.641   6.062
  142    HZ   PHE  22           HZ       PHE  22  -5.047  -0.755   4.092
  143    H    THR  23           H        THR  23 -12.842  -2.952   4.866
  144    HA   THR  23           HA       THR  23 -14.770  -3.753   2.966
  145    HB   THR  23           HB       THR  23 -16.435  -3.355   4.703
  146    HG1  THR  23           HG1      THR  23 -15.463  -1.375   5.499
  147   HG21  THR  23          3HG2      THR  23 -15.242  -5.404   4.945
  148   HG22  THR  23          1HG2      THR  23 -15.369  -4.695   6.554
  149   HG23  THR  23          2HG2      THR  23 -13.853  -4.585   5.659
  150    H    GLN  24           H        GLN  24 -13.892  -0.605   4.297
  151    HA   GLN  24           HA       GLN  24 -15.787   0.654   2.426
  152    HB2  GLN  24           1HB      GLN  24 -14.691   1.583   5.074
  153    HB3  GLN  24           2HB      GLN  24 -15.472   2.684   3.947
  154    HG2  GLN  24           1HG      GLN  24 -17.541   1.578   4.141
  155    HG3  GLN  24           2HG      GLN  24 -16.810   0.193   4.950
  156   HE21  GLN  24          1HE2      GLN  24 -16.935   0.133   7.077
  157   HE22  GLN  24          2HE2      GLN  24 -17.275   1.473   8.112
  158    H    LYS  25           H        LYS  25 -15.060   2.845   1.643
  159    HA   LYS  25           HA       LYS  25 -12.418   2.571   0.507
  160    HB2  LYS  25           1HB      LYS  25 -13.008   4.382  -0.923
  161    HB3  LYS  25           2HB      LYS  25 -14.433   3.362  -0.782
  162    HG2  LYS  25           1HG      LYS  25 -14.089   5.725   1.014
  163    HG3  LYS  25           2HG      LYS  25 -14.686   5.928  -0.634
  164    HD2  LYS  25           1HD      LYS  25 -16.290   3.949   0.105
  165    HD3  LYS  25           2HD      LYS  25 -15.961   4.613   1.707
  166    HE2  LYS  25           1HE      LYS  25 -16.600   6.867   0.764
  167    HE3  LYS  25           2HE      LYS  25 -17.175   6.012  -0.667
  168    HZ1  LYS  25           3HZ      LYS  25 -19.090   5.943   0.467
  169    HZ2  LYS  25           1HZ      LYS  25 -18.353   6.204   1.967
  170    HZ3  LYS  25           2HZ      LYS  25 -18.382   4.651   1.297
  171    H    ALA  26           H        ALA  26 -13.997   4.473   2.966
  172    HA   ALA  26           HA       ALA  26 -12.195   6.582   3.228
  173    HB1  ALA  26           3HB      ALA  26 -13.995   5.203   5.193
  174    HB2  ALA  26           1HB      ALA  26 -12.963   6.551   5.671
  175    HB3  ALA  26           2HB      ALA  26 -14.191   6.779   4.427
  176    H    HIS  27           H        HIS  27 -12.078   3.304   4.526
  177    HA   HIS  27           HA       HIS  27  -9.814   3.717   6.189
  178    HB2  HIS  27           1HB      HIS  27 -10.768   1.117   4.975
  179    HB3  HIS  27           2HB      HIS  27  -9.739   1.305   6.393
  180    HD1  HIS  27           HD1      HIS  27 -12.659  -0.078   6.181
  181    HD2  HIS  27           HD2      HIS  27 -11.716   3.608   7.850
  182    HE1  HIS  27           HE1      HIS  27 -14.507   0.413   7.815
  183    H    LEU  28           H        LEU  28 -10.181   2.241   2.970
  184    HA   LEU  28           HA       LEU  28  -7.465   1.697   2.544
  185    HB2  LEU  28           1HB      LEU  28  -9.029   0.638   1.140
  186    HB3  LEU  28           2HB      LEU  28  -9.770   2.169   0.679
  187    HG   LEU  28           HG       LEU  28  -7.405   2.626  -0.376
  188   HD11  LEU  28          1HD1      LEU  28  -7.425  -0.295   0.149
  189   HD12  LEU  28          2HD1      LEU  28  -6.079   0.844   0.121
  190   HD13  LEU  28          3HD1      LEU  28  -6.776   0.266  -1.392
  191   HD21  LEU  28          3HD2      LEU  28  -8.309   1.215  -2.418
  192   HD22  LEU  28          1HD2      LEU  28  -9.120   2.686  -1.881
  193   HD23  LEU  28          2HD2      LEU  28  -9.747   1.109  -1.402
  194    H    ALA  29           H        ALA  29  -9.406   4.388   1.226
  195    HA   ALA  29           HA       ALA  29  -7.447   5.830  -0.018
  196    HB1  ALA  29           3HB      ALA  29  -9.071   7.730   1.300
  197    HB2  ALA  29           1HB      ALA  29  -9.194   7.150  -0.361
  198    HB3  ALA  29           2HB      ALA  29 -10.087   6.338   0.925
  199    H    GLN  30           H        GLN  30  -8.323   5.998   3.423
  200    HA   GLN  30           HA       GLN  30  -6.434   7.981   4.109
  201    HB2  GLN  30           1HB      GLN  30  -8.448   7.263   5.463
  202    HB3  GLN  30           2HB      GLN  30  -7.519   5.852   5.952
  203    HG2  GLN  30           1HG      GLN  30  -6.075   7.080   7.249
  204    HG3  GLN  30           2HG      GLN  30  -6.363   8.568   6.349
  205   HE21  GLN  30          1HE2      GLN  30  -6.443   9.147   8.777
  206   HE22  GLN  30          2HE2      GLN  30  -8.026   9.192   9.469
  207    H    HIS  31           H        HIS  31  -6.269   4.479   3.930
  208    HA   HIS  31           HA       HIS  31  -3.791   4.178   5.268
  209    HB2  HIS  31           1HB      HIS  31  -4.908   2.169   5.131
  210    HB3  HIS  31           2HB      HIS  31  -5.475   2.473   3.492
  211    HD1  HIS  31           HD1      HIS  31  -2.167   1.727   5.224
  212    HD2  HIS  31           HD2      HIS  31  -4.142   1.033   1.635
  213    HE1  HIS  31           HE1      HIS  31  -0.642   0.233   3.895
  214    H    GLN  32           H        GLN  32  -4.618   4.307   1.808
  215    HA   GLN  32           HA       GLN  32  -2.229   3.932   0.607
  216    HB2  GLN  32           1HB      GLN  32  -4.454   5.842  -0.002
  217    HB3  GLN  32           2HB      GLN  32  -2.998   5.858  -0.988
  218    HG2  GLN  32           1HG      GLN  32  -3.327   3.521  -1.551
  219    HG3  GLN  32           2HG      GLN  32  -4.754   3.459  -0.519
  220   HE21  GLN  32          1HE2      GLN  32  -3.719   3.774  -3.619
  221   HE22  GLN  32          2HE2      GLN  32  -5.104   4.540  -4.312
  222    H    LYS  33           H        LYS  33  -3.133   6.652   2.576
  223    HA   LYS  33           HA       LYS  33  -1.268   8.555   1.830
  224    HB2  LYS  33           1HB      LYS  33  -2.390   7.889   4.553
  225    HB3  LYS  33           2HB      LYS  33  -1.389   9.302   4.245
  226    HG2  LYS  33           1HG      LYS  33  -3.020  10.202   2.735
  227    HG3  LYS  33           2HG      LYS  33  -3.987   8.729   2.837
  228    HD2  LYS  33           1HD      LYS  33  -4.392   9.149   5.207
  229    HD3  LYS  33           2HD      LYS  33  -3.395  10.603   5.130
  230    HE2  LYS  33           1HE      LYS  33  -4.984  11.449   3.361
  231    HE3  LYS  33           2HE      LYS  33  -6.031  10.091   3.768
  232    HZ1  LYS  33           3HZ      LYS  33  -6.017  12.536   4.981
  233    HZ2  LYS  33           1HZ      LYS  33  -5.200  11.545   6.082
  234    HZ3  LYS  33           2HZ      LYS  33  -6.759  11.135   5.573
  235    H    THR  34           H        THR  34  -0.895   5.912   4.176
  236    HA   THR  34           HA       THR  34   1.722   6.492   4.975
  237    HB   THR  34           HB       THR  34   0.207   4.851   6.100
  238    HG1  THR  34           HG1      THR  34   1.924   3.570   6.749
  239   HG21  THR  34          3HG2      THR  34   1.103   2.603   4.467
  240   HG22  THR  34          1HG2      THR  34   0.020   3.697   3.608
  241   HG23  THR  34          2HG2      THR  34  -0.494   2.957   5.124
  242    H    HIS  35           H        HIS  35   0.490   4.924   2.120
  243    HA   HIS  35           HA       HIS  35   3.014   3.791   1.334
  244    HB2  HIS  35           1HB      HIS  35   0.303   4.026   0.087
  245    HB3  HIS  35           2HB      HIS  35   1.682   3.621  -0.930
  246    HD1  HIS  35           HD1      HIS  35   3.166   1.730   1.021
  247    HD2  HIS  35           HD2      HIS  35  -0.913   1.589   0.244
  248    HE1  HIS  35           HE1      HIS  35   2.454  -0.614   1.590
  249    H    THR  36           H        THR  36   1.046   6.560   0.292
  250    HA   THR  36           HA       THR  36   3.256   7.508  -1.373
  251    HB   THR  36           HB       THR  36   1.588   9.290  -2.059
  252    HG1  THR  36           HG1      THR  36   0.254   8.664  -0.059
  253   HG21  THR  36          3HG2      THR  36   0.747   7.957  -3.730
  254   HG22  THR  36          1HG2      THR  36   0.385   6.624  -2.635
  255   HG23  THR  36          2HG2      THR  36   2.049   6.925  -3.138
  256    H    GLY  37           H        GLY  37   4.761   8.549  -0.200
  257    HA2  GLY  37           1HA      GLY  37   4.524  11.101   0.707
  258    HA3  GLY  37           2HA      GLY  37   4.072  10.137   2.105
  259    H    GLU  38           H        GLU  38   5.630   9.173   3.310
  260    HA   GLU  38           HA       GLU  38   8.352   9.991   2.803
  261    HB2  GLU  38           1HB      GLU  38   8.830   8.972   4.992
  262    HB3  GLU  38           2HB      GLU  38   7.484  10.101   5.073
  263    HG2  GLU  38           1HG      GLU  38   6.848   8.258   6.372
  264    HG3  GLU  38           2HG      GLU  38   5.959   8.100   4.859
  265    H    LYS  39           H        LYS  39  10.137   8.358   3.149
  266    HA   LYS  39           HA       LYS  39  10.473   6.624   1.168
  267    HB2  LYS  39           1HB      LYS  39  12.102   7.098   3.028
  268    HB3  LYS  39           2HB      LYS  39  11.268   5.881   3.985
  269    HG2  LYS  39           1HG      LYS  39  11.777   4.233   2.171
  270    HG3  LYS  39           2HG      LYS  39  12.788   5.472   1.423
  271    HD2  LYS  39           1HD      LYS  39  14.143   5.588   3.464
  272    HD3  LYS  39           2HD      LYS  39  13.137   4.338   4.199
  273    HE2  LYS  39           1HE      LYS  39  15.008   3.182   3.408
  274    HE3  LYS  39           2HE      LYS  39  13.775   2.901   2.180
  275    HZ1  LYS  39           3HZ      LYS  39  16.280   3.834   1.719
  276    HZ2  LYS  39           1HZ      LYS  39  15.349   5.246   1.676
  277    HZ3  LYS  39           2HZ      LYS  39  14.975   3.956   0.649
  278    HA   PRO  40           HA       PRO  40   6.932   3.882   1.956
  279    HB2  PRO  40           1HB      PRO  40   6.743   3.049  -0.622
  280    HB3  PRO  40           2HB      PRO  40   6.042   4.568  -0.049
  281    HG2  PRO  40           1HG      PRO  40   8.617   4.100  -1.502
  282    HG3  PRO  40           2HG      PRO  40   7.404   5.368  -1.755
  283    HD2  PRO  40           1HD      PRO  40   9.699   5.799  -0.383
  284    HD3  PRO  40           2HD      PRO  40   8.183   6.638   0.004
  285    H    SER  41           H        SER  41   7.941   2.292   3.153
  286    HA   SER  41           HA       SER  41   9.914   0.556   1.954
  287    HB2  SER  41           1HB      SER  41  10.039   1.212   4.346
  288    HB3  SER  41           2HB      SER  41   8.540   0.331   4.643
  289    HG   SER  41           HG       SER  41   9.905  -1.241   5.025
  290    H    GLY  42           H        GLY  42   8.828  -0.471   0.264
  291    HA2  GLY  42           1HA      GLY  42   7.458  -2.861   0.973
  292    HA3  GLY  42           2HA      GLY  42   6.334  -1.673   0.331
  293    HA   PRO  43           HA       PRO  43   8.515  -4.137  -3.082
  294    HB2  PRO  43           1HB      PRO  43   6.371  -5.588  -3.901
  295    HB3  PRO  43           2HB      PRO  43   7.493  -6.151  -2.657
  296    HG2  PRO  43           1HG      PRO  43   4.805  -4.870  -2.345
  297    HG3  PRO  43           2HG      PRO  43   5.492  -6.255  -1.476
  298    HD2  PRO  43           1HD      PRO  43   5.421  -3.763  -0.420
  299    HD3  PRO  43           2HD      PRO  43   6.721  -4.916  -0.058
  300    H    SER  44           H        SER  44   8.698  -2.614  -4.616
  301    HA   SER  44           HA       SER  44   6.724  -0.806  -5.407
  302    HB2  SER  44           1HB      SER  44   8.185  -0.468  -7.441
  303    HB3  SER  44           2HB      SER  44   9.019  -0.314  -5.895
  304    HG   SER  44           HG       SER  44   9.444  -2.072  -7.913
  305    H    SER  45           H        SER  45   7.836  -3.759  -7.064
  306    HA   SER  45           HA       SER  45   5.215  -3.875  -8.405
  307    HB2  SER  45           1HB      SER  45   7.965  -4.191  -9.554
  308    HB3  SER  45           2HB      SER  45   6.621  -5.082 -10.267
  309    HG   SER  45           HG       SER  45   5.631  -2.772 -10.100
  310    H    GLY  46           H        GLY  46   4.257  -5.427  -7.186
  311    HA2  GLY  46           1HA      GLY  46   4.677  -8.104  -7.658
  312    HA3  GLY  46           2HA      GLY  46   5.642  -7.742  -6.234
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1  -2.682 -19.414   1.568
    2    HA2  GLY   1           1HA      GLY   1  -2.164 -21.666   3.228
    3    HA3  GLY   1           2HA      GLY   1  -3.570 -20.783   3.804
    4    H    SER   2           H        SER   2  -3.896 -23.356   3.029
    5    HA   SER   2           HA       SER   2  -4.607 -23.623   0.280
    6    HB2  SER   2           1HB      SER   2  -5.268 -25.312   2.702
    7    HB3  SER   2           2HB      SER   2  -5.689 -25.757   1.048
    8    HG   SER   2           HG       SER   2  -3.217 -25.248   0.828
    9    H    SER   3           H        SER   3  -6.814 -24.164  -0.457
   10    HA   SER   3           HA       SER   3  -8.715 -22.254   0.666
   11    HB2  SER   3           1HB      SER   3  -8.925 -23.854  -1.894
   12    HB3  SER   3           2HB      SER   3  -9.932 -22.487  -1.419
   13    HG   SER   3           HG       SER   3  -8.102 -22.071  -2.908
   14    H    GLY   4           H        GLY   4 -10.914 -22.822   1.079
   15    HA2  GLY   4           1HA      GLY   4 -12.477 -24.845   1.005
   16    HA3  GLY   4           2HA      GLY   4 -11.195 -25.638   1.908
   17    H    SER   5           H        SER   5 -10.465 -23.567   3.630
   18    HA   SER   5           HA       SER   5 -11.901 -23.903   5.852
   19    HB2  SER   5           1HB      SER   5  -9.930 -22.525   5.905
   20    HB3  SER   5           2HB      SER   5 -10.695 -21.299   4.895
   21    HG   SER   5           HG       SER   5 -11.397 -20.447   6.669
   22    H    SER   6           H        SER   6 -13.904 -23.577   6.557
   23    HA   SER   6           HA       SER   6 -15.976 -22.671   4.950
   24    HB2  SER   6           1HB      SER   6 -16.405 -24.071   6.883
   25    HB3  SER   6           2HB      SER   6 -15.823 -22.810   7.970
   26    HG   SER   6           HG       SER   6 -18.280 -23.153   6.969
   27    H    GLY   7           H        GLY   7 -16.197 -20.700   4.120
   28    HA2  GLY   7           1HA      GLY   7 -17.018 -18.439   4.838
   29    HA3  GLY   7           2HA      GLY   7 -15.587 -18.388   5.857
   30    H    THR   8           H        THR   8 -16.355 -16.516   3.797
   31    HA   THR   8           HA       THR   8 -13.924 -16.683   2.169
   32    HB   THR   8           HB       THR   8 -15.676 -17.501   0.698
   33    HG1  THR   8           HG1      THR   8 -14.811 -14.840   0.169
   34   HG21  THR   8          3HG2      THR   8 -17.421 -15.592   0.078
   35   HG22  THR   8          1HG2      THR   8 -17.140 -15.142   1.760
   36   HG23  THR   8          2HG2      THR   8 -17.731 -16.757   1.366
   37    H    GLY   9           H        GLY   9 -12.965 -14.728   1.713
   38    HA2  GLY   9           1HA      GLY   9 -14.270 -12.362   2.912
   39    HA3  GLY   9           2HA      GLY   9 -12.539 -12.655   2.997
   40    H    GLU  10           H        GLU  10 -15.105 -11.325   1.171
   41    HA   GLU  10           HA       GLU  10 -13.218 -10.640  -0.987
   42    HB2  GLU  10           1HB      GLU  10 -15.012 -10.632  -2.559
   43    HB3  GLU  10           2HB      GLU  10 -15.117 -12.140  -1.663
   44    HG2  GLU  10           1HG      GLU  10 -17.317 -11.350  -1.859
   45    HG3  GLU  10           2HG      GLU  10 -16.831 -11.011  -0.199
   46    H    LYS  11           H        LYS  11 -13.010  -8.533  -1.556
   47    HA   LYS  11           HA       LYS  11 -14.876  -6.558  -0.501
   48    HB2  LYS  11           1HB      LYS  11 -11.946  -6.673   0.193
   49    HB3  LYS  11           2HB      LYS  11 -12.867  -5.177   0.283
   50    HG2  LYS  11           1HG      LYS  11 -14.099  -5.879   2.082
   51    HG3  LYS  11           2HG      LYS  11 -13.903  -7.589   1.688
   52    HD2  LYS  11           1HD      LYS  11 -11.488  -7.370   2.298
   53    HD3  LYS  11           2HD      LYS  11 -11.835  -5.733   2.862
   54    HE2  LYS  11           1HE      LYS  11 -13.648  -6.849   4.309
   55    HE3  LYS  11           2HE      LYS  11 -12.794  -8.352   3.966
   56    HZ1  LYS  11           3HZ      LYS  11 -11.881  -7.593   5.953
   57    HZ2  LYS  11           1HZ      LYS  11 -11.819  -5.983   5.437
   58    HZ3  LYS  11           2HZ      LYS  11 -10.745  -7.119   4.792
   59    HA   PRO  12           HA       PRO  12 -14.144  -4.800  -4.479
   60    HB2  PRO  12           1HB      PRO  12 -15.198  -2.340  -4.022
   61    HB3  PRO  12           2HB      PRO  12 -16.192  -3.787  -4.234
   62    HG2  PRO  12           1HG      PRO  12 -15.357  -2.416  -1.707
   63    HG3  PRO  12           2HG      PRO  12 -16.940  -3.084  -2.147
   64    HD2  PRO  12           1HD      PRO  12 -15.201  -4.396  -0.540
   65    HD3  PRO  12           2HD      PRO  12 -16.311  -5.242  -1.637
   66    H    TYR  13           H        TYR  13 -12.950  -3.357  -1.537
   67    HA   TYR  13           HA       TYR  13 -11.044  -1.735  -3.083
   68    HB2  TYR  13           1HB      TYR  13 -11.674  -1.501  -0.137
   69    HB3  TYR  13           2HB      TYR  13 -10.762  -0.366  -1.127
   70    HD1  TYR  13           HD1      TYR  13 -12.038   0.763  -3.072
   71    HD2  TYR  13           HD2      TYR  13 -13.960  -1.192   0.181
   72    HE1  TYR  13           HE1      TYR  13 -14.102   2.012  -3.550
   73    HE2  TYR  13           HE2      TYR  13 -16.030   0.050  -0.288
   74    HH   TYR  13           HH       TYR  13 -16.623   1.635  -3.116
   75    H    GLU  14           H        GLU  14  -9.112  -2.621  -3.341
   76    HA   GLU  14           HA       GLU  14  -7.900  -4.056  -1.087
   77    HB2  GLU  14           1HB      GLU  14  -8.888  -5.596  -2.898
   78    HB3  GLU  14           2HB      GLU  14  -7.572  -5.029  -3.915
   79    HG2  GLU  14           1HG      GLU  14  -5.946  -5.874  -2.329
   80    HG3  GLU  14           2HG      GLU  14  -7.242  -6.390  -1.251
   81    H    CYS  15           H        CYS  15  -5.718  -3.769  -0.837
   82    HA   CYS  15           HA       CYS  15  -4.559  -1.555  -2.301
   83    HB2  CYS  15           1HB      CYS  15  -4.401  -2.022   0.253
   84    HB3  CYS  15           2HB      CYS  15  -3.122  -3.146  -0.196
   85    H    LYS  16           H        LYS  16  -2.257  -1.706  -3.025
   86    HA   LYS  16           HA       LYS  16  -1.823  -4.271  -4.403
   87    HB2  LYS  16           1HB      LYS  16  -1.396  -1.434  -5.189
   88    HB3  LYS  16           2HB      LYS  16  -0.242  -2.619  -5.788
   89    HG2  LYS  16           1HG      LYS  16  -1.812  -2.528  -7.477
   90    HG3  LYS  16           2HG      LYS  16  -2.329  -3.934  -6.543
   91    HD2  LYS  16           1HD      LYS  16  -4.283  -2.671  -7.010
   92    HD3  LYS  16           2HD      LYS  16  -3.899  -2.395  -5.309
   93    HE2  LYS  16           1HE      LYS  16  -2.874  -0.266  -5.862
   94    HE3  LYS  16           2HE      LYS  16  -3.156  -0.551  -7.578
   95    HZ1  LYS  16           3HZ      LYS  16  -5.545  -0.765  -6.013
   96    HZ2  LYS  16           1HZ      LYS  16  -5.246   0.149  -7.405
   97    HZ3  LYS  16           2HZ      LYS  16  -4.829   0.763  -5.885
   98    H    VAL  17           H        VAL  17  -0.343  -1.790  -2.423
   99    HA   VAL  17           HA       VAL  17   2.312  -2.817  -2.559
  100    HB   VAL  17           HB       VAL  17   1.089  -1.074  -0.416
  101   HG11  VAL  17          1HG1      VAL  17   3.273  -0.510   0.236
  102   HG12  VAL  17          2HG1      VAL  17   3.299  -2.263   0.037
  103   HG13  VAL  17          3HG1      VAL  17   3.981  -1.223  -1.213
  104   HG21  VAL  17          3HG2      VAL  17   1.421  -0.495  -3.119
  105   HG22  VAL  17          1HG2      VAL  17   1.153   0.659  -1.812
  106   HG23  VAL  17          2HG2      VAL  17   2.796   0.268  -2.322
  107    H    CYS  18           H        CYS  18  -0.060  -2.835   0.111
  108    HA   CYS  18           HA       CYS  18   1.333  -5.162   1.238
  109    HB2  CYS  18           1HB      CYS  18   0.156  -4.630   3.329
  110    HB3  CYS  18           2HB      CYS  18   1.082  -3.250   2.747
  111    H    SER  19           H        SER  19  -0.798  -4.949  -0.983
  112    HA   SER  19           HA       SER  19  -2.800  -5.936  -1.570
  113    HB2  SER  19           1HB      SER  19  -0.924  -7.698  -1.637
  114    HB3  SER  19           2HB      SER  19  -1.645  -8.337  -0.160
  115    HG   SER  19           HG       SER  19  -2.736  -9.418  -1.652
  116    H    LYS  20           H        LYS  20  -2.932  -4.607   1.003
  117    HA   LYS  20           HA       LYS  20  -4.532  -6.342   2.692
  118    HB2  LYS  20           1HB      LYS  20  -2.895  -4.639   3.589
  119    HB3  LYS  20           2HB      LYS  20  -4.004  -3.389   3.039
  120    HG2  LYS  20           1HG      LYS  20  -5.742  -4.289   4.505
  121    HG3  LYS  20           2HG      LYS  20  -4.622  -5.534   5.062
  122    HD2  LYS  20           1HD      LYS  20  -3.117  -3.767   5.897
  123    HD3  LYS  20           2HD      LYS  20  -4.295  -2.552   5.395
  124    HE2  LYS  20           1HE      LYS  20  -4.801  -2.815   7.632
  125    HE3  LYS  20           2HE      LYS  20  -5.940  -3.922   6.869
  126    HZ1  LYS  20           3HZ      LYS  20  -3.693  -4.489   8.599
  127    HZ2  LYS  20           1HZ      LYS  20  -3.821  -5.511   7.256
  128    HZ3  LYS  20           2HZ      LYS  20  -5.112  -5.373   8.340
  129    H    ALA  21           H        ALA  21  -6.660  -6.544   2.526
  130    HA   ALA  21           HA       ALA  21  -8.136  -4.691   0.817
  131    HB1  ALA  21           3HB      ALA  21  -9.663  -6.360   0.457
  132    HB2  ALA  21           1HB      ALA  21  -8.213  -7.317   0.763
  133    HB3  ALA  21           2HB      ALA  21  -9.406  -7.090   2.042
  134    H    PHE  22           H        PHE  22  -9.963  -3.570   1.483
  135    HA   PHE  22           HA       PHE  22 -10.412  -3.475   4.393
  136    HB2  PHE  22           1HB      PHE  22 -10.505  -1.143   2.467
  137    HB3  PHE  22           2HB      PHE  22 -10.824  -1.067   4.197
  138    HD1  PHE  22           HD1      PHE  22  -8.215  -1.671   1.661
  139    HD2  PHE  22           HD2      PHE  22  -9.065  -0.915   5.763
  140    HE1  PHE  22           HE1      PHE  22  -5.824  -1.261   2.078
  141    HE2  PHE  22           HE2      PHE  22  -6.676  -0.503   6.186
  142    HZ   PHE  22           HZ       PHE  22  -5.053  -0.676   4.342
  143    H    THR  23           H        THR  23 -12.571  -2.304   4.870
  144    HA   THR  23           HA       THR  23 -14.617  -3.678   3.310
  145    HB   THR  23           HB       THR  23 -16.153  -2.965   5.151
  146    HG1  THR  23           HG1      THR  23 -13.747  -2.094   6.409
  147   HG21  THR  23          3HG2      THR  23 -14.863  -5.140   5.120
  148   HG22  THR  23          1HG2      THR  23 -15.399  -4.593   6.708
  149   HG23  THR  23          2HG2      THR  23 -13.717  -4.379   6.222
  150    H    GLN  24           H        GLN  24 -13.756  -0.408   4.355
  151    HA   GLN  24           HA       GLN  24 -15.601   0.637   2.311
  152    HB2  GLN  24           1HB      GLN  24 -15.065   1.626   5.098
  153    HB3  GLN  24           2HB      GLN  24 -15.679   2.707   3.854
  154    HG2  GLN  24           1HG      GLN  24 -17.453   0.769   3.560
  155    HG3  GLN  24           2HG      GLN  24 -17.010   0.448   5.235
  156   HE21  GLN  24          1HE2      GLN  24 -18.920   1.076   6.134
  157   HE22  GLN  24          2HE2      GLN  24 -19.486   2.708   6.131
  158    H    LYS  25           H        LYS  25 -14.780   2.055   0.883
  159    HA   LYS  25           HA       LYS  25 -12.131   2.294   0.324
  160    HB2  LYS  25           1HB      LYS  25 -13.988   3.052  -1.145
  161    HB3  LYS  25           2HB      LYS  25 -14.177   4.474  -0.128
  162    HG2  LYS  25           1HG      LYS  25 -12.008   5.278  -0.736
  163    HG3  LYS  25           2HG      LYS  25 -11.644   3.782  -1.597
  164    HD2  LYS  25           1HD      LYS  25 -12.246   5.184  -3.329
  165    HD3  LYS  25           2HD      LYS  25 -13.777   4.383  -2.973
  166    HE2  LYS  25           1HE      LYS  25 -13.141   6.902  -1.528
  167    HE3  LYS  25           2HE      LYS  25 -13.596   7.014  -3.227
  168    HZ1  LYS  25           3HZ      LYS  25 -15.384   7.062  -1.327
  169    HZ2  LYS  25           1HZ      LYS  25 -15.264   5.380  -1.464
  170    HZ3  LYS  25           2HZ      LYS  25 -15.702   6.308  -2.808
  171    H    ALA  26           H        ALA  26 -14.035   4.595   2.259
  172    HA   ALA  26           HA       ALA  26 -12.322   6.569   2.834
  173    HB1  ALA  26           3HB      ALA  26 -14.118   6.940   4.115
  174    HB2  ALA  26           1HB      ALA  26 -14.421   5.219   4.353
  175    HB3  ALA  26           2HB      ALA  26 -13.236   6.054   5.359
  176    H    HIS  27           H        HIS  27 -12.154   3.320   4.231
  177    HA   HIS  27           HA       HIS  27  -9.974   3.860   5.963
  178    HB2  HIS  27           1HB      HIS  27 -11.336   1.406   4.952
  179    HB3  HIS  27           2HB      HIS  27  -9.747   1.229   5.691
  180    HD1  HIS  27           HD1      HIS  27 -12.708   0.356   6.789
  181    HD2  HIS  27           HD2      HIS  27 -10.246   3.411   8.155
  182    HE1  HIS  27           HE1      HIS  27 -13.417   0.780   9.164
  183    H    LEU  28           H        LEU  28 -10.174   2.382   2.739
  184    HA   LEU  28           HA       LEU  28  -7.459   1.804   2.421
  185    HB2  LEU  28           1HB      LEU  28  -9.091   0.885   0.927
  186    HB3  LEU  28           2HB      LEU  28  -9.578   2.493   0.395
  187    HG   LEU  28           HG       LEU  28  -7.166   2.695  -0.492
  188   HD11  LEU  28          1HD1      LEU  28  -7.322  -0.297  -0.556
  189   HD12  LEU  28          2HD1      LEU  28  -6.516   0.555   0.761
  190   HD13  LEU  28          3HD1      LEU  28  -5.945   0.751  -0.896
  191   HD21  LEU  28          3HD2      LEU  28  -7.833   1.348  -2.551
  192   HD22  LEU  28          1HD2      LEU  28  -8.923   2.639  -2.045
  193   HD23  LEU  28          2HD2      LEU  28  -9.314   0.959  -1.674
  194    H    ALA  29           H        ALA  29  -9.276   4.638   1.243
  195    HA   ALA  29           HA       ALA  29  -7.186   6.058   0.133
  196    HB1  ALA  29           3HB      ALA  29  -9.857   6.690   1.132
  197    HB2  ALA  29           1HB      ALA  29  -8.732   8.047   1.200
  198    HB3  ALA  29           2HB      ALA  29  -9.035   7.228  -0.333
  199    H    GLN  30           H        GLN  30  -8.300   6.080   3.505
  200    HA   GLN  30           HA       GLN  30  -6.415   7.999   4.397
  201    HB2  GLN  30           1HB      GLN  30  -8.178   5.997   5.769
  202    HB3  GLN  30           2HB      GLN  30  -6.981   6.901   6.687
  203    HG2  GLN  30           1HG      GLN  30  -8.002   8.997   5.937
  204    HG3  GLN  30           2HG      GLN  30  -9.215   8.077   5.049
  205   HE21  GLN  30          1HE2      GLN  30 -10.693   6.775   6.253
  206   HE22  GLN  30          2HE2      GLN  30 -11.084   7.183   7.885
  207    H    HIS  31           H        HIS  31  -6.193   4.655   3.686
  208    HA   HIS  31           HA       HIS  31  -3.858   4.201   5.341
  209    HB2  HIS  31           1HB      HIS  31  -5.030   2.228   5.197
  210    HB3  HIS  31           2HB      HIS  31  -5.561   2.539   3.547
  211    HD1  HIS  31           HD1      HIS  31  -2.211   1.861   5.239
  212    HD2  HIS  31           HD2      HIS  31  -4.350   0.866   1.820
  213    HE1  HIS  31           HE1      HIS  31  -0.744   0.260   3.971
  214    H    GLN  32           H        GLN  32  -4.496   3.959   1.836
  215    HA   GLN  32           HA       GLN  32  -2.047   3.629   0.806
  216    HB2  GLN  32           1HB      GLN  32  -4.162   5.561  -0.143
  217    HB3  GLN  32           2HB      GLN  32  -2.733   5.158  -1.086
  218    HG2  GLN  32           1HG      GLN  32  -3.484   2.726  -0.833
  219    HG3  GLN  32           2HG      GLN  32  -5.031   3.398  -0.321
  220   HE21  GLN  32          1HE2      GLN  32  -3.205   2.401  -2.920
  221   HE22  GLN  32          2HE2      GLN  32  -4.134   3.113  -4.191
  222    H    LYS  33           H        LYS  33  -3.229   6.590   2.273
  223    HA   LYS  33           HA       LYS  33  -1.423   8.474   1.516
  224    HB2  LYS  33           1HB      LYS  33  -1.960   9.656   3.440
  225    HB3  LYS  33           2HB      LYS  33  -3.332   8.567   3.280
  226    HG2  LYS  33           1HG      LYS  33  -2.420   7.098   4.958
  227    HG3  LYS  33           2HG      LYS  33  -0.952   8.073   5.057
  228    HD2  LYS  33           1HD      LYS  33  -2.093   9.877   6.048
  229    HD3  LYS  33           2HD      LYS  33  -3.673   9.228   5.603
  230    HE2  LYS  33           1HE      LYS  33  -3.485   7.472   7.201
  231    HE3  LYS  33           2HE      LYS  33  -1.791   7.851   7.508
  232    HZ1  LYS  33           3HZ      LYS  33  -3.312   8.667   9.249
  233    HZ2  LYS  33           1HZ      LYS  33  -4.051   9.679   8.112
  234    HZ3  LYS  33           2HZ      LYS  33  -2.426   9.910   8.520
  235    H    THR  34           H        THR  34  -0.918   6.025   4.040
  236    HA   THR  34           HA       THR  34   1.647   6.818   4.823
  237    HB   THR  34           HB       THR  34   0.109   5.091   5.935
  238    HG1  THR  34           HG1      THR  34   1.862   4.847   7.080
  239   HG21  THR  34          3HG2      THR  34  -0.251   3.586   4.102
  240   HG22  THR  34          1HG2      THR  34   0.679   2.731   5.331
  241   HG23  THR  34          2HG2      THR  34   1.483   3.350   3.889
  242    H    HIS  35           H        HIS  35   0.574   4.703   2.214
  243    HA   HIS  35           HA       HIS  35   3.155   3.769   1.489
  244    HB2  HIS  35           1HB      HIS  35   0.510   3.861   0.050
  245    HB3  HIS  35           2HB      HIS  35   1.965   3.241  -0.725
  246    HD1  HIS  35           HD1      HIS  35   3.120   1.668   1.693
  247    HD2  HIS  35           HD2      HIS  35  -0.836   1.513   0.432
  248    HE1  HIS  35           HE1      HIS  35   2.228  -0.524   2.544
  249    H    THR  36           H        THR  36   4.573   5.479   1.284
  250    HA   THR  36           HA       THR  36   4.365   7.921   0.210
  251    HB   THR  36           HB       THR  36   6.687   7.751  -0.622
  252    HG1  THR  36           HG1      THR  36   7.154   5.217   0.242
  253   HG21  THR  36          3HG2      THR  36   6.346   6.306   2.005
  254   HG22  THR  36          1HG2      THR  36   6.171   8.049   1.804
  255   HG23  THR  36          2HG2      THR  36   7.726   7.277   1.492
  256    H    GLY  37           H        GLY  37   3.966   8.879  -1.701
  257    HA2  GLY  37           1HA      GLY  37   2.984   7.300  -3.873
  258    HA3  GLY  37           2HA      GLY  37   3.157   9.049  -3.853
  259    H    GLU  38           H        GLU  38   4.714   6.012  -4.587
  260    HA   GLU  38           HA       GLU  38   7.276   6.685  -5.184
  261    HB2  GLU  38           1HB      GLU  38   7.247   4.949  -6.910
  262    HB3  GLU  38           2HB      GLU  38   6.385   4.426  -5.470
  263    HG2  GLU  38           1HG      GLU  38   4.979   5.601  -7.846
  264    HG3  GLU  38           2HG      GLU  38   5.332   3.880  -7.706
  265    H    LYS  39           H        LYS  39   8.368   7.251  -7.180
  266    HA   LYS  39           HA       LYS  39   8.778   8.925  -8.700
  267    HB2  LYS  39           1HB      LYS  39   7.628   6.926  -9.903
  268    HB3  LYS  39           2HB      LYS  39   6.252   8.012 -10.042
  269    HG2  LYS  39           1HG      LYS  39   8.011   9.658 -11.039
  270    HG3  LYS  39           2HG      LYS  39   8.938   8.182 -11.322
  271    HD2  LYS  39           1HD      LYS  39   6.084   8.546 -12.218
  272    HD3  LYS  39           2HD      LYS  39   7.476   8.929 -13.233
  273    HE2  LYS  39           1HE      LYS  39   8.252   6.594 -12.976
  274    HE3  LYS  39           2HE      LYS  39   6.792   6.237 -12.055
  275    HZ1  LYS  39           3HZ      LYS  39   6.539   7.411 -14.736
  276    HZ2  LYS  39           1HZ      LYS  39   5.476   6.389 -13.906
  277    HZ3  LYS  39           2HZ      LYS  39   6.888   5.762 -14.594
  278    HA   PRO  40           HA       PRO  40   5.328  11.671  -7.004
  279    HB2  PRO  40           1HB      PRO  40   6.882  13.131  -5.323
  280    HB3  PRO  40           2HB      PRO  40   6.071  11.640  -4.830
  281    HG2  PRO  40           1HG      PRO  40   8.916  12.065  -5.658
  282    HG3  PRO  40           2HG      PRO  40   8.273  11.091  -4.323
  283    HD2  PRO  40           1HD      PRO  40   9.057  10.001  -6.675
  284    HD3  PRO  40           2HD      PRO  40   7.733   9.326  -5.704
  285    H    SER  41           H        SER  41   5.005  13.824  -7.593
  286    HA   SER  41           HA       SER  41   6.757  14.786  -9.677
  287    HB2  SER  41           1HB      SER  41   4.118  14.873  -9.514
  288    HB3  SER  41           2HB      SER  41   4.440  16.389  -8.672
  289    HG   SER  41           HG       SER  41   5.411  17.189 -10.476
  290    H    GLY  42           H        GLY  42   5.430  16.223  -6.687
  291    HA2  GLY  42           1HA      GLY  42   7.078  17.204  -5.125
  292    HA3  GLY  42           2HA      GLY  42   7.883  17.866  -6.540
  293    HA   PRO  43           HA       PRO  43   3.762  20.313  -5.635
  294    HB2  PRO  43           1HB      PRO  43   3.142  20.387  -2.993
  295    HB3  PRO  43           2HB      PRO  43   2.489  19.173  -4.099
  296    HG2  PRO  43           1HG      PRO  43   4.772  18.951  -2.175
  297    HG3  PRO  43           2HG      PRO  43   3.477  17.788  -2.513
  298    HD2  PRO  43           1HD      PRO  43   5.962  17.546  -3.561
  299    HD3  PRO  43           2HD      PRO  43   4.507  17.005  -4.421
  300    H    SER  44           H        SER  44   4.386  22.364  -5.812
  301    HA   SER  44           HA       SER  44   6.535  23.381  -4.123
  302    HB2  SER  44           1HB      SER  44   6.505  23.699  -6.639
  303    HB3  SER  44           2HB      SER  44   5.161  24.815  -6.401
  304    HG   SER  44           HG       SER  44   7.857  25.105  -5.768
  305    H    SER  45           H        SER  45   5.929  24.180  -2.222
  306    HA   SER  45           HA       SER  45   3.936  26.288  -2.145
  307    HB2  SER  45           1HB      SER  45   2.734  24.076  -1.749
  308    HB3  SER  45           2HB      SER  45   3.647  23.958  -0.245
  309    HG   SER  45           HG       SER  45   2.640  25.776   0.506
  310    H    GLY  46           H        GLY  46   4.770  27.891  -0.991
  311    HA2  GLY  46           1HA      GLY  46   7.073  27.444   0.690
  312    HA3  GLY  46           2HA      GLY  46   6.326  28.993   0.329
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -10.409 -24.831 -10.459
    2    HA2  GLY   1           1HA      GLY   1 -10.231 -26.282  -7.970
    3    HA3  GLY   1           2HA      GLY   1  -8.693 -25.632  -8.519
    4    H    SER   2           H        SER   2 -10.844 -25.037  -6.317
    5    HA   SER   2           HA       SER   2 -10.476 -22.142  -6.477
    6    HB2  SER   2           1HB      SER   2 -13.154 -23.477  -6.015
    7    HB3  SER   2           2HB      SER   2 -12.839 -21.756  -5.794
    8    HG   SER   2           HG       SER   2 -13.470 -21.752  -7.827
    9    H    SER   3           H        SER   3 -10.575 -21.071  -4.453
   10    HA   SER   3           HA       SER   3 -10.320 -22.887  -2.146
   11    HB2  SER   3           1HB      SER   3  -8.264 -21.539  -2.997
   12    HB3  SER   3           2HB      SER   3  -9.060 -20.159  -2.240
   13    HG   SER   3           HG       SER   3  -7.503 -21.551  -0.963
   14    H    GLY   4           H        GLY   4 -12.148 -22.789  -1.004
   15    HA2  GLY   4           1HA      GLY   4 -13.800 -21.912   0.334
   16    HA3  GLY   4           2HA      GLY   4 -12.925 -20.388   0.296
   17    H    SER   5           H        SER   5 -15.850 -21.423  -0.133
   18    HA   SER   5           HA       SER   5 -16.352 -19.797  -2.540
   19    HB2  SER   5           1HB      SER   5 -18.260 -21.161  -3.042
   20    HB3  SER   5           2HB      SER   5 -16.910 -22.254  -2.734
   21    HG   SER   5           HG       SER   5 -17.788 -22.835  -0.842
   22    H    SER   6           H        SER   6 -17.574 -20.719   0.651
   23    HA   SER   6           HA       SER   6 -19.811 -19.136   0.840
   24    HB2  SER   6           1HB      SER   6 -17.800 -20.078   2.848
   25    HB3  SER   6           2HB      SER   6 -19.038 -18.928   3.353
   26    HG   SER   6           HG       SER   6 -20.214 -20.658   3.568
   27    H    GLY   7           H        GLY   7 -19.841 -17.105   0.048
   28    HA2  GLY   7           1HA      GLY   7 -18.320 -15.092   1.497
   29    HA3  GLY   7           2HA      GLY   7 -17.993 -15.200  -0.226
   30    H    THR   8           H        THR   8 -19.733 -13.576   2.023
   31    HA   THR   8           HA       THR   8 -22.068 -13.139   0.311
   32    HB   THR   8           HB       THR   8 -22.584 -13.528   2.646
   33    HG1  THR   8           HG1      THR   8 -23.995 -12.078   1.765
   34   HG21  THR   8          3HG2      THR   8 -21.313 -12.776   4.313
   35   HG22  THR   8          1HG2      THR   8 -21.583 -11.106   3.817
   36   HG23  THR   8          2HG2      THR   8 -20.251 -12.028   3.120
   37    H    GLY   9           H        GLY   9 -19.160 -11.592   1.429
   38    HA2  GLY   9           1HA      GLY   9 -19.797  -9.292  -0.292
   39    HA3  GLY   9           2HA      GLY   9 -19.243  -9.011   1.352
   40    H    GLU  10           H        GLU  10 -18.187  -8.715  -1.603
   41    HA   GLU  10           HA       GLU  10 -15.531  -9.875  -1.095
   42    HB2  GLU  10           1HB      GLU  10 -15.196  -9.452  -3.582
   43    HB3  GLU  10           2HB      GLU  10 -16.334 -10.719  -3.147
   44    HG2  GLU  10           1HG      GLU  10 -17.216  -7.917  -3.755
   45    HG3  GLU  10           2HG      GLU  10 -17.010  -9.138  -5.010
   46    H    LYS  11           H        LYS  11 -14.556  -8.302   0.108
   47    HA   LYS  11           HA       LYS  11 -14.721  -5.636   0.140
   48    HB2  LYS  11           1HB      LYS  11 -12.206  -7.302   0.175
   49    HB3  LYS  11           2HB      LYS  11 -12.208  -5.577   0.519
   50    HG2  LYS  11           1HG      LYS  11 -12.310  -6.483   2.627
   51    HG3  LYS  11           2HG      LYS  11 -14.016  -6.196   2.278
   52    HD2  LYS  11           1HD      LYS  11 -14.473  -8.436   2.001
   53    HD3  LYS  11           2HD      LYS  11 -12.809  -8.830   1.563
   54    HE2  LYS  11           1HE      LYS  11 -12.100  -8.860   3.766
   55    HE3  LYS  11           2HE      LYS  11 -13.436  -7.849   4.316
   56    HZ1  LYS  11           3HZ      LYS  11 -14.167  -9.844   5.053
   57    HZ2  LYS  11           1HZ      LYS  11 -13.347 -10.730   3.868
   58    HZ3  LYS  11           2HZ      LYS  11 -14.795  -9.943   3.486
   59    HA   PRO  12           HA       PRO  12 -13.995  -4.790  -4.260
   60    HB2  PRO  12           1HB      PRO  12 -15.218  -2.367  -4.206
   61    HB3  PRO  12           2HB      PRO  12 -16.106  -3.888  -4.353
   62    HG2  PRO  12           1HG      PRO  12 -15.633  -2.197  -1.928
   63    HG3  PRO  12           2HG      PRO  12 -17.120  -3.008  -2.454
   64    HD2  PRO  12           1HD      PRO  12 -15.510  -4.024  -0.529
   65    HD3  PRO  12           2HD      PRO  12 -16.445  -5.053  -1.632
   66    H    TYR  13           H        TYR  13 -12.685  -3.617  -1.454
   67    HA   TYR  13           HA       TYR  13 -10.953  -1.744  -2.928
   68    HB2  TYR  13           1HB      TYR  13 -11.581  -1.496   0.010
   69    HB3  TYR  13           2HB      TYR  13 -10.817  -0.309  -1.041
   70    HD1  TYR  13           HD1      TYR  13 -12.290   0.562  -3.020
   71    HD2  TYR  13           HD2      TYR  13 -13.846  -1.312   0.469
   72    HE1  TYR  13           HE1      TYR  13 -14.479   1.599  -3.446
   73    HE2  TYR  13           HE2      TYR  13 -16.039  -0.280   0.052
   74    HH   TYR  13           HH       TYR  13 -16.780   1.983  -1.301
   75    H    GLU  14           H        GLU  14  -9.083  -2.770  -3.226
   76    HA   GLU  14           HA       GLU  14  -7.801  -4.004  -0.888
   77    HB2  GLU  14           1HB      GLU  14  -8.834  -5.636  -2.647
   78    HB3  GLU  14           2HB      GLU  14  -7.436  -5.192  -3.616
   79    HG2  GLU  14           1HG      GLU  14  -6.008  -5.869  -1.655
   80    HG3  GLU  14           2HG      GLU  14  -7.468  -6.546  -0.937
   81    H    CYS  15           H        CYS  15  -5.735  -3.426  -0.581
   82    HA   CYS  15           HA       CYS  15  -4.596  -1.376  -2.202
   83    HB2  CYS  15           1HB      CYS  15  -4.312  -1.923   0.368
   84    HB3  CYS  15           2HB      CYS  15  -2.962  -2.893  -0.211
   85    H    LYS  16           H        LYS  16  -2.337  -1.513  -3.044
   86    HA   LYS  16           HA       LYS  16  -1.957  -4.083  -4.428
   87    HB2  LYS  16           1HB      LYS  16  -1.070  -1.301  -5.212
   88    HB3  LYS  16           2HB      LYS  16  -0.692  -2.764  -6.112
   89    HG2  LYS  16           1HG      LYS  16  -3.270  -3.081  -6.166
   90    HG3  LYS  16           2HG      LYS  16  -3.304  -1.355  -5.800
   91    HD2  LYS  16           1HD      LYS  16  -2.020  -0.863  -7.781
   92    HD3  LYS  16           2HD      LYS  16  -1.803  -2.583  -8.112
   93    HE2  LYS  16           1HE      LYS  16  -3.543  -2.114  -9.522
   94    HE3  LYS  16           2HE      LYS  16  -4.434  -2.582  -8.075
   95    HZ1  LYS  16           3HZ      LYS  16  -3.732   0.236  -8.346
   96    HZ2  LYS  16           1HZ      LYS  16  -5.128  -0.475  -7.707
   97    HZ3  LYS  16           2HZ      LYS  16  -4.932  -0.354  -9.383
   98    H    VAL  17           H        VAL  17  -0.260  -1.476  -2.743
   99    HA   VAL  17           HA       VAL  17   2.321  -2.634  -2.902
  100    HB   VAL  17           HB       VAL  17   1.220  -0.647  -0.910
  101   HG11  VAL  17          1HG1      VAL  17   3.489  -0.133  -0.330
  102   HG12  VAL  17          2HG1      VAL  17   3.244  -1.869  -0.127
  103   HG13  VAL  17          3HG1      VAL  17   4.103  -1.258  -1.541
  104   HG21  VAL  17          3HG2      VAL  17   3.117   0.279  -2.924
  105   HG22  VAL  17          1HG2      VAL  17   1.609  -0.329  -3.608
  106   HG23  VAL  17          2HG2      VAL  17   1.576   0.970  -2.416
  107    H    CYS  18           H        CYS  18   0.036  -2.437  -0.167
  108    HA   CYS  18           HA       CYS  18   1.533  -4.479   1.260
  109    HB2  CYS  18           1HB      CYS  18   0.111  -3.988   3.134
  110    HB3  CYS  18           2HB      CYS  18   0.604  -2.459   2.415
  111    H    SER  19           H        SER  19  -1.401  -4.145  -0.578
  112    HA   SER  19           HA       SER  19  -2.815  -5.715  -1.441
  113    HB2  SER  19           1HB      SER  19  -0.673  -7.101  -1.577
  114    HB3  SER  19           2HB      SER  19  -1.188  -7.854  -0.067
  115    HG   SER  19           HG       SER  19  -2.715  -8.905  -1.097
  116    H    LYS  20           H        LYS  20  -3.528  -4.412   0.854
  117    HA   LYS  20           HA       LYS  20  -4.730  -6.477   2.566
  118    HB2  LYS  20           1HB      LYS  20  -3.294  -4.467   3.448
  119    HB3  LYS  20           2HB      LYS  20  -4.781  -3.555   3.223
  120    HG2  LYS  20           1HG      LYS  20  -4.856  -6.110   4.756
  121    HG3  LYS  20           2HG      LYS  20  -4.228  -4.650   5.524
  122    HD2  LYS  20           1HD      LYS  20  -6.437  -3.591   4.562
  123    HD3  LYS  20           2HD      LYS  20  -6.987  -5.268   4.577
  124    HE2  LYS  20           1HE      LYS  20  -5.733  -3.979   6.983
  125    HE3  LYS  20           2HE      LYS  20  -7.460  -3.851   6.650
  126    HZ1  LYS  20           3HZ      LYS  20  -6.668  -5.731   8.156
  127    HZ2  LYS  20           1HZ      LYS  20  -6.114  -6.478   6.743
  128    HZ3  LYS  20           2HZ      LYS  20  -7.758  -6.125   6.924
  129    H    ALA  21           H        ALA  21  -6.931  -6.522   2.957
  130    HA   ALA  21           HA       ALA  21  -8.558  -5.077   0.989
  131    HB1  ALA  21           3HB      ALA  21 -10.254  -6.764   1.369
  132    HB2  ALA  21           1HB      ALA  21  -8.709  -7.532   1.001
  133    HB3  ALA  21           2HB      ALA  21  -9.291  -7.475   2.665
  134    H    PHE  22           H        PHE  22 -10.070  -3.626   1.566
  135    HA   PHE  22           HA       PHE  22 -10.591  -3.266   4.444
  136    HB2  PHE  22           1HB      PHE  22 -10.561  -1.053   2.389
  137    HB3  PHE  22           2HB      PHE  22 -10.651  -0.889   4.139
  138    HD1  PHE  22           HD1      PHE  22  -8.437  -2.097   1.413
  139    HD2  PHE  22           HD2      PHE  22  -8.717  -0.607   5.390
  140    HE1  PHE  22           HE1      PHE  22  -5.985  -1.921   1.516
  141    HE2  PHE  22           HE2      PHE  22  -6.266  -0.427   5.499
  142    HZ   PHE  22           HZ       PHE  22  -4.896  -1.084   3.560
  143    H    THR  23           H        THR  23 -12.674  -2.841   5.084
  144    HA   THR  23           HA       THR  23 -14.753  -3.733   3.344
  145    HB   THR  23           HB       THR  23 -14.893  -4.200   5.724
  146    HG1  THR  23           HG1      THR  23 -17.045  -3.647   5.955
  147   HG21  THR  23          3HG2      THR  23 -13.871  -2.448   6.851
  148   HG22  THR  23          1HG2      THR  23 -15.577  -2.167   7.196
  149   HG23  THR  23          2HG2      THR  23 -14.760  -1.217   5.954
  150    H    GLN  24           H        GLN  24 -13.565  -0.612   4.380
  151    HA   GLN  24           HA       GLN  24 -15.649   0.677   2.744
  152    HB2  GLN  24           1HB      GLN  24 -14.176   1.777   5.144
  153    HB3  GLN  24           2HB      GLN  24 -15.299   2.694   4.148
  154    HG2  GLN  24           1HG      GLN  24 -16.197   0.150   5.415
  155    HG3  GLN  24           2HG      GLN  24 -16.088   1.620   6.381
  156   HE21  GLN  24          1HE2      GLN  24 -18.489   0.403   6.064
  157   HE22  GLN  24          2HE2      GLN  24 -19.513   1.355   5.049
  158    H    LYS  25           H        LYS  25 -15.038   2.434   1.428
  159    HA   LYS  25           HA       LYS  25 -12.485   2.159   0.212
  160    HB2  LYS  25           1HB      LYS  25 -13.178   4.069  -1.180
  161    HB3  LYS  25           2HB      LYS  25 -14.430   2.837  -1.085
  162    HG2  LYS  25           1HG      LYS  25 -15.832   4.157   0.156
  163    HG3  LYS  25           2HG      LYS  25 -14.511   5.116   0.829
  164    HD2  LYS  25           1HD      LYS  25 -14.273   6.369  -1.147
  165    HD3  LYS  25           2HD      LYS  25 -15.220   5.216  -2.090
  166    HE2  LYS  25           1HE      LYS  25 -17.153   5.838  -0.510
  167    HE3  LYS  25           2HE      LYS  25 -16.162   7.229  -0.074
  168    HZ1  LYS  25           3HZ      LYS  25 -17.067   8.219  -1.829
  169    HZ2  LYS  25           1HZ      LYS  25 -17.719   6.777  -2.428
  170    HZ3  LYS  25           2HZ      LYS  25 -16.126   7.205  -2.802
  171    H    ALA  26           H        ALA  26 -13.846   4.384   2.559
  172    HA   ALA  26           HA       ALA  26 -11.923   6.399   2.494
  173    HB1  ALA  26           3HB      ALA  26 -12.591   6.363   5.114
  174    HB2  ALA  26           1HB      ALA  26 -13.581   7.088   3.847
  175    HB3  ALA  26           2HB      ALA  26 -13.935   5.457   4.419
  176    H    HIS  27           H        HIS  27 -11.979   3.380   4.359
  177    HA   HIS  27           HA       HIS  27  -9.682   3.769   5.874
  178    HB2  HIS  27           1HB      HIS  27 -11.464   1.821   5.829
  179    HB3  HIS  27           2HB      HIS  27 -10.277   1.050   4.782
  180    HD1  HIS  27           HD1      HIS  27 -10.941  -0.147   7.529
  181    HD2  HIS  27           HD2      HIS  27  -7.817   2.504   6.840
  182    HE1  HIS  27           HE1      HIS  27  -9.300  -0.542   9.393
  183    H    LEU  28           H        LEU  28 -10.004   2.243   2.677
  184    HA   LEU  28           HA       LEU  28  -7.250   1.715   2.339
  185    HB2  LEU  28           1HB      LEU  28  -8.807   0.512   1.015
  186    HB3  LEU  28           2HB      LEU  28  -9.525   1.997   0.393
  187    HG   LEU  28           HG       LEU  28  -7.105   2.343  -0.603
  188   HD11  LEU  28          1HD1      LEU  28  -6.307   0.246   0.563
  189   HD12  LEU  28          2HD1      LEU  28  -5.959   0.359  -1.162
  190   HD13  LEU  28          3HD1      LEU  28  -7.284  -0.658  -0.594
  191   HD21  LEU  28          3HD2      LEU  28  -7.877   1.332  -2.669
  192   HD22  LEU  28          1HD2      LEU  28  -9.205   2.173  -1.868
  193   HD23  LEU  28          2HD2      LEU  28  -9.100   0.414  -1.788
  194    H    ALA  29           H        ALA  29  -9.304   4.290   0.973
  195    HA   ALA  29           HA       ALA  29  -7.367   5.704  -0.396
  196    HB1  ALA  29           3HB      ALA  29  -9.119   6.985  -0.852
  197    HB2  ALA  29           1HB      ALA  29 -10.052   6.118   0.368
  198    HB3  ALA  29           2HB      ALA  29  -9.155   7.571   0.811
  199    H    GLN  30           H        GLN  30  -8.264   5.933   3.022
  200    HA   GLN  30           HA       GLN  30  -6.417   8.052   3.572
  201    HB2  GLN  30           1HB      GLN  30  -8.254   6.342   5.176
  202    HB3  GLN  30           2HB      GLN  30  -6.937   7.147   6.018
  203    HG2  GLN  30           1HG      GLN  30  -7.798   9.268   4.796
  204    HG3  GLN  30           2HG      GLN  30  -9.279   8.331   4.601
  205   HE21  GLN  30          1HE2      GLN  30  -8.799  10.758   6.138
  206   HE22  GLN  30          2HE2      GLN  30  -9.229  10.387   7.770
  207    H    HIS  31           H        HIS  31  -6.423   4.546   3.954
  208    HA   HIS  31           HA       HIS  31  -4.072   4.294   5.456
  209    HB2  HIS  31           1HB      HIS  31  -5.254   2.317   5.369
  210    HB3  HIS  31           2HB      HIS  31  -5.627   2.491   3.656
  211    HD1  HIS  31           HD1      HIS  31  -2.748   1.542   5.922
  212    HD2  HIS  31           HD2      HIS  31  -3.965   1.121   1.972
  213    HE1  HIS  31           HE1      HIS  31  -1.097  -0.039   4.874
  214    H    GLN  32           H        GLN  32  -4.531   4.046   1.929
  215    HA   GLN  32           HA       GLN  32  -2.097   3.521   0.977
  216    HB2  GLN  32           1HB      GLN  32  -4.008   5.658   0.055
  217    HB3  GLN  32           2HB      GLN  32  -2.542   5.272  -0.836
  218    HG2  GLN  32           1HG      GLN  32  -3.292   3.013  -1.186
  219    HG3  GLN  32           2HG      GLN  32  -4.709   3.292  -0.175
  220   HE21  GLN  32          1HE2      GLN  32  -3.688   3.056  -3.265
  221   HE22  GLN  32          2HE2      GLN  32  -4.909   3.988  -4.057
  222    H    LYS  33           H        LYS  33  -3.059   6.717   2.186
  223    HA   LYS  33           HA       LYS  33  -0.940   8.286   1.672
  224    HB2  LYS  33           1HB      LYS  33  -2.422   7.998   4.284
  225    HB3  LYS  33           2HB      LYS  33  -1.259   9.283   3.985
  226    HG2  LYS  33           1HG      LYS  33  -2.603  10.145   2.183
  227    HG3  LYS  33           2HG      LYS  33  -3.727   8.792   2.330
  228    HD2  LYS  33           1HD      LYS  33  -3.999   9.605   4.776
  229    HD3  LYS  33           2HD      LYS  33  -3.306  11.114   4.177
  230    HE2  LYS  33           1HE      LYS  33  -5.654   9.791   2.848
  231    HE3  LYS  33           2HE      LYS  33  -5.851  10.913   4.193
  232    HZ1  LYS  33           3HZ      LYS  33  -5.939  12.411   2.536
  233    HZ2  LYS  33           1HZ      LYS  33  -5.097  11.436   1.439
  234    HZ3  LYS  33           2HZ      LYS  33  -4.251  12.322   2.605
  235    H    THR  34           H        THR  34  -1.045   5.912   4.316
  236    HA   THR  34           HA       THR  34   1.375   6.330   5.512
  237    HB   THR  34           HB       THR  34   1.425   3.926   6.071
  238    HG1  THR  34           HG1      THR  34   0.171   2.503   5.030
  239   HG21  THR  34          3HG2      THR  34  -0.318   5.742   6.967
  240   HG22  THR  34          1HG2      THR  34  -0.323   4.070   7.524
  241   HG23  THR  34          2HG2      THR  34  -1.458   4.587   6.278
  242    H    HIS  35           H        HIS  35   0.782   4.306   2.645
  243    HA   HIS  35           HA       HIS  35   3.429   3.485   2.245
  244    HB2  HIS  35           1HB      HIS  35   1.156   3.850   0.289
  245    HB3  HIS  35           2HB      HIS  35   2.695   3.111  -0.140
  246    HD1  HIS  35           HD1      HIS  35   3.277   1.079   1.830
  247    HD2  HIS  35           HD2      HIS  35  -0.655   1.924   0.785
  248    HE1  HIS  35           HE1      HIS  35   1.957  -0.965   2.468
  249    H    THR  36           H        THR  36   5.152   4.348   1.199
  250    HA   THR  36           HA       THR  36   4.965   7.187   0.510
  251    HB   THR  36           HB       THR  36   7.422   5.462   0.884
  252    HG1  THR  36           HG1      THR  36   6.772   7.519   2.652
  253   HG21  THR  36          3HG2      THR  36   7.007   8.209  -0.056
  254   HG22  THR  36          1HG2      THR  36   8.401   7.146  -0.244
  255   HG23  THR  36          2HG2      THR  36   8.184   8.060   1.248
  256    H    GLY  37           H        GLY  37   4.506   7.589  -1.558
  257    HA2  GLY  37           1HA      GLY  37   6.165   7.142  -3.680
  258    HA3  GLY  37           2HA      GLY  37   5.126   5.725  -3.657
  259    H    GLU  38           H        GLU  38   2.729   6.228  -3.551
  260    HA   GLU  38           HA       GLU  38   2.178   8.358  -5.489
  261    HB2  GLU  38           1HB      GLU  38   0.886   5.756  -4.819
  262    HB3  GLU  38           2HB      GLU  38  -0.128   7.042  -5.458
  263    HG2  GLU  38           1HG      GLU  38   0.950   7.060  -7.502
  264    HG3  GLU  38           2HG      GLU  38   2.399   6.291  -6.858
  265    H    LYS  39           H        LYS  39   2.617   9.122  -2.818
  266    HA   LYS  39           HA       LYS  39  -0.075   9.769  -1.833
  267    HB2  LYS  39           1HB      LYS  39   1.005  10.316   0.292
  268    HB3  LYS  39           2HB      LYS  39   1.407   8.680  -0.214
  269    HG2  LYS  39           1HG      LYS  39   3.595   9.309  -0.843
  270    HG3  LYS  39           2HG      LYS  39   3.208  11.028  -0.731
  271    HD2  LYS  39           1HD      LYS  39   3.004  10.888   1.656
  272    HD3  LYS  39           2HD      LYS  39   3.159   9.130   1.612
  273    HE2  LYS  39           1HE      LYS  39   5.290   9.764   2.211
  274    HE3  LYS  39           2HE      LYS  39   5.441   9.643   0.459
  275    HZ1  LYS  39           3HZ      LYS  39   5.525  11.909   0.219
  276    HZ2  LYS  39           1HZ      LYS  39   6.329  11.723   1.696
  277    HZ3  LYS  39           2HZ      LYS  39   4.713  12.221   1.670
  278    HA   PRO  40           HA       PRO  40   0.288  13.988  -3.001
  279    HB2  PRO  40           1HB      PRO  40  -1.161  15.180  -1.039
  280    HB3  PRO  40           2HB      PRO  40  -1.898  14.228  -2.333
  281    HG2  PRO  40           1HG      PRO  40  -1.262  13.427   0.481
  282    HG3  PRO  40           2HG      PRO  40  -2.716  13.091  -0.477
  283    HD2  PRO  40           1HD      PRO  40  -0.751  11.263  -0.121
  284    HD3  PRO  40           2HD      PRO  40  -1.721  11.344  -1.605
  285    H    SER  41           H        SER  41   0.597  16.246  -1.787
  286    HA   SER  41           HA       SER  41   3.230  16.234  -0.785
  287    HB2  SER  41           1HB      SER  41   1.087  18.315  -1.033
  288    HB3  SER  41           2HB      SER  41   2.548  18.679  -0.116
  289    HG   SER  41           HG       SER  41   3.753  18.459  -1.921
  290    H    GLY  42           H        GLY  42   0.131  16.885   0.853
  291    HA2  GLY  42           1HA      GLY  42  -0.490  16.423   3.033
  292    HA3  GLY  42           2HA      GLY  42   1.067  15.644   3.271
  293    HA   PRO  43           HA       PRO  43   0.787  20.130   5.019
  294    HB2  PRO  43           1HB      PRO  43  -0.267  19.690   7.482
  295    HB3  PRO  43           2HB      PRO  43  -1.255  20.094   6.073
  296    HG2  PRO  43           1HG      PRO  43  -0.718  17.419   7.306
  297    HG3  PRO  43           2HG      PRO  43  -2.245  18.086   6.700
  298    HD2  PRO  43           1HD      PRO  43  -0.749  16.339   5.271
  299    HD3  PRO  43           2HD      PRO  43  -1.730  17.605   4.505
  300    H    SER  44           H        SER  44   2.765  20.621   5.704
  301    HA   SER  44           HA       SER  44   4.162  18.735   7.476
  302    HB2  SER  44           1HB      SER  44   6.241  19.824   6.690
  303    HB3  SER  44           2HB      SER  44   5.303  19.154   5.356
  304    HG   SER  44           HG       SER  44   5.465  21.091   4.562
  305    H    SER  45           H        SER  45   3.654  19.346   9.513
  306    HA   SER  45           HA       SER  45   3.643  22.153  10.253
  307    HB2  SER  45           1HB      SER  45   3.004  21.260  12.513
  308    HB3  SER  45           2HB      SER  45   1.901  20.797  11.217
  309    HG   SER  45           HG       SER  45   3.813  19.232  12.570
  310    H    GLY  46           H        GLY  46   5.377  19.206  11.266
  311    HA2  GLY  46           1HA      GLY  46   7.876  19.546  11.331
  312    HA3  GLY  46           2HA      GLY  46   7.513  20.956  12.315
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1  -4.743 -33.938  -3.307
    2    HA2  GLY   1           1HA      GLY   1  -3.707 -31.248  -3.869
    3    HA3  GLY   1           2HA      GLY   1  -4.459 -32.324  -5.038
    4    H    SER   2           H        SER   2  -6.625 -32.221  -5.378
    5    HA   SER   2           HA       SER   2  -8.594 -31.037  -5.545
    6    HB2  SER   2           1HB      SER   2  -8.995 -32.755  -3.787
    7    HB3  SER   2           2HB      SER   2  -8.560 -31.562  -2.563
    8    HG   SER   2           HG       SER   2 -10.854 -31.765  -4.123
    9    H    SER   3           H        SER   3  -6.478 -29.247  -5.447
   10    HA   SER   3           HA       SER   3  -7.117 -27.197  -3.494
   11    HB2  SER   3           1HB      SER   3  -5.099 -27.205  -5.752
   12    HB3  SER   3           2HB      SER   3  -5.238 -25.961  -4.510
   13    HG   SER   3           HG       SER   3  -3.873 -27.196  -3.487
   14    H    GLY   4           H        GLY   4  -8.371 -25.470  -3.836
   15    HA2  GLY   4           1HA      GLY   4  -9.006 -24.701  -6.601
   16    HA3  GLY   4           2HA      GLY   4 -10.324 -25.057  -5.494
   17    H    SER   5           H        SER   5 -10.531 -22.679  -6.500
   18    HA   SER   5           HA       SER   5  -9.225 -20.785  -4.675
   19    HB2  SER   5           1HB      SER   5 -10.503 -20.482  -7.382
   20    HB3  SER   5           2HB      SER   5 -10.250 -19.082  -6.339
   21    HG   SER   5           HG       SER   5  -7.984 -19.938  -6.232
   22    H    SER   6           H        SER   6 -10.687 -21.548  -2.961
   23    HA   SER   6           HA       SER   6 -13.255 -20.118  -3.086
   24    HB2  SER   6           1HB      SER   6 -13.500 -22.636  -3.300
   25    HB3  SER   6           2HB      SER   6 -12.885 -22.752  -1.652
   26    HG   SER   6           HG       SER   6 -14.983 -20.981  -2.099
   27    H    GLY   7           H        GLY   7 -10.911 -19.028  -2.062
   28    HA2  GLY   7           1HA      GLY   7 -10.968 -19.369   0.829
   29    HA3  GLY   7           2HA      GLY   7  -9.857 -18.356  -0.081
   30    H    THR   8           H        THR   8 -11.519 -17.802   2.320
   31    HA   THR   8           HA       THR   8 -13.515 -15.914   1.429
   32    HB   THR   8           HB       THR   8 -12.461 -16.409   4.221
   33    HG1  THR   8           HG1      THR   8 -14.201 -17.789   4.429
   34   HG21  THR   8          3HG2      THR   8 -14.308 -14.470   3.123
   35   HG22  THR   8          1HG2      THR   8 -13.641 -14.588   4.751
   36   HG23  THR   8          2HG2      THR   8 -15.091 -15.497   4.324
   37    H    GLY   9           H        GLY   9 -13.399 -13.699   1.489
   38    HA2  GLY   9           1HA      GLY   9 -12.213 -11.733   2.466
   39    HA3  GLY   9           2HA      GLY   9 -10.725 -12.574   2.057
   40    H    GLU  10           H        GLU  10 -13.743 -11.900   0.280
   41    HA   GLU  10           HA       GLU  10 -12.082 -10.798  -1.890
   42    HB2  GLU  10           1HB      GLU  10 -14.629 -12.384  -1.919
   43    HB3  GLU  10           2HB      GLU  10 -14.226 -11.332  -3.269
   44    HG2  GLU  10           1HG      GLU  10 -12.496 -12.637  -3.960
   45    HG3  GLU  10           2HG      GLU  10 -12.158 -13.242  -2.339
   46    H    LYS  11           H        LYS  11 -12.132  -8.727  -0.822
   47    HA   LYS  11           HA       LYS  11 -14.731  -7.382  -0.771
   48    HB2  LYS  11           1HB      LYS  11 -12.021  -6.538   0.267
   49    HB3  LYS  11           2HB      LYS  11 -13.471  -5.548   0.366
   50    HG2  LYS  11           1HG      LYS  11 -14.473  -6.947   1.924
   51    HG3  LYS  11           2HG      LYS  11 -13.421  -8.307   1.523
   52    HD2  LYS  11           1HD      LYS  11 -11.621  -7.421   2.701
   53    HD3  LYS  11           2HD      LYS  11 -12.281  -5.784   2.669
   54    HE2  LYS  11           1HE      LYS  11 -13.470  -8.090   4.208
   55    HE3  LYS  11           2HE      LYS  11 -12.408  -6.865   4.900
   56    HZ1  LYS  11           3HZ      LYS  11 -14.411  -5.490   3.590
   57    HZ2  LYS  11           1HZ      LYS  11 -14.209  -5.653   5.262
   58    HZ3  LYS  11           2HZ      LYS  11 -15.195  -6.739   4.420
   59    HA   PRO  12           HA       PRO  12 -14.062  -5.125  -4.477
   60    HB2  PRO  12           1HB      PRO  12 -15.316  -2.789  -3.897
   61    HB3  PRO  12           2HB      PRO  12 -16.187  -4.294  -4.211
   62    HG2  PRO  12           1HG      PRO  12 -15.500  -3.015  -1.593
   63    HG3  PRO  12           2HG      PRO  12 -17.018  -3.778  -2.102
   64    HD2  PRO  12           1HD      PRO  12 -15.202  -5.043  -0.541
   65    HD3  PRO  12           2HD      PRO  12 -16.226  -5.907  -1.707
   66    H    TYR  13           H        TYR  13 -12.496  -4.388  -1.654
   67    HA   TYR  13           HA       TYR  13 -10.914  -2.287  -2.976
   68    HB2  TYR  13           1HB      TYR  13 -11.399  -2.394   0.000
   69    HB3  TYR  13           2HB      TYR  13 -10.664  -1.091  -0.928
   70    HD1  TYR  13           HD1      TYR  13 -12.131   0.196  -2.556
   71    HD2  TYR  13           HD2      TYR  13 -13.714  -2.435   0.390
   72    HE1  TYR  13           HE1      TYR  13 -14.326   1.286  -2.770
   73    HE2  TYR  13           HE2      TYR  13 -15.913  -1.352   0.183
   74    HH   TYR  13           HH       TYR  13 -16.376   1.591  -1.337
   75    H    GLU  14           H        GLU  14  -8.897  -2.921  -3.304
   76    HA   GLU  14           HA       GLU  14  -7.540  -4.526  -1.273
   77    HB2  GLU  14           1HB      GLU  14  -8.508  -6.044  -3.048
   78    HB3  GLU  14           2HB      GLU  14  -7.430  -5.264  -4.197
   79    HG2  GLU  14           1HG      GLU  14  -5.619  -5.931  -2.385
   80    HG3  GLU  14           2HG      GLU  14  -6.821  -7.164  -2.008
   81    H    CYS  15           H        CYS  15  -5.660  -3.617  -0.803
   82    HA   CYS  15           HA       CYS  15  -4.607  -1.438  -2.273
   83    HB2  CYS  15           1HB      CYS  15  -4.339  -2.096   0.253
   84    HB3  CYS  15           2HB      CYS  15  -2.942  -2.996  -0.329
   85    H    LYS  16           H        LYS  16  -2.323  -1.353  -3.058
   86    HA   LYS  16           HA       LYS  16  -1.751  -3.760  -4.647
   87    HB2  LYS  16           1HB      LYS  16  -1.060  -0.856  -5.101
   88    HB3  LYS  16           2HB      LYS  16  -0.413  -2.168  -6.077
   89    HG2  LYS  16           1HG      LYS  16  -2.182  -1.516  -7.363
   90    HG3  LYS  16           2HG      LYS  16  -2.944  -2.773  -6.386
   91    HD2  LYS  16           1HD      LYS  16  -3.596  -0.894  -4.786
   92    HD3  LYS  16           2HD      LYS  16  -3.140   0.213  -6.083
   93    HE2  LYS  16           1HE      LYS  16  -4.732  -1.012  -7.573
   94    HE3  LYS  16           2HE      LYS  16  -5.268  -1.921  -6.161
   95    HZ1  LYS  16           3HZ      LYS  16  -5.515   0.996  -6.625
   96    HZ2  LYS  16           1HZ      LYS  16  -5.805   0.270  -5.125
   97    HZ3  LYS  16           2HZ      LYS  16  -6.764  -0.132  -6.458
   98    H    VAL  17           H        VAL  17  -0.404  -1.482  -2.370
   99    HA   VAL  17           HA       VAL  17   2.294  -2.449  -2.609
  100    HB   VAL  17           HB       VAL  17   1.015  -0.715  -0.491
  101   HG11  VAL  17          1HG1      VAL  17   2.926  -1.730   0.487
  102   HG12  VAL  17          2HG1      VAL  17   3.887  -1.480  -0.971
  103   HG13  VAL  17          3HG1      VAL  17   3.402  -0.100   0.014
  104   HG21  VAL  17          3HG2      VAL  17   2.982   0.366  -2.412
  105   HG22  VAL  17          1HG2      VAL  17   1.394  -0.043  -3.061
  106   HG23  VAL  17          2HG2      VAL  17   1.534   1.107  -1.732
  107    H    CYS  18           H        CYS  18   0.143  -2.396   0.235
  108    HA   CYS  18           HA       CYS  18   1.519  -4.682   1.352
  109    HB2  CYS  18           1HB      CYS  18   0.203  -4.303   3.326
  110    HB3  CYS  18           2HB      CYS  18   0.757  -2.738   2.738
  111    H    SER  19           H        SER  19  -1.224  -4.117  -0.590
  112    HA   SER  19           HA       SER  19  -2.818  -5.483  -1.467
  113    HB2  SER  19           1HB      SER  19  -0.919  -7.584  -0.413
  114    HB3  SER  19           2HB      SER  19  -2.368  -7.978  -1.338
  115    HG   SER  19           HG       SER  19  -1.534  -6.865  -3.081
  116    H    LYS  20           H        LYS  20  -3.517  -4.347   0.876
  117    HA   LYS  20           HA       LYS  20  -4.736  -6.484   2.484
  118    HB2  LYS  20           1HB      LYS  20  -3.300  -4.657   3.555
  119    HB3  LYS  20           2HB      LYS  20  -4.628  -3.559   3.205
  120    HG2  LYS  20           1HG      LYS  20  -6.095  -4.721   4.648
  121    HG3  LYS  20           2HG      LYS  20  -4.980  -6.081   4.799
  122    HD2  LYS  20           1HD      LYS  20  -4.522  -5.006   6.759
  123    HD3  LYS  20           2HD      LYS  20  -3.370  -4.182   5.707
  124    HE2  LYS  20           1HE      LYS  20  -4.354  -2.378   6.708
  125    HE3  LYS  20           2HE      LYS  20  -5.410  -2.563   5.309
  126    HZ1  LYS  20           3HZ      LYS  20  -7.124  -2.913   6.644
  127    HZ2  LYS  20           1HZ      LYS  20  -6.137  -2.586   7.979
  128    HZ3  LYS  20           2HZ      LYS  20  -6.329  -4.177   7.438
  129    H    ALA  21           H        ALA  21  -6.935  -6.557   2.850
  130    HA   ALA  21           HA       ALA  21  -8.556  -5.045   0.937
  131    HB1  ALA  21           3HB      ALA  21  -8.782  -7.470   0.892
  132    HB2  ALA  21           1HB      ALA  21  -9.256  -7.469   2.590
  133    HB3  ALA  21           2HB      ALA  21 -10.294  -6.709   1.384
  134    H    PHE  22           H        PHE  22 -10.389  -3.884   1.545
  135    HA   PHE  22           HA       PHE  22 -10.724  -3.395   4.425
  136    HB2  PHE  22           1HB      PHE  22 -10.795  -1.241   2.303
  137    HB3  PHE  22           2HB      PHE  22 -10.949  -1.015   4.042
  138    HD1  PHE  22           HD1      PHE  22  -8.606  -2.095   1.386
  139    HD2  PHE  22           HD2      PHE  22  -9.060  -0.718   5.389
  140    HE1  PHE  22           HE1      PHE  22  -6.170  -1.798   1.557
  141    HE2  PHE  22           HE2      PHE  22  -6.624  -0.418   5.565
  142    HZ   PHE  22           HZ       PHE  22  -5.176  -0.957   3.648
  143    H    THR  23           H        THR  23 -12.821  -2.254   4.899
  144    HA   THR  23           HA       THR  23 -14.933  -3.499   3.299
  145    HB   THR  23           HB       THR  23 -14.989  -3.972   5.694
  146    HG1  THR  23           HG1      THR  23 -17.028  -2.521   4.444
  147   HG21  THR  23          3HG2      THR  23 -14.896  -0.994   5.891
  148   HG22  THR  23          1HG2      THR  23 -14.036  -2.209   6.835
  149   HG23  THR  23          2HG2      THR  23 -15.748  -1.911   7.132
  150    H    GLN  24           H        GLN  24 -13.610  -0.414   4.117
  151    HA   GLN  24           HA       GLN  24 -15.729   0.877   2.538
  152    HB2  GLN  24           1HB      GLN  24 -14.444   1.935   5.060
  153    HB3  GLN  24           2HB      GLN  24 -15.491   2.878   4.008
  154    HG2  GLN  24           1HG      GLN  24 -17.250   1.096   4.408
  155    HG3  GLN  24           2HG      GLN  24 -16.204   0.506   5.699
  156   HE21  GLN  24          1HE2      GLN  24 -18.844   2.261   5.178
  157   HE22  GLN  24          2HE2      GLN  24 -18.752   3.383   6.488
  158    H    LYS  25           H        LYS  25 -15.012   3.095   1.762
  159    HA   LYS  25           HA       LYS  25 -12.509   2.788   0.391
  160    HB2  LYS  25           1HB      LYS  25 -14.381   5.162   0.453
  161    HB3  LYS  25           2HB      LYS  25 -13.080   4.896  -0.700
  162    HG2  LYS  25           1HG      LYS  25 -14.220   2.979  -1.613
  163    HG3  LYS  25           2HG      LYS  25 -15.485   3.112  -0.389
  164    HD2  LYS  25           1HD      LYS  25 -16.392   5.016  -1.349
  165    HD3  LYS  25           2HD      LYS  25 -14.896   5.426  -2.192
  166    HE2  LYS  25           1HE      LYS  25 -15.288   3.931  -3.894
  167    HE3  LYS  25           2HE      LYS  25 -16.300   2.892  -2.893
  168    HZ1  LYS  25           3HZ      LYS  25 -17.234   5.601  -3.531
  169    HZ2  LYS  25           1HZ      LYS  25 -18.131   4.200  -3.222
  170    HZ3  LYS  25           2HZ      LYS  25 -17.356   4.396  -4.712
  171    H    ALA  26           H        ALA  26 -13.785   5.245   2.641
  172    HA   ALA  26           HA       ALA  26 -11.655   6.874   2.978
  173    HB1  ALA  26           3HB      ALA  26 -13.163   7.654   4.420
  174    HB2  ALA  26           1HB      ALA  26 -13.895   6.063   4.634
  175    HB3  ALA  26           2HB      ALA  26 -12.485   6.521   5.590
  176    H    HIS  27           H        HIS  27 -12.059   3.688   4.474
  177    HA   HIS  27           HA       HIS  27  -9.775   3.730   6.094
  178    HB2  HIS  27           1HB      HIS  27 -11.237   1.428   4.792
  179    HB3  HIS  27           2HB      HIS  27  -9.932   1.214   5.955
  180    HD1  HIS  27           HD1      HIS  27 -11.374   0.156   7.763
  181    HD2  HIS  27           HD2      HIS  27 -12.745   3.882   6.537
  182    HE1  HIS  27           HE1      HIS  27 -13.145   0.802   9.428
  183    H    LEU  28           H        LEU  28 -10.195   2.267   2.867
  184    HA   LEU  28           HA       LEU  28  -7.492   1.565   2.526
  185    HB2  LEU  28           1HB      LEU  28  -9.002   0.470   1.132
  186    HB3  LEU  28           2HB      LEU  28  -9.793   1.970   0.654
  187    HG   LEU  28           HG       LEU  28  -7.597   2.523  -0.549
  188   HD11  LEU  28          1HD1      LEU  28  -7.089  -0.340  -0.884
  189   HD12  LEU  28          2HD1      LEU  28  -6.681   0.292   0.710
  190   HD13  LEU  28          3HD1      LEU  28  -5.961   1.007  -0.732
  191   HD21  LEU  28          3HD2      LEU  28  -9.898   1.517  -1.422
  192   HD22  LEU  28          1HD2      LEU  28  -8.848   0.159  -1.827
  193   HD23  LEU  28          2HD2      LEU  28  -8.511   1.760  -2.485
  194    H    ALA  29           H        ALA  29  -9.315   4.269   1.073
  195    HA   ALA  29           HA       ALA  29  -7.240   5.553  -0.203
  196    HB1  ALA  29           3HB      ALA  29  -9.900   6.269   0.711
  197    HB2  ALA  29           1HB      ALA  29  -8.788   7.639   0.735
  198    HB3  ALA  29           2HB      ALA  29  -9.044   6.736  -0.759
  199    H    GLN  30           H        GLN  30  -8.399   6.184   3.111
  200    HA   GLN  30           HA       GLN  30  -6.454   8.090   3.768
  201    HB2  GLN  30           1HB      GLN  30  -8.606   7.522   5.019
  202    HB3  GLN  30           2HB      GLN  30  -7.710   6.193   5.744
  203    HG2  GLN  30           1HG      GLN  30  -7.585   7.914   7.308
  204    HG3  GLN  30           2HG      GLN  30  -6.025   7.946   6.488
  205   HE21  GLN  30          1HE2      GLN  30  -5.407   9.744   5.437
  206   HE22  GLN  30          2HE2      GLN  30  -6.361  11.179   5.305
  207    H    HIS  31           H        HIS  31  -6.312   4.640   3.603
  208    HA   HIS  31           HA       HIS  31  -3.975   4.354   5.247
  209    HB2  HIS  31           1HB      HIS  31  -5.189   2.387   5.208
  210    HB3  HIS  31           2HB      HIS  31  -5.594   2.546   3.502
  211    HD1  HIS  31           HD1      HIS  31  -2.509   1.839   5.616
  212    HD2  HIS  31           HD2      HIS  31  -4.137   0.921   1.905
  213    HE1  HIS  31           HE1      HIS  31  -0.927   0.182   4.579
  214    H    GLN  32           H        GLN  32  -4.624   4.366   1.758
  215    HA   GLN  32           HA       GLN  32  -2.247   3.734   0.659
  216    HB2  GLN  32           1HB      GLN  32  -3.998   6.071  -0.118
  217    HB3  GLN  32           2HB      GLN  32  -2.721   5.405  -1.128
  218    HG2  GLN  32           1HG      GLN  32  -3.918   3.225  -1.089
  219    HG3  GLN  32           2HG      GLN  32  -5.239   4.023  -0.236
  220   HE21  GLN  32          1HE2      GLN  32  -6.410   3.192  -2.154
  221   HE22  GLN  32          2HE2      GLN  32  -6.473   4.196  -3.558
  222    H    LYS  33           H        LYS  33  -3.000   6.740   2.323
  223    HA   LYS  33           HA       LYS  33  -0.858   8.324   1.675
  224    HB2  LYS  33           1HB      LYS  33  -2.365   7.975   4.253
  225    HB3  LYS  33           2HB      LYS  33  -1.044   9.129   4.128
  226    HG2  LYS  33           1HG      LYS  33  -2.937  10.404   3.712
  227    HG3  LYS  33           2HG      LYS  33  -2.306  10.059   2.100
  228    HD2  LYS  33           1HD      LYS  33  -3.928   8.310   1.782
  229    HD3  LYS  33           2HD      LYS  33  -4.484   8.467   3.451
  230    HE2  LYS  33           1HE      LYS  33  -5.644  10.388   3.028
  231    HE3  LYS  33           2HE      LYS  33  -4.563  10.885   1.727
  232    HZ1  LYS  33           3HZ      LYS  33  -5.974   8.481   1.100
  233    HZ2  LYS  33           1HZ      LYS  33  -5.858   9.922   0.221
  234    HZ3  LYS  33           2HZ      LYS  33  -7.031   9.761   1.429
  235    H    THR  34           H        THR  34  -0.968   5.852   4.231
  236    HA   THR  34           HA       THR  34   1.602   6.160   5.230
  237    HB   THR  34           HB       THR  34  -0.206   4.675   6.175
  238    HG1  THR  34           HG1      THR  34   2.499   3.949   5.908
  239   HG21  THR  34          3HG2      THR  34   0.284   3.289   3.691
  240   HG22  THR  34          1HG2      THR  34  -1.009   3.055   4.867
  241   HG23  THR  34          2HG2      THR  34   0.530   2.216   5.069
  242    H    HIS  35           H        HIS  35   0.570   4.866   2.212
  243    HA   HIS  35           HA       HIS  35   3.109   3.518   1.728
  244    HB2  HIS  35           1HB      HIS  35   0.514   3.690   0.218
  245    HB3  HIS  35           2HB      HIS  35   1.972   3.074  -0.553
  246    HD1  HIS  35           HD1      HIS  35   3.126   1.334   1.656
  247    HD2  HIS  35           HD2      HIS  35  -0.917   1.439   0.701
  248    HE1  HIS  35           HE1      HIS  35   2.183  -0.847   2.480
  249    H    THR  36           H        THR  36   4.741   4.364   0.595
  250    HA   THR  36           HA       THR  36   5.009   7.042   0.049
  251    HB   THR  36           HB       THR  36   6.374   4.794  -1.446
  252    HG1  THR  36           HG1      THR  36   6.699   5.896   1.099
  253   HG21  THR  36          3HG2      THR  36   7.050   6.594  -2.670
  254   HG22  THR  36          1HG2      THR  36   8.208   6.732  -1.347
  255   HG23  THR  36          2HG2      THR  36   6.757   7.735  -1.358
  256    H    GLY  37           H        GLY  37   4.365   8.401  -1.509
  257    HA2  GLY  37           1HA      GLY  37   4.098   8.085  -4.174
  258    HA3  GLY  37           2HA      GLY  37   2.595   7.402  -3.571
  259    H    GLU  38           H        GLU  38   4.542  10.258  -2.694
  260    HA   GLU  38           HA       GLU  38   2.497  12.060  -3.606
  261    HB2  GLU  38           1HB      GLU  38   1.866  12.994  -1.500
  262    HB3  GLU  38           2HB      GLU  38   1.630  11.255  -1.393
  263    HG2  GLU  38           1HG      GLU  38   2.607  11.873   0.638
  264    HG3  GLU  38           2HG      GLU  38   3.913  11.154  -0.302
  265    H    LYS  39           H        LYS  39   3.284  14.080  -3.966
  266    HA   LYS  39           HA       LYS  39   5.752  14.951  -2.720
  267    HB2  LYS  39           1HB      LYS  39   6.403  13.553  -4.722
  268    HB3  LYS  39           2HB      LYS  39   5.611  14.758  -5.730
  269    HG2  LYS  39           1HG      LYS  39   7.235  16.321  -5.385
  270    HG3  LYS  39           2HG      LYS  39   7.666  15.683  -3.796
  271    HD2  LYS  39           1HD      LYS  39   9.488  15.022  -5.025
  272    HD3  LYS  39           2HD      LYS  39   8.450  13.605  -5.201
  273    HE2  LYS  39           1HE      LYS  39   7.765  14.273  -7.373
  274    HE3  LYS  39           2HE      LYS  39   8.482  15.872  -7.180
  275    HZ1  LYS  39           3HZ      LYS  39  10.628  15.006  -7.365
  276    HZ2  LYS  39           1HZ      LYS  39   9.753  14.189  -8.561
  277    HZ3  LYS  39           2HZ      LYS  39  10.122  13.412  -7.105
  278    HA   PRO  40           HA       PRO  40   3.409  18.705  -3.095
  279    HB2  PRO  40           1HB      PRO  40   5.277  20.340  -1.997
  280    HB3  PRO  40           2HB      PRO  40   4.265  19.256  -1.035
  281    HG2  PRO  40           1HG      PRO  40   7.087  18.886  -1.965
  282    HG3  PRO  40           2HG      PRO  40   6.375  18.529  -0.381
  283    HD2  PRO  40           1HD      PRO  40   6.828  16.613  -2.240
  284    HD3  PRO  40           2HD      PRO  40   5.472  16.533  -1.096
  285    H    SER  41           H        SER  41   3.666  20.846  -4.083
  286    HA   SER  41           HA       SER  41   5.453  20.707  -6.409
  287    HB2  SER  41           1HB      SER  41   3.938  22.297  -7.476
  288    HB3  SER  41           2HB      SER  41   3.025  20.919  -6.863
  289    HG   SER  41           HG       SER  41   3.335  23.106  -5.167
  290    H    GLY  42           H        GLY  42   6.993  22.207  -6.778
  291    HA2  GLY  42           1HA      GLY  42   8.073  23.733  -4.747
  292    HA3  GLY  42           2HA      GLY  42   8.355  24.030  -6.456
  293    HA   PRO  43           HA       PRO  43   6.391  27.928  -5.960
  294    HB2  PRO  43           1HB      PRO  43   5.722  28.413  -8.546
  295    HB3  PRO  43           2HB      PRO  43   7.382  28.514  -7.948
  296    HG2  PRO  43           1HG      PRO  43   6.035  26.288  -9.428
  297    HG3  PRO  43           2HG      PRO  43   7.661  26.959  -9.655
  298    HD2  PRO  43           1HD      PRO  43   7.210  24.661  -8.296
  299    HD3  PRO  43           2HD      PRO  43   8.535  25.768  -7.886
  300    H    SER  44           H        SER  44   4.348  28.945  -6.004
  301    HA   SER  44           HA       SER  44   2.140  27.217  -5.651
  302    HB2  SER  44           1HB      SER  44   0.815  29.349  -5.533
  303    HB3  SER  44           2HB      SER  44   2.208  29.306  -4.452
  304    HG   SER  44           HG       SER  44   1.666  31.137  -6.223
  305    H    SER  45           H        SER  45   0.862  26.315  -7.111
  306    HA   SER  45           HA       SER  45   0.721  27.525  -9.795
  307    HB2  SER  45           1HB      SER  45   1.777  25.207  -9.541
  308    HB3  SER  45           2HB      SER  45   0.154  24.628  -9.168
  309    HG   SER  45           HG       SER  45   0.945  25.972 -11.541
  310    H    GLY  46           H        GLY  46  -1.348  26.932 -10.984
  311    HA2  GLY  46           1HA      GLY  46  -3.540  28.108  -9.894
  312    HA3  GLY  46           2HA      GLY  46  -3.652  26.847 -11.113
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1   1.800 -27.342   0.001
    2    HA2  GLY   1           1HA      GLY   1  -0.012 -26.170   2.010
    3    HA3  GLY   1           2HA      GLY   1   0.850 -25.258   0.779
    4    H    SER   2           H        SER   2  -1.735 -24.716   0.976
    5    HA   SER   2           HA       SER   2  -2.771 -25.614  -1.561
    6    HB2  SER   2           1HB      SER   2  -4.394 -26.145   0.938
    7    HB3  SER   2           2HB      SER   2  -4.872 -26.496  -0.723
    8    HG   SER   2           HG       SER   2  -3.452 -28.136  -0.804
    9    H    SER   3           H        SER   3  -4.438 -24.292  -2.365
   10    HA   SER   3           HA       SER   3  -4.797 -21.783  -0.863
   11    HB2  SER   3           1HB      SER   3  -5.120 -20.697  -3.070
   12    HB3  SER   3           2HB      SER   3  -3.532 -21.451  -2.922
   13    HG   SER   3           HG       SER   3  -4.607 -23.320  -3.991
   14    H    GLY   4           H        GLY   4  -6.810 -21.043  -0.462
   15    HA2  GLY   4           1HA      GLY   4  -9.134 -21.242  -1.785
   16    HA3  GLY   4           2HA      GLY   4  -9.022 -22.832  -1.045
   17    H    SER   5           H        SER   5  -9.958 -19.612  -0.620
   18    HA   SER   5           HA       SER   5 -10.763 -20.189   2.123
   19    HB2  SER   5           1HB      SER   5  -9.039 -17.840   1.324
   20    HB3  SER   5           2HB      SER   5  -9.972 -17.876   2.820
   21    HG   SER   5           HG       SER   5  -8.792 -20.037   3.052
   22    H    SER   6           H        SER   6 -12.879 -19.867   2.130
   23    HA   SER   6           HA       SER   6 -13.982 -17.675   0.502
   24    HB2  SER   6           1HB      SER   6 -14.741 -19.967  -0.114
   25    HB3  SER   6           2HB      SER   6 -15.415 -20.146   1.506
   26    HG   SER   6           HG       SER   6 -16.468 -17.973   0.774
   27    H    GLY   7           H        GLY   7 -14.174 -15.948   1.804
   28    HA2  GLY   7           1HA      GLY   7 -15.136 -16.324   4.547
   29    HA3  GLY   7           2HA      GLY   7 -14.409 -14.861   3.900
   30    H    THR   8           H        THR   8 -15.883 -13.307   4.133
   31    HA   THR   8           HA       THR   8 -18.685 -13.893   3.492
   32    HB   THR   8           HB       THR   8 -18.261 -12.854   5.682
   33    HG1  THR   8           HG1      THR   8 -19.817 -11.207   5.424
   34   HG21  THR   8          3HG2      THR   8 -16.287 -11.568   5.254
   35   HG22  THR   8          1HG2      THR   8 -17.566 -10.444   5.713
   36   HG23  THR   8          2HG2      THR   8 -17.109 -10.616   4.018
   37    H    GLY   9           H        GLY   9 -16.747 -13.612   1.384
   38    HA2  GLY   9           1HA      GLY   9 -17.268 -12.720  -0.777
   39    HA3  GLY   9           2HA      GLY   9 -17.956 -11.308   0.012
   40    H    GLU  10           H        GLU  10 -16.183 -11.040  -2.081
   41    HA   GLU  10           HA       GLU  10 -13.596 -10.397  -0.879
   42    HB2  GLU  10           1HB      GLU  10 -14.580 -10.703  -3.693
   43    HB3  GLU  10           2HB      GLU  10 -13.109  -9.794  -3.377
   44    HG2  GLU  10           1HG      GLU  10 -13.594 -12.647  -2.554
   45    HG3  GLU  10           2HG      GLU  10 -12.671 -12.133  -3.964
   46    H    LYS  11           H        LYS  11 -13.190  -8.418  -0.176
   47    HA   LYS  11           HA       LYS  11 -14.984  -6.266  -0.452
   48    HB2  LYS  11           1HB      LYS  11 -12.227  -6.608   0.627
   49    HB3  LYS  11           2HB      LYS  11 -12.793  -4.972   0.319
   50    HG2  LYS  11           1HG      LYS  11 -13.277  -5.410   2.576
   51    HG3  LYS  11           2HG      LYS  11 -14.816  -5.544   1.721
   52    HD2  LYS  11           1HD      LYS  11 -14.611  -7.970   1.699
   53    HD3  LYS  11           2HD      LYS  11 -13.041  -7.859   2.498
   54    HE2  LYS  11           1HE      LYS  11 -13.959  -7.308   4.522
   55    HE3  LYS  11           2HE      LYS  11 -15.378  -6.556   3.796
   56    HZ1  LYS  11           3HZ      LYS  11 -15.364  -9.296   3.169
   57    HZ2  LYS  11           1HZ      LYS  11 -16.495  -8.428   4.080
   58    HZ3  LYS  11           2HZ      LYS  11 -15.155  -9.125   4.839
   59    HA   PRO  12           HA       PRO  12 -13.895  -4.648  -4.407
   60    HB2  PRO  12           1HB      PRO  12 -14.902  -2.145  -4.101
   61    HB3  PRO  12           2HB      PRO  12 -15.922  -3.567  -4.348
   62    HG2  PRO  12           1HG      PRO  12 -15.238  -2.145  -1.804
   63    HG3  PRO  12           2HG      PRO  12 -16.803  -2.779  -2.345
   64    HD2  PRO  12           1HD      PRO  12 -15.234  -4.093  -0.573
   65    HD3  PRO  12           2HD      PRO  12 -16.285  -4.938  -1.728
   66    H    TYR  13           H        TYR  13 -12.668  -3.474  -1.441
   67    HA   TYR  13           HA       TYR  13 -10.786  -1.685  -2.820
   68    HB2  TYR  13           1HB      TYR  13 -11.215  -1.860   0.160
   69    HB3  TYR  13           2HB      TYR  13 -10.437  -0.569  -0.749
   70    HD1  TYR  13           HD1      TYR  13 -11.881   0.837  -2.304
   71    HD2  TYR  13           HD2      TYR  13 -13.515  -1.784   0.622
   72    HE1  TYR  13           HE1      TYR  13 -14.019   2.047  -2.422
   73    HE2  TYR  13           HE2      TYR  13 -15.657  -0.582   0.512
   74    HH   TYR  13           HH       TYR  13 -16.113   2.160  -1.701
   75    H    GLU  14           H        GLU  14  -8.842  -2.476  -3.232
   76    HA   GLU  14           HA       GLU  14  -7.540  -4.196  -1.262
   77    HB2  GLU  14           1HB      GLU  14  -8.715  -5.568  -3.091
   78    HB3  GLU  14           2HB      GLU  14  -7.482  -4.943  -4.177
   79    HG2  GLU  14           1HG      GLU  14  -6.719  -7.048  -3.480
   80    HG3  GLU  14           2HG      GLU  14  -5.772  -5.870  -2.572
   81    H    CYS  15           H        CYS  15  -5.504  -3.590  -0.927
   82    HA   CYS  15           HA       CYS  15  -4.356  -1.487  -2.523
   83    HB2  CYS  15           1HB      CYS  15  -4.159  -1.654  -0.012
   84    HB3  CYS  15           2HB      CYS  15  -3.054  -3.002  -0.257
   85    H    LYS  16           H        LYS  16  -2.052  -1.629  -3.242
   86    HA   LYS  16           HA       LYS  16  -1.585  -4.236  -4.526
   87    HB2  LYS  16           1HB      LYS  16  -0.533  -3.112  -6.320
   88    HB3  LYS  16           2HB      LYS  16  -1.976  -2.173  -5.963
   89    HG2  LYS  16           1HG      LYS  16  -0.797  -0.390  -5.186
   90    HG3  LYS  16           2HG      LYS  16   0.551  -1.382  -4.627
   91    HD2  LYS  16           1HD      LYS  16   0.981  -1.819  -7.131
   92    HD3  LYS  16           2HD      LYS  16  -0.061  -0.419  -7.401
   93    HE2  LYS  16           1HE      LYS  16   2.353  -0.372  -5.600
   94    HE3  LYS  16           2HE      LYS  16   2.409   0.063  -7.307
   95    HZ1  LYS  16           3HZ      LYS  16   1.896   2.102  -6.621
   96    HZ2  LYS  16           1HZ      LYS  16   1.459   1.581  -5.072
   97    HZ3  LYS  16           2HZ      LYS  16   0.333   1.524  -6.332
   98    H    VAL  17           H        VAL  17  -0.189  -1.761  -2.511
   99    HA   VAL  17           HA       VAL  17   2.494  -2.746  -2.622
  100    HB   VAL  17           HB       VAL  17   1.150  -0.914  -0.632
  101   HG11  VAL  17          1HG1      VAL  17   3.607  -0.282  -0.178
  102   HG12  VAL  17          2HG1      VAL  17   2.967  -1.754   0.556
  103   HG13  VAL  17          3HG1      VAL  17   3.984  -1.854  -0.882
  104   HG21  VAL  17          3HG2      VAL  17   3.074  -0.257  -2.858
  105   HG22  VAL  17          1HG2      VAL  17   1.321  -0.109  -2.986
  106   HG23  VAL  17          2HG2      VAL  17   2.207   0.878  -1.823
  107    H    CYS  18           H        CYS  18   0.173  -2.674   0.090
  108    HA   CYS  18           HA       CYS  18   1.588  -4.882   1.351
  109    HB2  CYS  18           1HB      CYS  18   0.166  -4.445   3.280
  110    HB3  CYS  18           2HB      CYS  18   0.884  -2.942   2.709
  111    H    SER  19           H        SER  19  -1.202  -4.334  -0.566
  112    HA   SER  19           HA       SER  19  -2.763  -5.743  -1.440
  113    HB2  SER  19           1HB      SER  19  -1.154  -7.958  -0.148
  114    HB3  SER  19           2HB      SER  19  -2.343  -8.139  -1.438
  115    HG   SER  19           HG       SER  19   0.001  -8.022  -2.013
  116    H    LYS  20           H        LYS  20  -3.417  -4.473   0.885
  117    HA   LYS  20           HA       LYS  20  -4.795  -6.513   2.496
  118    HB2  LYS  20           1HB      LYS  20  -3.331  -5.064   3.793
  119    HB3  LYS  20           2HB      LYS  20  -4.122  -3.636   3.139
  120    HG2  LYS  20           1HG      LYS  20  -6.158  -4.164   4.288
  121    HG3  LYS  20           2HG      LYS  20  -5.504  -5.715   4.821
  122    HD2  LYS  20           1HD      LYS  20  -4.210  -3.099   5.542
  123    HD3  LYS  20           2HD      LYS  20  -5.504  -3.806   6.513
  124    HE2  LYS  20           1HE      LYS  20  -3.014  -5.326   5.785
  125    HE3  LYS  20           2HE      LYS  20  -3.113  -4.313   7.224
  126    HZ1  LYS  20           3HZ      LYS  20  -3.625  -6.725   7.562
  127    HZ2  LYS  20           1HZ      LYS  20  -5.035  -6.495   6.657
  128    HZ3  LYS  20           2HZ      LYS  20  -4.818  -5.659   8.111
  129    H    ALA  21           H        ALA  21  -6.984  -6.498   2.716
  130    HA   ALA  21           HA       ALA  21  -8.451  -4.723   0.906
  131    HB1  ALA  21           3HB      ALA  21  -8.867  -7.063   0.559
  132    HB2  ALA  21           1HB      ALA  21  -9.263  -7.289   2.263
  133    HB3  ALA  21           2HB      ALA  21 -10.320  -6.325   1.231
  134    H    PHE  22           H        PHE  22 -10.472  -3.772   1.600
  135    HA   PHE  22           HA       PHE  22 -10.784  -3.450   4.493
  136    HB2  PHE  22           1HB      PHE  22 -10.713  -1.106   2.584
  137    HB3  PHE  22           2HB      PHE  22 -10.927  -1.036   4.330
  138    HD1  PHE  22           HD1      PHE  22  -8.514  -2.057   1.700
  139    HD2  PHE  22           HD2      PHE  22  -9.088  -0.823   5.733
  140    HE1  PHE  22           HE1      PHE  22  -6.078  -1.864   1.984
  141    HE2  PHE  22           HE2      PHE  22  -6.653  -0.627   6.023
  142    HZ   PHE  22           HZ       PHE  22  -5.144  -1.147   4.148
  143    H    THR  23           H        THR  23 -12.868  -2.593   5.120
  144    HA   THR  23           HA       THR  23 -14.977  -3.631   3.470
  145    HB   THR  23           HB       THR  23 -16.482  -2.921   5.287
  146    HG1  THR  23           HG1      THR  23 -15.726  -1.176   6.270
  147   HG21  THR  23          3HG2      THR  23 -15.392  -4.267   7.128
  148   HG22  THR  23          1HG2      THR  23 -13.975  -4.391   6.086
  149   HG23  THR  23          2HG2      THR  23 -15.515  -5.075   5.565
  150    H    GLN  24           H        GLN  24 -13.940  -0.416   4.536
  151    HA   GLN  24           HA       GLN  24 -15.796   0.750   2.568
  152    HB2  GLN  24           1HB      GLN  24 -14.891   1.698   5.261
  153    HB3  GLN  24           2HB      GLN  24 -15.384   2.870   4.046
  154    HG2  GLN  24           1HG      GLN  24 -17.526   1.488   3.850
  155    HG3  GLN  24           2HG      GLN  24 -17.020   0.735   5.362
  156   HE21  GLN  24          1HE2      GLN  24 -17.677   1.661   7.162
  157   HE22  GLN  24          2HE2      GLN  24 -18.227   3.291   7.325
  158    H    LYS  25           H        LYS  25 -15.051   2.801   1.587
  159    HA   LYS  25           HA       LYS  25 -12.419   2.484   0.526
  160    HB2  LYS  25           1HB      LYS  25 -12.923   4.520  -0.755
  161    HB3  LYS  25           2HB      LYS  25 -14.232   3.351  -0.856
  162    HG2  LYS  25           1HG      LYS  25 -15.548   4.603   0.712
  163    HG3  LYS  25           2HG      LYS  25 -14.209   5.713   1.010
  164    HD2  LYS  25           1HD      LYS  25 -15.243   5.358  -1.771
  165    HD3  LYS  25           2HD      LYS  25 -16.131   6.377  -0.635
  166    HE2  LYS  25           1HE      LYS  25 -14.745   7.947  -1.532
  167    HE3  LYS  25           2HE      LYS  25 -13.715   7.379  -0.218
  168    HZ1  LYS  25           3HZ      LYS  25 -13.188   7.347  -2.964
  169    HZ2  LYS  25           1HZ      LYS  25 -13.289   5.739  -2.446
  170    HZ3  LYS  25           2HZ      LYS  25 -12.201   6.799  -1.703
  171    H    ALA  26           H        ALA  26 -13.943   4.788   2.744
  172    HA   ALA  26           HA       ALA  26 -11.991   6.662   3.075
  173    HB1  ALA  26           3HB      ALA  26 -14.238   6.520   4.234
  174    HB2  ALA  26           1HB      ALA  26 -13.451   5.481   5.422
  175    HB3  ALA  26           2HB      ALA  26 -12.899   7.141   5.199
  176    H    HIS  27           H        HIS  27 -12.058   3.403   4.419
  177    HA   HIS  27           HA       HIS  27  -9.770   3.716   6.076
  178    HB2  HIS  27           1HB      HIS  27 -11.665   1.868   6.027
  179    HB3  HIS  27           2HB      HIS  27 -10.521   1.044   4.971
  180    HD1  HIS  27           HD1      HIS  27 -11.386   0.198   7.944
  181    HD2  HIS  27           HD2      HIS  27  -7.835   2.027   6.799
  182    HE1  HIS  27           HE1      HIS  27  -9.724  -0.375   9.742
  183    H    LEU  28           H        LEU  28 -10.251   2.357   2.832
  184    HA   LEU  28           HA       LEU  28  -7.586   1.563   2.408
  185    HB2  LEU  28           1HB      LEU  28  -9.306   0.692   1.010
  186    HB3  LEU  28           2HB      LEU  28  -9.793   2.308   0.503
  187    HG   LEU  28           HG       LEU  28  -7.464   2.465  -0.563
  188   HD11  LEU  28          1HD1      LEU  28  -6.220   0.565  -0.926
  189   HD12  LEU  28          2HD1      LEU  28  -7.586  -0.515  -0.648
  190   HD13  LEU  28          3HD1      LEU  28  -6.808   0.290   0.714
  191   HD21  LEU  28          3HD2      LEU  28  -9.933   1.593  -1.492
  192   HD22  LEU  28          1HD2      LEU  28  -8.780   0.415  -2.120
  193   HD23  LEU  28          2HD2      LEU  28  -8.565   2.131  -2.468
  194    H    ALA  29           H        ALA  29  -9.287   4.419   1.104
  195    HA   ALA  29           HA       ALA  29  -7.131   5.692  -0.049
  196    HB1  ALA  29           3HB      ALA  29  -8.692   7.750   1.014
  197    HB2  ALA  29           1HB      ALA  29  -8.819   7.029  -0.590
  198    HB3  ALA  29           2HB      ALA  29  -9.805   6.410   0.736
  199    H    GLN  30           H        GLN  30  -8.300   5.997   3.295
  200    HA   GLN  30           HA       GLN  30  -6.431   7.904   4.145
  201    HB2  GLN  30           1HB      GLN  30  -8.132   5.874   5.534
  202    HB3  GLN  30           2HB      GLN  30  -6.899   6.730   6.451
  203    HG2  GLN  30           1HG      GLN  30  -9.172   7.976   4.921
  204    HG3  GLN  30           2HG      GLN  30  -9.044   7.822   6.673
  205   HE21  GLN  30          1HE2      GLN  30  -7.281   8.960   7.721
  206   HE22  GLN  30          2HE2      GLN  30  -6.719  10.448   7.048
  207    H    HIS  31           H        HIS  31  -6.050   4.602   3.385
  208    HA   HIS  31           HA       HIS  31  -3.613   4.326   4.968
  209    HB2  HIS  31           1HB      HIS  31  -4.811   2.338   5.088
  210    HB3  HIS  31           2HB      HIS  31  -5.337   2.434   3.410
  211    HD1  HIS  31           HD1      HIS  31  -2.353   1.492   5.504
  212    HD2  HIS  31           HD2      HIS  31  -3.686   1.190   1.580
  213    HE1  HIS  31           HE1      HIS  31  -0.731  -0.053   4.360
  214    H    GLN  32           H        GLN  32  -4.653   4.196   1.573
  215    HA   GLN  32           HA       GLN  32  -2.354   3.649   0.256
  216    HB2  GLN  32           1HB      GLN  32  -4.621   5.489  -0.348
  217    HB3  GLN  32           2HB      GLN  32  -3.207   5.546  -1.392
  218    HG2  GLN  32           1HG      GLN  32  -3.460   3.258  -1.992
  219    HG3  GLN  32           2HG      GLN  32  -4.708   3.017  -0.770
  220   HE21  GLN  32          1HE2      GLN  32  -4.609   2.764  -3.778
  221   HE22  GLN  32          2HE2      GLN  32  -5.989   3.649  -4.322
  222    H    LYS  33           H        LYS  33  -3.009   6.470   2.143
  223    HA   LYS  33           HA       LYS  33  -0.788   7.984   1.073
  224    HB2  LYS  33           1HB      LYS  33  -1.497   9.745   2.428
  225    HB3  LYS  33           2HB      LYS  33  -2.998   8.925   2.020
  226    HG2  LYS  33           1HG      LYS  33  -3.149   7.931   4.158
  227    HG3  LYS  33           2HG      LYS  33  -1.491   8.384   4.562
  228    HD2  LYS  33           1HD      LYS  33  -2.807   9.940   5.711
  229    HD3  LYS  33           2HD      LYS  33  -2.285  10.805   4.264
  230    HE2  LYS  33           1HE      LYS  33  -4.485  10.010   3.225
  231    HE3  LYS  33           2HE      LYS  33  -4.972   9.607   4.871
  232    HZ1  LYS  33           3HZ      LYS  33  -5.366  11.991   3.743
  233    HZ2  LYS  33           1HZ      LYS  33  -3.886  12.270   4.514
  234    HZ3  LYS  33           2HZ      LYS  33  -5.224  11.757   5.412
  235    H    THR  34           H        THR  34  -1.510   6.033   3.905
  236    HA   THR  34           HA       THR  34   0.637   6.680   5.536
  237    HB   THR  34           HB       THR  34  -1.373   5.009   5.885
  238    HG1  THR  34           HG1      THR  34  -0.391   4.542   7.759
  239   HG21  THR  34          3HG2      THR  34   0.828   3.024   5.398
  240   HG22  THR  34          1HG2      THR  34  -0.317   3.453   4.128
  241   HG23  THR  34          2HG2      THR  34  -0.895   2.731   5.629
  242    H    HIS  35           H        HIS  35   0.515   4.623   2.702
  243    HA   HIS  35           HA       HIS  35   3.000   3.336   3.031
  244    HB2  HIS  35           1HB      HIS  35   1.139   3.815   0.754
  245    HB3  HIS  35           2HB      HIS  35   2.783   3.311   0.375
  246    HD1  HIS  35           HD1      HIS  35   3.135   1.322   2.771
  247    HD2  HIS  35           HD2      HIS  35  -0.133   1.447   0.209
  248    HE1  HIS  35           HE1      HIS  35   2.110  -0.971   2.878
  249    H    THR  36           H        THR  36   4.811   3.675   1.345
  250    HA   THR  36           HA       THR  36   5.420   6.557   1.202
  251    HB   THR  36           HB       THR  36   7.403   4.303   1.572
  252    HG1  THR  36           HG1      THR  36   5.921   5.042   3.398
  253   HG21  THR  36          3HG2      THR  36   7.698   7.295   1.401
  254   HG22  THR  36          1HG2      THR  36   8.484   6.065   0.412
  255   HG23  THR  36          2HG2      THR  36   8.934   6.255   2.106
  256    H    GLY  37           H        GLY  37   5.883   7.369  -0.747
  257    HA2  GLY  37           1HA      GLY  37   7.323   6.141  -2.781
  258    HA3  GLY  37           2HA      GLY  37   5.630   5.777  -3.082
  259    H    GLU  38           H        GLU  38   7.961   7.727  -4.076
  260    HA   GLU  38           HA       GLU  38   6.281  10.129  -4.263
  261    HB2  GLU  38           1HB      GLU  38   9.241   9.722  -4.697
  262    HB3  GLU  38           2HB      GLU  38   8.405  11.227  -5.054
  263    HG2  GLU  38           1HG      GLU  38   7.962  11.657  -2.808
  264    HG3  GLU  38           2HG      GLU  38   8.271   9.988  -2.333
  265    H    LYS  39           H        LYS  39   5.808   7.740  -5.843
  266    HA   LYS  39           HA       LYS  39   6.777   7.677  -8.390
  267    HB2  LYS  39           1HB      LYS  39   4.857   6.509  -9.011
  268    HB3  LYS  39           2HB      LYS  39   4.930   6.252  -7.272
  269    HG2  LYS  39           1HG      LYS  39   3.276   8.422  -8.532
  270    HG3  LYS  39           2HG      LYS  39   2.664   6.795  -8.222
  271    HD2  LYS  39           1HD      LYS  39   3.151   7.062  -5.842
  272    HD3  LYS  39           2HD      LYS  39   3.785   8.681  -6.148
  273    HE2  LYS  39           1HE      LYS  39   1.674   9.533  -6.675
  274    HE3  LYS  39           2HE      LYS  39   0.993   7.930  -6.944
  275    HZ1  LYS  39           3HZ      LYS  39   1.725   9.159  -4.346
  276    HZ2  LYS  39           1HZ      LYS  39   1.322   7.525  -4.522
  277    HZ3  LYS  39           2HZ      LYS  39   0.180   8.721  -4.879
  278    HA   PRO  40           HA       PRO  40   5.735  11.411 -10.451
  279    HB2  PRO  40           1HB      PRO  40   5.358  10.515 -12.986
  280    HB3  PRO  40           2HB      PRO  40   6.954  10.623 -12.233
  281    HG2  PRO  40           1HG      PRO  40   5.174   8.239 -12.565
  282    HG3  PRO  40           2HG      PRO  40   6.926   8.369 -12.802
  283    HD2  PRO  40           1HD      PRO  40   5.833   7.315 -10.560
  284    HD3  PRO  40           2HD      PRO  40   7.370   8.203 -10.547
  285    H    SER  41           H        SER  41   4.064  12.373 -11.968
  286    HA   SER  41           HA       SER  41   1.420  11.247 -11.322
  287    HB2  SER  41           1HB      SER  41   2.097  14.131 -11.947
  288    HB3  SER  41           2HB      SER  41   0.541  13.507 -11.399
  289    HG   SER  41           HG       SER  41   2.810  13.019  -9.834
  290    H    GLY  42           H        GLY  42   1.563   9.888 -13.219
  291    HA2  GLY  42           1HA      GLY  42   1.013   9.377 -15.387
  292    HA3  GLY  42           2HA      GLY  42   0.200  10.935 -15.436
  293    HA   PRO  43           HA       PRO  43   4.380  10.778 -17.842
  294    HB2  PRO  43           1HB      PRO  43   3.594   9.799 -20.249
  295    HB3  PRO  43           2HB      PRO  43   4.213   8.773 -18.950
  296    HG2  PRO  43           1HG      PRO  43   1.380   9.305 -19.757
  297    HG3  PRO  43           2HG      PRO  43   2.146   7.770 -19.309
  298    HD2  PRO  43           1HD      PRO  43   0.611   9.188 -17.588
  299    HD3  PRO  43           2HD      PRO  43   1.988   8.204 -17.051
  300    H    SER  44           H        SER  44   1.141  11.787 -18.342
  301    HA   SER  44           HA       SER  44   2.025  14.263 -19.521
  302    HB2  SER  44           1HB      SER  44   1.821  12.852 -21.523
  303    HB3  SER  44           2HB      SER  44   0.162  12.453 -21.079
  304    HG   SER  44           HG       SER  44  -0.123  14.859 -21.126
  305    H    SER  45           H        SER  45   0.539  15.926 -19.286
  306    HA   SER  45           HA       SER  45  -1.167  17.074 -18.313
  307    HB2  SER  45           1HB      SER  45  -2.530  15.809 -19.942
  308    HB3  SER  45           2HB      SER  45  -2.718  14.511 -18.762
  309    HG   SER  45           HG       SER  45  -3.473  16.564 -17.451
  310    H    GLY  46           H        GLY  46   0.552  16.288 -16.480
  311    HA2  GLY  46           1HA      GLY  46  -1.141  15.289 -14.274
  312    HA3  GLY  46           2HA      GLY  46   0.542  14.815 -14.444
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1  -7.812 -33.466   7.278
    2    HA2  GLY   1           1HA      GLY   1 -10.105 -33.151   5.785
    3    HA3  GLY   1           2HA      GLY   1 -10.475 -32.434   7.347
    4    H    SER   2           H        SER   2  -9.146 -31.904   4.312
    5    HA   SER   2           HA       SER   2  -7.135 -30.037   4.762
    6    HB2  SER   2           1HB      SER   2  -9.148 -30.239   2.514
    7    HB3  SER   2           2HB      SER   2  -7.779 -29.128   2.497
    8    HG   SER   2           HG       SER   2  -7.846 -31.865   2.143
    9    H    SER   3           H        SER   3  -7.300 -27.656   4.272
   10    HA   SER   3           HA       SER   3  -9.757 -26.502   5.412
   11    HB2  SER   3           1HB      SER   3  -8.006 -26.519   7.136
   12    HB3  SER   3           2HB      SER   3  -6.918 -25.659   6.048
   13    HG   SER   3           HG       SER   3  -7.844 -24.124   7.324
   14    H    GLY   4           H        GLY   4 -10.681 -25.185   3.998
   15    HA2  GLY   4           1HA      GLY   4  -8.955 -23.798   2.044
   16    HA3  GLY   4           2HA      GLY   4 -10.619 -24.273   1.736
   17    H    SER   5           H        SER   5 -11.584 -22.360   1.347
   18    HA   SER   5           HA       SER   5 -12.629 -20.392   1.833
   19    HB2  SER   5           1HB      SER   5 -12.958 -21.488   4.103
   20    HB3  SER   5           2HB      SER   5 -11.527 -20.606   4.638
   21    HG   SER   5           HG       SER   5 -12.586 -18.701   4.342
   22    H    SER   6           H        SER   6 -10.132 -20.356   0.642
   23    HA   SER   6           HA       SER   6  -8.065 -18.933   1.620
   24    HB2  SER   6           1HB      SER   6  -9.396 -18.721  -1.078
   25    HB3  SER   6           2HB      SER   6  -7.915 -17.842  -0.699
   26    HG   SER   6           HG       SER   6  -7.670 -20.406   0.053
   27    H    GLY   7           H        GLY   7 -10.888 -17.357   0.098
   28    HA2  GLY   7           1HA      GLY   7 -10.203 -14.916   1.606
   29    HA3  GLY   7           2HA      GLY   7 -11.096 -14.942   0.093
   30    H    THR   8           H        THR   8 -12.136 -13.508   2.112
   31    HA   THR   8           HA       THR   8 -14.557 -15.016   2.734
   32    HB   THR   8           HB       THR   8 -14.588 -14.172   5.069
   33    HG1  THR   8           HG1      THR   8 -11.836 -13.569   4.667
   34   HG21  THR   8          3HG2      THR   8 -12.183 -15.870   4.393
   35   HG22  THR   8          1HG2      THR   8 -13.835 -16.456   4.587
   36   HG23  THR   8          2HG2      THR   8 -12.973 -15.774   5.966
   37    H    GLY   9           H        GLY   9 -16.353 -13.629   3.400
   38    HA2  GLY   9           1HA      GLY   9 -17.724 -11.838   2.954
   39    HA3  GLY   9           2HA      GLY   9 -16.367 -10.875   3.520
   40    H    GLU  10           H        GLU  10 -17.304  -9.327   1.942
   41    HA   GLU  10           HA       GLU  10 -16.150  -9.811  -0.722
   42    HB2  GLU  10           1HB      GLU  10 -18.884  -8.864   0.006
   43    HB3  GLU  10           2HB      GLU  10 -18.123  -8.190  -1.429
   44    HG2  GLU  10           1HG      GLU  10 -18.397 -11.144  -0.962
   45    HG3  GLU  10           2HG      GLU  10 -19.621 -10.181  -1.788
   46    H    LYS  11           H        LYS  11 -14.301  -8.658   0.066
   47    HA   LYS  11           HA       LYS  11 -14.733  -5.773   0.446
   48    HB2  LYS  11           1HB      LYS  11 -12.449  -7.576   1.248
   49    HB3  LYS  11           2HB      LYS  11 -12.357  -5.821   1.328
   50    HG2  LYS  11           1HG      LYS  11 -12.898  -6.589   3.498
   51    HG3  LYS  11           2HG      LYS  11 -14.368  -5.880   2.826
   52    HD2  LYS  11           1HD      LYS  11 -15.222  -8.083   2.288
   53    HD3  LYS  11           2HD      LYS  11 -13.722  -8.828   2.844
   54    HE2  LYS  11           1HE      LYS  11 -15.123  -9.109   4.664
   55    HE3  LYS  11           2HE      LYS  11 -14.250  -7.636   5.082
   56    HZ1  LYS  11           3HZ      LYS  11 -17.041  -7.946   4.198
   57    HZ2  LYS  11           1HZ      LYS  11 -16.236  -6.480   3.944
   58    HZ3  LYS  11           2HZ      LYS  11 -16.428  -7.078   5.514
   59    HA   PRO  12           HA       PRO  12 -13.056  -5.961  -3.810
   60    HB2  PRO  12           1HB      PRO  12 -14.317  -3.698  -4.624
   61    HB3  PRO  12           2HB      PRO  12 -15.098  -5.283  -4.617
   62    HG2  PRO  12           1HG      PRO  12 -15.298  -3.063  -2.619
   63    HG3  PRO  12           2HG      PRO  12 -16.582  -4.094  -3.279
   64    HD2  PRO  12           1HD      PRO  12 -15.484  -4.517  -0.840
   65    HD3  PRO  12           2HD      PRO  12 -16.082  -5.841  -1.861
   66    H    TYR  13           H        TYR  13 -12.653  -3.954  -1.151
   67    HA   TYR  13           HA       TYR  13 -10.953  -2.024  -2.521
   68    HB2  TYR  13           1HB      TYR  13 -11.507  -2.217   0.441
   69    HB3  TYR  13           2HB      TYR  13 -10.872  -0.834  -0.442
   70    HD1  TYR  13           HD1      TYR  13 -13.117  -1.781  -2.702
   71    HD2  TYR  13           HD2      TYR  13 -13.099  -0.392   1.319
   72    HE1  TYR  13           HE1      TYR  13 -15.402  -0.920  -2.996
   73    HE2  TYR  13           HE2      TYR  13 -15.384   0.473   1.037
   74    HH   TYR  13           HH       TYR  13 -17.346  -0.345  -1.606
   75    H    GLU  14           H        GLU  14  -9.309  -3.493  -3.189
   76    HA   GLU  14           HA       GLU  14  -7.614  -4.499  -1.002
   77    HB2  GLU  14           1HB      GLU  14  -8.611  -6.065  -2.835
   78    HB3  GLU  14           2HB      GLU  14  -7.342  -5.395  -3.850
   79    HG2  GLU  14           1HG      GLU  14  -5.813  -6.055  -1.825
   80    HG3  GLU  14           2HG      GLU  14  -7.133  -7.169  -1.475
   81    H    CYS  15           H        CYS  15  -5.717  -3.550  -0.678
   82    HA   CYS  15           HA       CYS  15  -4.865  -1.332  -2.208
   83    HB2  CYS  15           1HB      CYS  15  -4.378  -1.899   0.266
   84    HB3  CYS  15           2HB      CYS  15  -3.060  -2.881  -0.365
   85    H    LYS  16           H        LYS  16  -2.655  -1.146  -3.169
   86    HA   LYS  16           HA       LYS  16  -2.128  -3.501  -4.846
   87    HB2  LYS  16           1HB      LYS  16  -1.549  -0.567  -5.260
   88    HB3  LYS  16           2HB      LYS  16  -0.916  -1.829  -6.309
   89    HG2  LYS  16           1HG      LYS  16  -3.854  -1.610  -5.797
   90    HG3  LYS  16           2HG      LYS  16  -3.064  -0.584  -6.996
   91    HD2  LYS  16           1HD      LYS  16  -2.129  -2.694  -8.014
   92    HD3  LYS  16           2HD      LYS  16  -3.205  -3.593  -6.941
   93    HE2  LYS  16           1HE      LYS  16  -4.239  -1.441  -8.759
   94    HE3  LYS  16           2HE      LYS  16  -4.008  -3.092  -9.330
   95    HZ1  LYS  16           3HZ      LYS  16  -5.758  -3.835  -8.157
   96    HZ2  LYS  16           1HZ      LYS  16  -6.258  -2.220  -8.215
   97    HZ3  LYS  16           2HZ      LYS  16  -5.471  -2.813  -6.840
   98    H    VAL  17           H        VAL  17  -0.776  -1.468  -2.421
   99    HA   VAL  17           HA       VAL  17   1.959  -2.288  -2.929
  100    HB   VAL  17           HB       VAL  17   0.750  -0.638  -0.707
  101   HG11  VAL  17          1HG1      VAL  17   2.629  -1.589   0.295
  102   HG12  VAL  17          2HG1      VAL  17   3.567  -1.541  -1.199
  103   HG13  VAL  17          3HG1      VAL  17   3.222  -0.049  -0.324
  104   HG21  VAL  17          3HG2      VAL  17   1.303   1.221  -1.887
  105   HG22  VAL  17          1HG2      VAL  17   2.705   0.460  -2.639
  106   HG23  VAL  17          2HG2      VAL  17   1.085   0.121  -3.248
  107    H    CYS  18           H        CYS  18   0.016  -2.377   0.058
  108    HA   CYS  18           HA       CYS  18   1.473  -4.710   0.959
  109    HB2  CYS  18           1HB      CYS  18   0.181  -4.447   3.032
  110    HB3  CYS  18           2HB      CYS  18   0.935  -2.929   2.553
  111    H    SER  19           H        SER  19  -1.353  -4.091  -0.797
  112    HA   SER  19           HA       SER  19  -3.010  -5.421  -1.609
  113    HB2  SER  19           1HB      SER  19  -0.980  -7.461  -0.752
  114    HB3  SER  19           2HB      SER  19  -2.561  -7.980  -1.338
  115    HG   SER  19           HG       SER  19  -2.121  -6.719  -3.243
  116    H    LYS  20           H        LYS  20  -3.521  -4.295   0.818
  117    HA   LYS  20           HA       LYS  20  -4.654  -6.395   2.512
  118    HB2  LYS  20           1HB      LYS  20  -3.278  -4.378   3.377
  119    HB3  LYS  20           2HB      LYS  20  -4.747  -3.450   3.108
  120    HG2  LYS  20           1HG      LYS  20  -5.949  -4.708   4.705
  121    HG3  LYS  20           2HG      LYS  20  -4.681  -5.933   4.799
  122    HD2  LYS  20           1HD      LYS  20  -4.192  -3.062   5.547
  123    HD3  LYS  20           2HD      LYS  20  -4.813  -4.241   6.705
  124    HE2  LYS  20           1HE      LYS  20  -2.792  -5.674   5.977
  125    HE3  LYS  20           2HE      LYS  20  -2.154  -4.168   5.322
  126    HZ1  LYS  20           3HZ      LYS  20  -3.026  -3.601   7.886
  127    HZ2  LYS  20           1HZ      LYS  20  -1.426  -3.700   7.345
  128    HZ3  LYS  20           2HZ      LYS  20  -2.183  -5.063   8.002
  129    H    ALA  21           H        ALA  21  -6.843  -6.470   3.060
  130    HA   ALA  21           HA       ALA  21  -8.608  -5.204   1.091
  131    HB1  ALA  21           3HB      ALA  21  -8.893  -7.542   1.100
  132    HB2  ALA  21           1HB      ALA  21  -8.932  -7.611   2.862
  133    HB3  ALA  21           2HB      ALA  21 -10.279  -6.894   1.977
  134    H    PHE  22           H        PHE  22 -10.471  -4.084   1.696
  135    HA   PHE  22           HA       PHE  22 -10.795  -3.461   4.542
  136    HB2  PHE  22           1HB      PHE  22 -10.733  -1.346   2.380
  137    HB3  PHE  22           2HB      PHE  22 -10.948  -1.080   4.107
  138    HD1  PHE  22           HD1      PHE  22  -8.542  -2.174   1.530
  139    HD2  PHE  22           HD2      PHE  22  -9.098  -0.914   5.558
  140    HE1  PHE  22           HE1      PHE  22  -6.106  -1.942   1.791
  141    HE2  PHE  22           HE2      PHE  22  -6.664  -0.679   5.824
  142    HZ   PHE  22           HZ       PHE  22  -5.164  -1.193   3.939
  143    H    THR  23           H        THR  23 -12.829  -1.842   4.646
  144    HA   THR  23           HA       THR  23 -14.943  -3.111   3.029
  145    HB   THR  23           HB       THR  23 -16.484  -2.725   4.916
  146    HG1  THR  23           HG1      THR  23 -14.246  -1.430   5.922
  147   HG21  THR  23          3HG2      THR  23 -15.344  -4.885   4.717
  148   HG22  THR  23          1HG2      THR  23 -15.603  -4.456   6.407
  149   HG23  THR  23          2HG2      THR  23 -14.004  -4.271   5.685
  150    H    GLN  24           H        GLN  24 -13.714  -0.138   4.420
  151    HA   GLN  24           HA       GLN  24 -15.740   1.369   2.905
  152    HB2  GLN  24           1HB      GLN  24 -14.147   2.219   5.329
  153    HB3  GLN  24           2HB      GLN  24 -15.285   3.239   4.457
  154    HG2  GLN  24           1HG      GLN  24 -15.909   0.736   6.004
  155    HG3  GLN  24           2HG      GLN  24 -16.340   2.391   6.430
  156   HE21  GLN  24          1HE2      GLN  24 -17.611  -0.356   5.371
  157   HE22  GLN  24          2HE2      GLN  24 -18.900   0.238   4.386
  158    H    LYS  25           H        LYS  25 -15.048   2.401   1.163
  159    HA   LYS  25           HA       LYS  25 -12.528   2.361   0.118
  160    HB2  LYS  25           1HB      LYS  25 -14.873   4.152  -0.258
  161    HB3  LYS  25           2HB      LYS  25 -13.341   4.675  -0.945
  162    HG2  LYS  25           1HG      LYS  25 -14.645   2.018  -1.496
  163    HG3  LYS  25           2HG      LYS  25 -14.764   3.438  -2.537
  164    HD2  LYS  25           1HD      LYS  25 -12.127   3.341  -2.369
  165    HD3  LYS  25           2HD      LYS  25 -12.448   1.640  -2.021
  166    HE2  LYS  25           1HE      LYS  25 -13.654   3.042  -4.389
  167    HE3  LYS  25           2HE      LYS  25 -12.059   2.295  -4.460
  168    HZ1  LYS  25           3HZ      LYS  25 -13.417   0.609  -5.183
  169    HZ2  LYS  25           1HZ      LYS  25 -14.690   1.020  -4.146
  170    HZ3  LYS  25           2HZ      LYS  25 -13.315   0.248  -3.533
  171    H    ALA  26           H        ALA  26 -13.776   4.506   2.563
  172    HA   ALA  26           HA       ALA  26 -11.813   6.517   2.442
  173    HB1  ALA  26           3HB      ALA  26 -14.048   6.444   3.744
  174    HB2  ALA  26           1HB      ALA  26 -13.089   5.694   5.020
  175    HB3  ALA  26           2HB      ALA  26 -12.678   7.309   4.441
  176    H    HIS  27           H        HIS  27 -11.964   3.487   4.275
  177    HA   HIS  27           HA       HIS  27  -9.572   3.877   5.726
  178    HB2  HIS  27           1HB      HIS  27 -11.098   1.381   4.981
  179    HB3  HIS  27           2HB      HIS  27  -9.669   1.359   6.010
  180    HD1  HIS  27           HD1      HIS  27 -12.702   0.614   6.808
  181    HD2  HIS  27           HD2      HIS  27 -10.622   4.077   7.779
  182    HE1  HIS  27           HE1      HIS  27 -13.827   1.519   8.867
  183    H    LEU  28           H        LEU  28 -10.261   2.470   2.578
  184    HA   LEU  28           HA       LEU  28  -7.687   1.361   2.145
  185    HB2  LEU  28           1HB      LEU  28  -9.404   0.497   0.815
  186    HB3  LEU  28           2HB      LEU  28  -9.974   2.100   0.355
  187    HG   LEU  28           HG       LEU  28  -7.742   2.311  -0.903
  188   HD11  LEU  28          1HD1      LEU  28  -6.356   0.606  -0.395
  189   HD12  LEU  28          2HD1      LEU  28  -7.238  -0.206  -1.688
  190   HD13  LEU  28          3HD1      LEU  28  -7.675  -0.497  -0.004
  191   HD21  LEU  28          3HD2      LEU  28  -9.220   2.139  -2.552
  192   HD22  LEU  28          1HD2      LEU  28 -10.256   1.084  -1.589
  193   HD23  LEU  28          2HD2      LEU  28  -8.942   0.397  -2.545
  194    H    ALA  29           H        ALA  29  -9.206   4.336   0.898
  195    HA   ALA  29           HA       ALA  29  -6.867   5.313  -0.353
  196    HB1  ALA  29           3HB      ALA  29  -9.571   6.275   0.163
  197    HB2  ALA  29           1HB      ALA  29  -8.357   7.554   0.170
  198    HB3  ALA  29           2HB      ALA  29  -8.531   6.511  -1.241
  199    H    GLN  30           H        GLN  30  -8.358   6.024   2.792
  200    HA   GLN  30           HA       GLN  30  -6.520   7.981   3.609
  201    HB2  GLN  30           1HB      GLN  30  -7.450   7.767   5.772
  202    HB3  GLN  30           2HB      GLN  30  -8.765   7.420   4.658
  203    HG2  GLN  30           1HG      GLN  30  -9.040   5.746   6.183
  204    HG3  GLN  30           2HG      GLN  30  -8.008   4.944   5.000
  205   HE21  GLN  30          1HE2      GLN  30  -8.289   6.121   8.210
  206   HE22  GLN  30          2HE2      GLN  30  -6.756   5.571   8.783
  207    H    HIS  31           H        HIS  31  -6.295   4.540   3.465
  208    HA   HIS  31           HA       HIS  31  -4.162   4.266   5.356
  209    HB2  HIS  31           1HB      HIS  31  -5.240   2.253   5.127
  210    HB3  HIS  31           2HB      HIS  31  -5.545   2.489   3.408
  211    HD1  HIS  31           HD1      HIS  31  -2.658   1.637   5.722
  212    HD2  HIS  31           HD2      HIS  31  -3.855   1.120   1.777
  213    HE1  HIS  31           HE1      HIS  31  -0.941   0.116   4.692
  214    H    GLN  32           H        GLN  32  -4.331   4.200   1.800
  215    HA   GLN  32           HA       GLN  32  -1.826   3.725   1.013
  216    HB2  GLN  32           1HB      GLN  32  -3.504   6.048   0.050
  217    HB3  GLN  32           2HB      GLN  32  -2.117   5.386  -0.805
  218    HG2  GLN  32           1HG      GLN  32  -3.438   3.152  -0.669
  219    HG3  GLN  32           2HG      GLN  32  -4.823   4.206  -0.390
  220   HE21  GLN  32          1HE2      GLN  32  -5.276   2.912  -2.482
  221   HE22  GLN  32          2HE2      GLN  32  -4.880   3.733  -3.950
  222    H    LYS  33           H        LYS  33  -2.890   6.743   2.509
  223    HA   LYS  33           HA       LYS  33  -0.813   8.429   2.216
  224    HB2  LYS  33           1HB      LYS  33  -2.443   7.795   4.660
  225    HB3  LYS  33           2HB      LYS  33  -1.190   9.029   4.710
  226    HG2  LYS  33           1HG      LYS  33  -2.430   9.952   2.601
  227    HG3  LYS  33           2HG      LYS  33  -3.782   9.015   3.243
  228    HD2  LYS  33           1HD      LYS  33  -3.513  10.195   5.406
  229    HD3  LYS  33           2HD      LYS  33  -2.247  11.185   4.675
  230    HE2  LYS  33           1HE      LYS  33  -3.747  12.271   3.262
  231    HE3  LYS  33           2HE      LYS  33  -4.968  11.012   3.433
  232    HZ1  LYS  33           3HZ      LYS  33  -5.862  12.535   4.816
  233    HZ2  LYS  33           1HZ      LYS  33  -4.381  13.277   5.165
  234    HZ3  LYS  33           2HZ      LYS  33  -4.808  11.834   5.938
  235    H    THR  34           H        THR  34  -0.898   5.804   4.619
  236    HA   THR  34           HA       THR  34   1.543   6.172   5.825
  237    HB   THR  34           HB       THR  34   1.570   3.766   6.307
  238    HG1  THR  34           HG1      THR  34   0.800   2.563   4.739
  239   HG21  THR  34          3HG2      THR  34   0.161   4.639   7.854
  240   HG22  THR  34          1HG2      THR  34  -1.041   3.705   6.965
  241   HG23  THR  34          2HG2      THR  34  -0.850   5.428   6.644
  242    H    HIS  35           H        HIS  35   0.874   4.332   2.857
  243    HA   HIS  35           HA       HIS  35   3.477   3.446   2.367
  244    HB2  HIS  35           1HB      HIS  35   1.189   4.050   0.493
  245    HB3  HIS  35           2HB      HIS  35   2.708   3.347  -0.054
  246    HD1  HIS  35           HD1      HIS  35   3.150   1.326   2.249
  247    HD2  HIS  35           HD2      HIS  35  -0.454   1.884   0.259
  248    HE1  HIS  35           HE1      HIS  35   1.871  -0.816   2.562
  249    H    THR  36           H        THR  36   1.811   6.315   1.065
  250    HA   THR  36           HA       THR  36   3.612   7.441  -0.559
  251    HB   THR  36           HB       THR  36   2.239   8.991   1.645
  252    HG1  THR  36           HG1      THR  36   1.362   8.082  -0.901
  253   HG21  THR  36          3HG2      THR  36   3.071  10.832   0.709
  254   HG22  THR  36          1HG2      THR  36   2.430  10.358  -0.864
  255   HG23  THR  36          2HG2      THR  36   4.035   9.822  -0.368
  256    H    GLY  37           H        GLY  37   3.849   7.454   2.977
  257    HA2  GLY  37           1HA      GLY  37   6.552   8.606   2.731
  258    HA3  GLY  37           2HA      GLY  37   5.556   8.673   4.178
  259    H    GLU  38           H        GLU  38   6.520   7.532   5.720
  260    HA   GLU  38           HA       GLU  38   7.351   4.787   5.090
  261    HB2  GLU  38           1HB      GLU  38   9.371   6.182   5.139
  262    HB3  GLU  38           2HB      GLU  38   8.944   6.751   6.747
  263    HG2  GLU  38           1HG      GLU  38  10.654   5.053   6.879
  264    HG3  GLU  38           2HG      GLU  38   9.158   4.475   7.610
  265    H    LYS  39           H        LYS  39   6.490   3.346   6.429
  266    HA   LYS  39           HA       LYS  39   6.228   3.697   9.218
  267    HB2  LYS  39           1HB      LYS  39   4.317   5.132   8.083
  268    HB3  LYS  39           2HB      LYS  39   3.524   3.567   7.955
  269    HG2  LYS  39           1HG      LYS  39   3.506   3.280  10.303
  270    HG3  LYS  39           2HG      LYS  39   4.602   4.642  10.546
  271    HD2  LYS  39           1HD      LYS  39   2.804   6.097   9.515
  272    HD3  LYS  39           2HD      LYS  39   1.727   4.706   9.656
  273    HE2  LYS  39           1HE      LYS  39   2.214   4.646  12.090
  274    HE3  LYS  39           2HE      LYS  39   3.163   6.119  11.901
  275    HZ1  LYS  39           3HZ      LYS  39   1.152   6.975  12.506
  276    HZ2  LYS  39           1HZ      LYS  39   0.259   5.749  11.757
  277    HZ3  LYS  39           2HZ      LYS  39   0.958   6.975  10.826
  278    HA   PRO  40           HA       PRO  40   6.096  -0.688   8.790
  279    HB2  PRO  40           1HB      PRO  40   5.420  -1.324  11.341
  280    HB3  PRO  40           2HB      PRO  40   7.034  -0.765  10.886
  281    HG2  PRO  40           1HG      PRO  40   4.769   0.772  12.099
  282    HG3  PRO  40           2HG      PRO  40   6.495   0.821  12.500
  283    HD2  PRO  40           1HD      PRO  40   5.304   2.700  10.956
  284    HD3  PRO  40           2HD      PRO  40   6.996   2.210  10.730
  285    H    SER  41           H        SER  41   4.523  -1.745   7.769
  286    HA   SER  41           HA       SER  41   1.790  -1.125   7.952
  287    HB2  SER  41           1HB      SER  41   3.159  -2.426   6.118
  288    HB3  SER  41           2HB      SER  41   2.690  -3.840   7.061
  289    HG   SER  41           HG       SER  41   1.109  -3.502   5.543
  290    H    GLY  42           H        GLY  42   0.480  -1.470   9.613
  291    HA2  GLY  42           1HA      GLY  42   0.835  -3.956  11.171
  292    HA3  GLY  42           2HA      GLY  42   0.449  -2.420  11.932
  293    HA   PRO  43           HA       PRO  43  -3.375  -4.857  10.285
  294    HB2  PRO  43           1HB      PRO  43  -3.912  -6.510  12.370
  295    HB3  PRO  43           2HB      PRO  43  -2.913  -6.993  10.995
  296    HG2  PRO  43           1HG      PRO  43  -2.071  -6.049  13.708
  297    HG3  PRO  43           2HG      PRO  43  -1.421  -7.382  12.735
  298    HD2  PRO  43           1HD      PRO  43  -0.211  -4.964  12.888
  299    HD3  PRO  43           2HD      PRO  43  -0.148  -5.973  11.429
  300    H    SER  44           H        SER  44  -4.548  -2.991  10.556
  301    HA   SER  44           HA       SER  44  -5.508  -2.434  13.287
  302    HB2  SER  44           1HB      SER  44  -5.643  -0.107  12.761
  303    HB3  SER  44           2HB      SER  44  -4.053  -0.649  12.224
  304    HG   SER  44           HG       SER  44  -4.825  -0.713  10.116
  305    H    SER  45           H        SER  45  -7.655  -2.394  13.630
  306    HA   SER  45           HA       SER  45  -9.398  -3.430  11.633
  307    HB2  SER  45           1HB      SER  45  -9.681  -2.542  14.467
  308    HB3  SER  45           2HB      SER  45 -11.145  -2.666  13.491
  309    HG   SER  45           HG       SER  45 -10.891  -4.793  13.341
  310    H    GLY  46           H        GLY  46 -11.628  -2.296  11.340
  311    HA2  GLY  46           1HA      GLY  46 -11.054   0.474  10.500
  312    HA3  GLY  46           2HA      GLY  46 -12.200  -0.594   9.704
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1   1.931 -13.144 -22.478
    2    HA2  GLY   1           1HA      GLY   1   0.209 -14.669 -22.476
    3    HA3  GLY   1           2HA      GLY   1   1.440 -15.797 -23.026
    4    H    SER   2           H        SER   2  -0.676 -14.961 -20.516
    5    HA   SER   2           HA       SER   2  -0.121 -17.340 -19.070
    6    HB2  SER   2           1HB      SER   2   1.718 -15.581 -18.387
    7    HB3  SER   2           2HB      SER   2   0.420 -14.914 -17.398
    8    HG   SER   2           HG       SER   2   1.905 -16.689 -16.543
    9    H    SER   3           H        SER   3  -1.831 -17.915 -17.823
   10    HA   SER   3           HA       SER   3  -3.952 -15.900 -17.460
   11    HB2  SER   3           1HB      SER   3  -4.290 -18.861 -17.999
   12    HB3  SER   3           2HB      SER   3  -5.598 -17.707 -17.739
   13    HG   SER   3           HG       SER   3  -3.690 -17.575 -19.838
   14    H    GLY   4           H        GLY   4  -3.554 -15.348 -15.357
   15    HA2  GLY   4           1HA      GLY   4  -4.164 -17.416 -13.377
   16    HA3  GLY   4           2HA      GLY   4  -2.638 -16.560 -13.210
   17    H    SER   5           H        SER   5  -5.140 -16.680 -11.536
   18    HA   SER   5           HA       SER   5  -5.267 -13.826 -11.007
   19    HB2  SER   5           1HB      SER   5  -7.667 -13.669 -11.091
   20    HB3  SER   5           2HB      SER   5  -7.121 -14.326 -12.634
   21    HG   SER   5           HG       SER   5  -8.782 -15.612 -11.998
   22    H    SER   6           H        SER   6  -5.291 -13.440  -8.884
   23    HA   SER   6           HA       SER   6  -5.965 -15.676  -7.087
   24    HB2  SER   6           1HB      SER   6  -3.794 -13.617  -6.988
   25    HB3  SER   6           2HB      SER   6  -4.423 -14.272  -5.476
   26    HG   SER   6           HG       SER   6  -3.133 -15.629  -7.589
   27    H    GLY   7           H        GLY   7  -6.554 -14.873  -4.819
   28    HA2  GLY   7           1HA      GLY   7  -8.010 -12.332  -4.866
   29    HA3  GLY   7           2HA      GLY   7  -8.934 -13.797  -4.570
   30    H    THR   8           H        THR   8  -6.753 -11.474  -3.252
   31    HA   THR   8           HA       THR   8  -6.259 -12.934  -0.813
   32    HB   THR   8           HB       THR   8  -5.747 -10.001  -1.321
   33    HG1  THR   8           HG1      THR   8  -4.264 -12.310  -2.024
   34   HG21  THR   8          3HG2      THR   8  -5.325 -10.217   0.906
   35   HG22  THR   8          1HG2      THR   8  -3.774 -10.793   0.298
   36   HG23  THR   8          2HG2      THR   8  -5.012 -11.948   0.791
   37    H    GLY   9           H        GLY   9  -8.999 -12.715  -1.284
   38    HA2  GLY   9           1HA      GLY   9 -10.346 -12.360   0.861
   39    HA3  GLY   9           2HA      GLY   9  -9.872 -10.680   0.663
   40    H    GLU  10           H        GLU  10 -12.437 -10.905   0.819
   41    HA   GLU  10           HA       GLU  10 -13.406 -10.805  -1.961
   42    HB2  GLU  10           1HB      GLU  10 -14.237 -12.789  -0.636
   43    HB3  GLU  10           2HB      GLU  10 -15.066 -11.649   0.415
   44    HG2  GLU  10           1HG      GLU  10 -16.498 -12.672  -1.340
   45    HG3  GLU  10           2HG      GLU  10 -16.467 -10.909  -1.355
   46    H    LYS  11           H        LYS  11 -12.717  -8.513  -1.639
   47    HA   LYS  11           HA       LYS  11 -14.997  -6.967  -0.655
   48    HB2  LYS  11           1HB      LYS  11 -12.130  -6.593   0.185
   49    HB3  LYS  11           2HB      LYS  11 -13.293  -5.276   0.260
   50    HG2  LYS  11           1HG      LYS  11 -13.508  -6.062   2.373
   51    HG3  LYS  11           2HG      LYS  11 -14.702  -7.092   1.580
   52    HD2  LYS  11           1HD      LYS  11 -12.981  -8.845   1.334
   53    HD3  LYS  11           2HD      LYS  11 -11.838  -7.817   2.203
   54    HE2  LYS  11           1HE      LYS  11 -12.797  -9.457   3.708
   55    HE3  LYS  11           2HE      LYS  11 -13.334  -7.838   4.155
   56    HZ1  LYS  11           3HZ      LYS  11 -15.160  -9.403   4.226
   57    HZ2  LYS  11           1HZ      LYS  11 -14.909  -9.825   2.607
   58    HZ3  LYS  11           2HZ      LYS  11 -15.424  -8.264   3.004
   59    HA   PRO  12           HA       PRO  12 -14.496  -4.684  -4.372
   60    HB2  PRO  12           1HB      PRO  12 -15.431  -2.250  -3.616
   61    HB3  PRO  12           2HB      PRO  12 -16.483  -3.649  -3.861
   62    HG2  PRO  12           1HG      PRO  12 -15.391  -2.523  -1.311
   63    HG3  PRO  12           2HG      PRO  12 -17.026  -3.113  -1.664
   64    HD2  PRO  12           1HD      PRO  12 -15.195  -4.601  -0.334
   65    HD3  PRO  12           2HD      PRO  12 -16.422  -5.321  -1.396
   66    H    TYR  13           H        TYR  13 -13.015  -3.521  -1.435
   67    HA   TYR  13           HA       TYR  13 -11.141  -1.902  -3.031
   68    HB2  TYR  13           1HB      TYR  13 -11.703  -1.653  -0.071
   69    HB3  TYR  13           2HB      TYR  13 -10.731  -0.568  -1.059
   70    HD1  TYR  13           HD1      TYR  13 -11.818   0.941  -2.680
   71    HD2  TYR  13           HD2      TYR  13 -14.095  -1.498  -0.040
   72    HE1  TYR  13           HE1      TYR  13 -13.805   2.317  -3.132
   73    HE2  TYR  13           HE2      TYR  13 -16.089  -0.130  -0.486
   74    HH   TYR  13           HH       TYR  13 -16.789   1.878  -1.346
   75    H    GLU  14           H        GLU  14  -9.176  -2.714  -3.266
   76    HA   GLU  14           HA       GLU  14  -7.968  -4.233  -1.078
   77    HB2  GLU  14           1HB      GLU  14  -9.073  -5.769  -2.816
   78    HB3  GLU  14           2HB      GLU  14  -7.794  -5.251  -3.906
   79    HG2  GLU  14           1HG      GLU  14  -6.162  -6.018  -2.127
   80    HG3  GLU  14           2HG      GLU  14  -7.539  -6.792  -1.345
   81    H    CYS  15           H        CYS  15  -5.993  -3.504  -0.679
   82    HA   CYS  15           HA       CYS  15  -4.759  -1.544  -2.329
   83    HB2  CYS  15           1HB      CYS  15  -4.555  -1.737   0.189
   84    HB3  CYS  15           2HB      CYS  15  -3.451  -3.080  -0.083
   85    H    LYS  16           H        LYS  16  -2.464  -1.729  -3.066
   86    HA   LYS  16           HA       LYS  16  -2.027  -4.364  -4.307
   87    HB2  LYS  16           1HB      LYS  16  -2.455  -2.174  -5.695
   88    HB3  LYS  16           2HB      LYS  16  -0.762  -1.856  -5.342
   89    HG2  LYS  16           1HG      LYS  16  -0.154  -3.997  -6.369
   90    HG3  LYS  16           2HG      LYS  16  -1.854  -4.286  -6.747
   91    HD2  LYS  16           1HD      LYS  16  -0.883  -3.428  -8.725
   92    HD3  LYS  16           2HD      LYS  16  -1.803  -2.097  -8.021
   93    HE2  LYS  16           1HE      LYS  16   0.154  -1.017  -8.503
   94    HE3  LYS  16           2HE      LYS  16   0.504  -1.565  -6.864
   95    HZ1  LYS  16           3HZ      LYS  16   2.204  -1.967  -8.767
   96    HZ2  LYS  16           1HZ      LYS  16   1.215  -3.290  -9.132
   97    HZ3  LYS  16           2HZ      LYS  16   1.937  -3.170  -7.608
   98    H    VAL  17           H        VAL  17  -0.517  -1.702  -2.584
   99    HA   VAL  17           HA       VAL  17   2.146  -2.625  -2.709
  100    HB   VAL  17           HB       VAL  17   0.822  -0.914  -0.600
  101   HG11  VAL  17          1HG1      VAL  17   2.913  -1.944   0.182
  102   HG12  VAL  17          2HG1      VAL  17   3.754  -1.268  -1.215
  103   HG13  VAL  17          3HG1      VAL  17   3.059  -0.196   0.001
  104   HG21  VAL  17          3HG2      VAL  17   0.611   0.261  -2.604
  105   HG22  VAL  17          1HG2      VAL  17   2.105   0.892  -1.910
  106   HG23  VAL  17          2HG2      VAL  17   2.169  -0.300  -3.208
  107    H    CYS  18           H        CYS  18  -0.225  -2.851  -0.051
  108    HA   CYS  18           HA       CYS  18   1.315  -5.125   1.009
  109    HB2  CYS  18           1HB      CYS  18   0.228  -4.623   3.180
  110    HB3  CYS  18           2HB      CYS  18   1.195  -3.279   2.581
  111    H    SER  19           H        SER  19  -0.865  -5.011  -1.095
  112    HA   SER  19           HA       SER  19  -2.889  -6.003  -1.590
  113    HB2  SER  19           1HB      SER  19  -1.049  -7.786  -1.635
  114    HB3  SER  19           2HB      SER  19  -1.698  -8.334  -0.090
  115    HG   SER  19           HG       SER  19  -2.515  -9.201  -2.288
  116    H    LYS  20           H        LYS  20  -2.889  -4.580   0.972
  117    HA   LYS  20           HA       LYS  20  -4.427  -6.184   2.806
  118    HB2  LYS  20           1HB      LYS  20  -2.904  -4.416   3.604
  119    HB3  LYS  20           2HB      LYS  20  -3.893  -3.207   2.794
  120    HG2  LYS  20           1HG      LYS  20  -5.627  -3.419   4.308
  121    HG3  LYS  20           2HG      LYS  20  -5.114  -5.027   4.825
  122    HD2  LYS  20           1HD      LYS  20  -3.537  -2.512   5.354
  123    HD3  LYS  20           2HD      LYS  20  -4.698  -3.200   6.492
  124    HE2  LYS  20           1HE      LYS  20  -3.378  -5.331   6.398
  125    HE3  LYS  20           2HE      LYS  20  -2.161  -4.461   5.465
  126    HZ1  LYS  20           3HZ      LYS  20  -1.870  -2.943   7.315
  127    HZ2  LYS  20           1HZ      LYS  20  -1.607  -4.536   7.819
  128    HZ3  LYS  20           2HZ      LYS  20  -3.055  -3.755   8.208
  129    H    ALA  21           H        ALA  21  -6.544  -6.512   2.714
  130    HA   ALA  21           HA       ALA  21  -8.158  -4.896   0.894
  131    HB1  ALA  21           3HB      ALA  21  -8.553  -7.134   0.459
  132    HB2  ALA  21           1HB      ALA  21  -8.508  -7.580   2.165
  133    HB3  ALA  21           2HB      ALA  21  -9.900  -6.713   1.516
  134    H    PHE  22           H        PHE  22  -9.960  -3.747   1.514
  135    HA   PHE  22           HA       PHE  22 -10.444  -3.519   4.409
  136    HB2  PHE  22           1HB      PHE  22 -10.408  -1.257   2.400
  137    HB3  PHE  22           2HB      PHE  22 -10.832  -1.104   4.101
  138    HD1  PHE  22           HD1      PHE  22  -8.081  -1.875   1.766
  139    HD2  PHE  22           HD2      PHE  22  -9.172  -0.902   5.763
  140    HE1  PHE  22           HE1      PHE  22  -5.714  -1.491   2.315
  141    HE2  PHE  22           HE2      PHE  22  -6.807  -0.515   6.318
  142    HZ   PHE  22           HZ       PHE  22  -5.074  -0.809   4.593
  143    H    THR  23           H        THR  23 -12.591  -2.631   4.949
  144    HA   THR  23           HA       THR  23 -14.611  -3.870   3.282
  145    HB   THR  23           HB       THR  23 -14.782  -4.223   5.671
  146    HG1  THR  23           HG1      THR  23 -16.854  -2.409   4.970
  147   HG21  THR  23          3HG2      THR  23 -14.649  -1.239   5.761
  148   HG22  THR  23          1HG2      THR  23 -13.815  -2.430   6.759
  149   HG23  THR  23          2HG2      THR  23 -15.528  -2.106   7.020
  150    H    GLN  24           H        GLN  24 -13.498  -0.670   4.102
  151    HA   GLN  24           HA       GLN  24 -15.563   0.451   2.327
  152    HB2  GLN  24           1HB      GLN  24 -14.593   1.382   4.989
  153    HB3  GLN  24           2HB      GLN  24 -15.045   2.594   3.798
  154    HG2  GLN  24           1HG      GLN  24 -16.853   0.343   4.630
  155    HG3  GLN  24           2HG      GLN  24 -16.844   1.924   5.409
  156   HE21  GLN  24          1HE2      GLN  24 -18.433   3.157   4.740
  157   HE22  GLN  24          2HE2      GLN  24 -19.077   3.221   3.138
  158    H    LYS  25           H        LYS  25 -14.841   2.766   1.618
  159    HA   LYS  25           HA       LYS  25 -12.274   2.429   0.317
  160    HB2  LYS  25           1HB      LYS  25 -12.891   4.369  -0.998
  161    HB3  LYS  25           2HB      LYS  25 -14.241   3.243  -0.941
  162    HG2  LYS  25           1HG      LYS  25 -15.360   5.176  -0.550
  163    HG3  LYS  25           2HG      LYS  25 -14.943   4.757   1.113
  164    HD2  LYS  25           1HD      LYS  25 -14.309   6.978   1.002
  165    HD3  LYS  25           2HD      LYS  25 -12.794   6.147   0.642
  166    HE2  LYS  25           1HE      LYS  25 -12.913   6.656  -1.626
  167    HE3  LYS  25           2HE      LYS  25 -14.646   6.974  -1.562
  168    HZ1  LYS  25           3HZ      LYS  25 -13.261   8.995  -1.769
  169    HZ2  LYS  25           1HZ      LYS  25 -12.598   8.672  -0.247
  170    HZ3  LYS  25           2HZ      LYS  25 -14.249   9.002  -0.396
  171    H    ALA  26           H        ALA  26 -13.789   4.648   2.618
  172    HA   ALA  26           HA       ALA  26 -11.867   6.587   2.867
  173    HB1  ALA  26           3HB      ALA  26 -14.118   6.329   4.083
  174    HB2  ALA  26           1HB      ALA  26 -13.194   5.452   5.302
  175    HB3  ALA  26           2HB      ALA  26 -12.796   7.130   4.932
  176    H    HIS  27           H        HIS  27 -11.874   3.353   4.284
  177    HA   HIS  27           HA       HIS  27  -9.598   3.689   5.921
  178    HB2  HIS  27           1HB      HIS  27 -11.141   1.368   4.869
  179    HB3  HIS  27           2HB      HIS  27  -9.528   1.057   5.503
  180    HD1  HIS  27           HD1      HIS  27  -9.321   0.845   7.980
  181    HD2  HIS  27           HD2      HIS  27 -12.914   2.594   6.841
  182    HE1  HIS  27           HE1      HIS  27 -10.670   1.048  10.093
  183    H    LEU  28           H        LEU  28  -9.993   2.462   2.619
  184    HA   LEU  28           HA       LEU  28  -7.247   1.838   2.242
  185    HB2  LEU  28           1HB      LEU  28  -8.930   0.779   0.890
  186    HB3  LEU  28           2HB      LEU  28  -9.477   2.339   0.279
  187    HG   LEU  28           HG       LEU  28  -7.054   2.508  -0.669
  188   HD11  LEU  28          1HD1      LEU  28  -6.829   0.068   0.590
  189   HD12  LEU  28          2HD1      LEU  28  -5.751   0.701  -0.654
  190   HD13  LEU  28          3HD1      LEU  28  -7.082  -0.365  -1.101
  191   HD21  LEU  28          3HD2      LEU  28  -9.343   2.156  -1.837
  192   HD22  LEU  28          1HD2      LEU  28  -8.793   0.492  -2.032
  193   HD23  LEU  28          2HD2      LEU  28  -7.857   1.817  -2.726
  194    H    ALA  29           H        ALA  29  -9.235   4.482   0.899
  195    HA   ALA  29           HA       ALA  29  -7.257   5.936  -0.337
  196    HB1  ALA  29           3HB      ALA  29  -8.930   7.873   0.749
  197    HB2  ALA  29           1HB      ALA  29  -9.100   7.082  -0.818
  198    HB3  ALA  29           2HB      ALA  29  -9.944   6.439   0.591
  199    H    GLN  30           H        GLN  30  -8.240   6.068   3.066
  200    HA   GLN  30           HA       GLN  30  -6.396   8.137   3.751
  201    HB2  GLN  30           1HB      GLN  30  -8.478   7.680   5.023
  202    HB3  GLN  30           2HB      GLN  30  -7.785   6.157   5.563
  203    HG2  GLN  30           1HG      GLN  30  -7.544   7.756   7.311
  204    HG3  GLN  30           2HG      GLN  30  -5.949   7.432   6.634
  205   HE21  GLN  30          1HE2      GLN  30  -4.818   9.055   5.697
  206   HE22  GLN  30          2HE2      GLN  30  -5.354  10.696   5.636
  207    H    HIS  31           H        HIS  31  -6.325   4.631   3.781
  208    HA   HIS  31           HA       HIS  31  -4.002   4.302   5.345
  209    HB2  HIS  31           1HB      HIS  31  -5.132   2.312   5.117
  210    HB3  HIS  31           2HB      HIS  31  -5.534   2.609   3.429
  211    HD1  HIS  31           HD1      HIS  31  -2.246   2.116   5.302
  212    HD2  HIS  31           HD2      HIS  31  -4.239   0.816   1.896
  213    HE1  HIS  31           HE1      HIS  31  -0.680   0.498   4.183
  214    H    GLN  32           H        GLN  32  -4.462   4.480   1.825
  215    HA   GLN  32           HA       GLN  32  -1.972   4.001   0.874
  216    HB2  GLN  32           1HB      GLN  32  -3.960   6.103   0.037
  217    HB3  GLN  32           2HB      GLN  32  -2.467   5.828  -0.850
  218    HG2  GLN  32           1HG      GLN  32  -3.139   3.483  -1.197
  219    HG3  GLN  32           2HG      GLN  32  -4.664   3.827  -0.383
  220   HE21  GLN  32          1HE2      GLN  32  -6.191   3.822  -1.872
  221   HE22  GLN  32          2HE2      GLN  32  -6.133   4.651  -3.386
  222    H    LYS  33           H        LYS  33  -3.077   7.034   2.332
  223    HA   LYS  33           HA       LYS  33  -0.966   8.699   1.898
  224    HB2  LYS  33           1HB      LYS  33  -2.788   8.332   4.242
  225    HB3  LYS  33           2HB      LYS  33  -1.450   9.466   4.369
  226    HG2  LYS  33           1HG      LYS  33  -3.044  10.886   3.616
  227    HG3  LYS  33           2HG      LYS  33  -2.442  10.310   2.060
  228    HD2  LYS  33           1HD      LYS  33  -4.245   8.522   2.199
  229    HD3  LYS  33           2HD      LYS  33  -4.924   9.459   3.532
  230    HE2  LYS  33           1HE      LYS  33  -4.344  10.657   0.835
  231    HE3  LYS  33           2HE      LYS  33  -5.885   9.892   1.221
  232    HZ1  LYS  33           3HZ      LYS  33  -5.108  11.768   3.221
  233    HZ2  LYS  33           1HZ      LYS  33  -6.542  11.684   2.326
  234    HZ3  LYS  33           2HZ      LYS  33  -5.200  12.498   1.697
  235    H    THR  34           H        THR  34  -1.149   6.092   4.274
  236    HA   THR  34           HA       THR  34   1.246   6.617   5.631
  237    HB   THR  34           HB       THR  34   1.170   4.315   6.403
  238    HG1  THR  34           HG1      THR  34   0.359   3.661   4.122
  239   HG21  THR  34          3HG2      THR  34  -0.908   6.182   6.677
  240   HG22  THR  34          1HG2      THR  34  -0.515   4.849   7.761
  241   HG23  THR  34          2HG2      THR  34  -1.689   4.615   6.466
  242    H    HIS  35           H        HIS  35   0.590   4.850   2.659
  243    HA   HIS  35           HA       HIS  35   3.149   3.683   2.370
  244    HB2  HIS  35           1HB      HIS  35   0.882   4.255   0.488
  245    HB3  HIS  35           2HB      HIS  35   2.421   3.666  -0.134
  246    HD1  HIS  35           HD1      HIS  35   3.076   1.598   2.065
  247    HD2  HIS  35           HD2      HIS  35  -0.642   2.006   0.254
  248    HE1  HIS  35           HE1      HIS  35   1.940  -0.627   2.352
  249    H    THR  36           H        THR  36   1.727   6.641   1.003
  250    HA   THR  36           HA       THR  36   4.330   7.435  -0.046
  251    HB   THR  36           HB       THR  36   2.346   7.739  -1.478
  252    HG1  THR  36           HG1      THR  36   3.118  10.359  -0.858
  253   HG21  THR  36          3HG2      THR  36   0.941   9.845  -0.756
  254   HG22  THR  36          1HG2      THR  36   1.429   9.346   0.863
  255   HG23  THR  36          2HG2      THR  36   0.522   8.237  -0.166
  256    H    GLY  37           H        GLY  37   4.069   7.323   2.794
  257    HA2  GLY  37           1HA      GLY  37   4.170   8.650   4.706
  258    HA3  GLY  37           2HA      GLY  37   5.409   9.430   3.734
  259    H    GLU  38           H        GLU  38   5.154  11.516   3.239
  260    HA   GLU  38           HA       GLU  38   2.470  12.675   3.240
  261    HB2  GLU  38           1HB      GLU  38   3.137  14.520   4.682
  262    HB3  GLU  38           2HB      GLU  38   3.335  12.988   5.521
  263    HG2  GLU  38           1HG      GLU  38   5.679  13.057   5.307
  264    HG3  GLU  38           2HG      GLU  38   5.608  14.364   4.126
  265    H    LYS  39           H        LYS  39   2.218  14.417   1.888
  266    HA   LYS  39           HA       LYS  39   3.497  14.699  -0.420
  267    HB2  LYS  39           1HB      LYS  39   1.537  16.075   0.472
  268    HB3  LYS  39           2HB      LYS  39   2.743  17.183   1.114
  269    HG2  LYS  39           1HG      LYS  39   2.055  18.085  -0.946
  270    HG3  LYS  39           2HG      LYS  39   3.642  17.370  -1.237
  271    HD2  LYS  39           1HD      LYS  39   2.275  15.270  -1.933
  272    HD3  LYS  39           2HD      LYS  39   0.943  16.415  -2.108
  273    HE2  LYS  39           1HE      LYS  39   2.588  17.790  -3.527
  274    HE3  LYS  39           2HE      LYS  39   3.548  16.313  -3.593
  275    HZ1  LYS  39           3HZ      LYS  39   2.166  16.350  -5.498
  276    HZ2  LYS  39           1HZ      LYS  39   0.784  16.709  -4.590
  277    HZ3  LYS  39           2HZ      LYS  39   1.512  15.188  -4.457
  278    HA   PRO  40           HA       PRO  40   7.657  15.675   1.136
  279    HB2  PRO  40           1HB      PRO  40   8.923  14.758  -1.084
  280    HB3  PRO  40           2HB      PRO  40   8.388  13.697   0.224
  281    HG2  PRO  40           1HG      PRO  40   7.077  14.273  -2.405
  282    HG3  PRO  40           2HG      PRO  40   7.277  12.721  -1.571
  283    HD2  PRO  40           1HD      PRO  40   4.956  14.113  -1.521
  284    HD3  PRO  40           2HD      PRO  40   5.494  13.105  -0.163
  285    H    SER  41           H        SER  41   7.969  17.824   1.061
  286    HA   SER  41           HA       SER  41   7.993  19.974   0.209
  287    HB2  SER  41           1HB      SER  41  10.299  19.138  -0.034
  288    HB3  SER  41           2HB      SER  41   9.911  18.544  -1.648
  289    HG   SER  41           HG       SER  41  10.495  20.463  -2.265
  290    H    GLY  42           H        GLY  42   5.741  18.709  -0.787
  291    HA2  GLY  42           1HA      GLY  42   5.705  19.380  -3.651
  292    HA3  GLY  42           2HA      GLY  42   4.523  18.378  -2.823
  293    HA   PRO  43           HA       PRO  43   3.385  23.055  -3.016
  294    HB2  PRO  43           1HB      PRO  43   2.085  23.185  -5.396
  295    HB3  PRO  43           2HB      PRO  43   3.809  23.533  -5.223
  296    HG2  PRO  43           1HG      PRO  43   2.467  21.026  -6.160
  297    HG3  PRO  43           2HG      PRO  43   3.894  21.846  -6.821
  298    HD2  PRO  43           1HD      PRO  43   4.075  19.669  -5.220
  299    HD3  PRO  43           2HD      PRO  43   5.300  20.954  -5.227
  300    H    SER  44           H        SER  44   2.066  20.038  -2.971
  301    HA   SER  44           HA       SER  44   0.010  19.155  -2.520
  302    HB2  SER  44           1HB      SER  44  -1.282  20.341  -0.826
  303    HB3  SER  44           2HB      SER  44   0.437  20.458  -0.453
  304    HG   SER  44           HG       SER  44  -1.256  22.437  -1.560
  305    H    SER  45           H        SER  45   0.178  20.305  -5.065
  306    HA   SER  45           HA       SER  45  -2.203  21.890  -5.507
  307    HB2  SER  45           1HB      SER  45  -0.344  20.650  -7.549
  308    HB3  SER  45           2HB      SER  45  -1.527  21.926  -7.837
  309    HG   SER  45           HG       SER  45   0.155  22.586  -5.824
  310    H    GLY  46           H        GLY  46  -4.162  21.114  -5.938
  311    HA2  GLY  46           1HA      GLY  46  -4.873  18.450  -5.768
  312    HA3  GLY  46           2HA      GLY  46  -5.847  19.682  -6.558
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1   1.260 -23.184  -1.952
    2    HA2  GLY   1           1HA      GLY   1   1.671 -26.029  -2.569
    3    HA3  GLY   1           2HA      GLY   1   2.568 -25.308  -1.241
    4    H    SER   2           H        SER   2   1.505 -24.767   0.667
    5    HA   SER   2           HA       SER   2  -0.974 -26.229   1.087
    6    HB2  SER   2           1HB      SER   2  -0.562 -25.795   3.481
    7    HB3  SER   2           2HB      SER   2   0.843 -26.524   2.705
    8    HG   SER   2           HG       SER   2   0.468 -23.888   3.603
    9    H    SER   3           H        SER   3  -2.347 -24.808  -0.122
   10    HA   SER   3           HA       SER   3  -2.972 -22.306   1.308
   11    HB2  SER   3           1HB      SER   3  -2.063 -22.211  -1.134
   12    HB3  SER   3           2HB      SER   3  -3.684 -22.741  -1.579
   13    HG   SER   3           HG       SER   3  -4.253 -20.742  -1.359
   14    H    GLY   4           H        GLY   4  -4.449 -23.382   2.681
   15    HA2  GLY   4           1HA      GLY   4  -6.890 -24.343   1.320
   16    HA3  GLY   4           2HA      GLY   4  -6.340 -24.940   2.879
   17    H    SER   5           H        SER   5  -5.718 -22.561   4.157
   18    HA   SER   5           HA       SER   5  -8.302 -21.718   4.990
   19    HB2  SER   5           1HB      SER   5  -5.523 -20.735   5.650
   20    HB3  SER   5           2HB      SER   5  -6.976 -20.046   6.372
   21    HG   SER   5           HG       SER   5  -6.771 -22.807   6.454
   22    H    SER   6           H        SER   6  -9.566 -20.309   3.996
   23    HA   SER   6           HA       SER   6  -8.424 -17.879   2.864
   24    HB2  SER   6           1HB      SER   6  -8.637 -19.745   1.073
   25    HB3  SER   6           2HB      SER   6 -10.371 -19.442   1.185
   26    HG   SER   6           HG       SER   6  -8.376 -17.514   0.576
   27    H    GLY   7           H        GLY   7 -10.016 -16.216   2.463
   28    HA2  GLY   7           1HA      GLY   7 -12.189 -16.365   4.389
   29    HA3  GLY   7           2HA      GLY   7 -11.654 -14.930   3.526
   30    H    THR   8           H        THR   8 -14.204 -14.979   3.595
   31    HA   THR   8           HA       THR   8 -15.082 -16.127   1.026
   32    HB   THR   8           HB       THR   8 -16.784 -15.761   3.499
   33    HG1  THR   8           HG1      THR   8 -15.488 -17.560   3.767
   34   HG21  THR   8          3HG2      THR   8 -18.120 -15.442   1.529
   35   HG22  THR   8          1HG2      THR   8 -18.459 -17.051   2.165
   36   HG23  THR   8          2HG2      THR   8 -17.411 -16.861   0.760
   37    H    GLY   9           H        GLY   9 -15.531 -14.606  -0.420
   38    HA2  GLY   9           1HA      GLY   9 -16.817 -12.765  -1.191
   39    HA3  GLY   9           2HA      GLY   9 -16.905 -12.169   0.460
   40    H    GLU  10           H        GLU  10 -15.499 -11.706  -2.511
   41    HA   GLU  10           HA       GLU  10 -12.972 -10.660  -1.571
   42    HB2  GLU  10           1HB      GLU  10 -14.258 -10.537  -4.304
   43    HB3  GLU  10           2HB      GLU  10 -12.613 -10.040  -3.932
   44    HG2  GLU  10           1HG      GLU  10 -12.197 -12.396  -3.155
   45    HG3  GLU  10           2HG      GLU  10 -13.765 -12.812  -3.844
   46    H    LYS  11           H        LYS  11 -12.530  -8.610  -1.055
   47    HA   LYS  11           HA       LYS  11 -14.681  -6.701  -0.928
   48    HB2  LYS  11           1HB      LYS  11 -11.816  -6.727  -0.038
   49    HB3  LYS  11           2HB      LYS  11 -12.718  -5.218  -0.061
   50    HG2  LYS  11           1HG      LYS  11 -14.420  -6.278   1.403
   51    HG3  LYS  11           2HG      LYS  11 -13.381  -7.701   1.507
   52    HD2  LYS  11           1HD      LYS  11 -11.587  -5.878   2.204
   53    HD3  LYS  11           2HD      LYS  11 -13.036  -4.996   2.693
   54    HE2  LYS  11           1HE      LYS  11 -12.245  -7.766   3.589
   55    HE3  LYS  11           2HE      LYS  11 -12.134  -6.292   4.549
   56    HZ1  LYS  11           3HZ      LYS  11 -14.438  -6.134   4.706
   57    HZ2  LYS  11           1HZ      LYS  11 -14.142  -7.787   4.908
   58    HZ3  LYS  11           2HZ      LYS  11 -14.709  -7.205   3.425
   59    HA   PRO  12           HA       PRO  12 -13.930  -4.634  -4.742
   60    HB2  PRO  12           1HB      PRO  12 -15.024  -2.222  -4.144
   61    HB3  PRO  12           2HB      PRO  12 -15.994  -3.667  -4.451
   62    HG2  PRO  12           1HG      PRO  12 -15.197  -2.441  -1.839
   63    HG3  PRO  12           2HG      PRO  12 -16.766  -3.104  -2.332
   64    HD2  PRO  12           1HD      PRO  12 -15.019  -4.487  -0.794
   65    HD3  PRO  12           2HD      PRO  12 -16.109  -5.279  -1.949
   66    H    TYR  13           H        TYR  13 -12.667  -3.508  -1.729
   67    HA   TYR  13           HA       TYR  13 -10.813  -1.712  -3.150
   68    HB2  TYR  13           1HB      TYR  13 -11.518  -1.691  -0.209
   69    HB3  TYR  13           2HB      TYR  13 -10.512  -0.521  -1.055
   70    HD1  TYR  13           HD1      TYR  13 -11.528   1.097  -2.608
   71    HD2  TYR  13           HD2      TYR  13 -13.914  -1.591  -0.330
   72    HE1  TYR  13           HE1      TYR  13 -13.514   2.469  -3.079
   73    HE2  TYR  13           HE2      TYR  13 -15.906  -0.227  -0.796
   74    HH   TYR  13           HH       TYR  13 -16.514   1.505  -2.843
   75    H    GLU  14           H        GLU  14  -8.901  -2.613  -3.495
   76    HA   GLU  14           HA       GLU  14  -7.666  -4.169  -1.332
   77    HB2  GLU  14           1HB      GLU  14  -8.581  -5.723  -3.033
   78    HB3  GLU  14           2HB      GLU  14  -7.594  -4.935  -4.255
   79    HG2  GLU  14           1HG      GLU  14  -6.258  -6.030  -1.837
   80    HG3  GLU  14           2HG      GLU  14  -6.813  -7.147  -3.083
   81    H    CYS  15           H        CYS  15  -5.673  -3.516  -0.852
   82    HA   CYS  15           HA       CYS  15  -4.457  -1.406  -2.394
   83    HB2  CYS  15           1HB      CYS  15  -4.412  -1.361   0.066
   84    HB3  CYS  15           2HB      CYS  15  -3.467  -2.847   0.076
   85    H    LYS  16           H        LYS  16  -2.647  -1.501  -3.635
   86    HA   LYS  16           HA       LYS  16  -1.662  -4.188  -4.285
   87    HB2  LYS  16           1HB      LYS  16  -1.527  -1.587  -5.818
   88    HB3  LYS  16           2HB      LYS  16  -0.753  -3.077  -6.342
   89    HG2  LYS  16           1HG      LYS  16  -3.021  -4.151  -6.309
   90    HG3  LYS  16           2HG      LYS  16  -3.696  -2.541  -6.044
   91    HD2  LYS  16           1HD      LYS  16  -1.801  -2.910  -8.306
   92    HD3  LYS  16           2HD      LYS  16  -3.431  -3.566  -8.474
   93    HE2  LYS  16           1HE      LYS  16  -3.133  -0.781  -7.478
   94    HE3  LYS  16           2HE      LYS  16  -2.835  -1.085  -9.189
   95    HZ1  LYS  16           3HZ      LYS  16  -5.193  -0.483  -8.472
   96    HZ2  LYS  16           1HZ      LYS  16  -5.291  -2.061  -7.872
   97    HZ3  LYS  16           2HZ      LYS  16  -5.006  -1.799  -9.518
   98    H    VAL  17           H        VAL  17  -0.815  -2.538  -1.959
   99    HA   VAL  17           HA       VAL  17   2.051  -2.323  -2.618
  100    HB   VAL  17           HB       VAL  17   0.528  -0.785  -0.510
  101   HG11  VAL  17          1HG1      VAL  17   3.439  -0.805  -1.277
  102   HG12  VAL  17          2HG1      VAL  17   2.694   0.476  -0.319
  103   HG13  VAL  17          3HG1      VAL  17   2.731  -1.178   0.294
  104   HG21  VAL  17          3HG2      VAL  17   0.572   1.069  -1.879
  105   HG22  VAL  17          1HG2      VAL  17   1.924   0.461  -2.835
  106   HG23  VAL  17          2HG2      VAL  17   0.313  -0.221  -3.054
  107    H    CYS  18           H        CYS  18  -0.331  -3.292  -0.203
  108    HA   CYS  18           HA       CYS  18   1.686  -5.088   0.958
  109    HB2  CYS  18           1HB      CYS  18   0.676  -4.653   3.206
  110    HB3  CYS  18           2HB      CYS  18   1.508  -3.263   2.517
  111    H    SER  19           H        SER  19  -0.951  -5.038  -0.794
  112    HA   SER  19           HA       SER  19  -2.680  -6.456  -1.215
  113    HB2  SER  19           1HB      SER  19  -0.683  -8.071  -0.976
  114    HB3  SER  19           2HB      SER  19  -1.359  -8.461   0.605
  115    HG   SER  19           HG       SER  19  -2.842  -8.601  -1.806
  116    H    LYS  20           H        LYS  20  -3.140  -4.628   0.814
  117    HA   LYS  20           HA       LYS  20  -4.563  -6.130   2.893
  118    HB2  LYS  20           1HB      LYS  20  -2.972  -4.285   3.528
  119    HB3  LYS  20           2HB      LYS  20  -4.075  -3.152   2.759
  120    HG2  LYS  20           1HG      LYS  20  -5.842  -3.842   4.322
  121    HG3  LYS  20           2HG      LYS  20  -4.694  -4.923   5.115
  122    HD2  LYS  20           1HD      LYS  20  -3.296  -3.034   5.722
  123    HD3  LYS  20           2HD      LYS  20  -4.373  -1.932   4.860
  124    HE2  LYS  20           1HE      LYS  20  -5.182  -1.661   6.973
  125    HE3  LYS  20           2HE      LYS  20  -6.173  -3.027   6.463
  126    HZ1  LYS  20           3HZ      LYS  20  -3.747  -3.976   7.533
  127    HZ2  LYS  20           1HZ      LYS  20  -5.323  -4.239   8.089
  128    HZ3  LYS  20           2HZ      LYS  20  -4.447  -2.900   8.635
  129    H    ALA  21           H        ALA  21  -6.749  -5.992   3.174
  130    HA   ALA  21           HA       ALA  21  -8.239  -4.549   1.080
  131    HB1  ALA  21           3HB      ALA  21  -9.524  -6.789   2.534
  132    HB2  ALA  21           1HB      ALA  21  -9.681  -6.288   0.849
  133    HB3  ALA  21           2HB      ALA  21  -8.259  -7.191   1.373
  134    H    PHE  22           H        PHE  22 -10.117  -3.434   1.642
  135    HA   PHE  22           HA       PHE  22 -10.617  -3.102   4.521
  136    HB2  PHE  22           1HB      PHE  22 -10.733  -0.799   2.582
  137    HB3  PHE  22           2HB      PHE  22 -10.723  -0.743   4.342
  138    HD1  PHE  22           HD1      PHE  22  -8.651  -1.492   1.373
  139    HD2  PHE  22           HD2      PHE  22  -8.707  -0.626   5.540
  140    HE1  PHE  22           HE1      PHE  22  -6.208  -1.202   1.342
  141    HE2  PHE  22           HE2      PHE  22  -6.265  -0.333   5.515
  142    HZ   PHE  22           HZ       PHE  22  -5.012  -0.620   3.415
  143    H    THR  23           H        THR  23 -12.734  -2.786   5.126
  144    HA   THR  23           HA       THR  23 -14.723  -3.686   3.263
  145    HB   THR  23           HB       THR  23 -14.851  -4.373   5.602
  146    HG1  THR  23           HG1      THR  23 -16.905  -2.952   4.364
  147   HG21  THR  23          3HG2      THR  23 -15.900  -1.941   6.734
  148   HG22  THR  23          1HG2      THR  23 -14.262  -1.685   6.134
  149   HG23  THR  23          2HG2      THR  23 -14.582  -2.962   7.308
  150    H    GLN  24           H        GLN  24 -13.478  -0.651   4.165
  151    HA   GLN  24           HA       GLN  24 -15.697   0.678   2.770
  152    HB2  GLN  24           1HB      GLN  24 -14.368   1.536   5.337
  153    HB3  GLN  24           2HB      GLN  24 -15.310   2.637   4.341
  154    HG2  GLN  24           1HG      GLN  24 -17.302   1.475   4.738
  155    HG3  GLN  24           2HG      GLN  24 -16.451   0.056   5.346
  156   HE21  GLN  24          1HE2      GLN  24 -16.272  -0.155   7.464
  157   HE22  GLN  24          2HE2      GLN  24 -16.527   1.093   8.630
  158    H    LYS  25           H        LYS  25 -15.145   2.555   1.599
  159    HA   LYS  25           HA       LYS  25 -12.615   2.473   0.351
  160    HB2  LYS  25           1HB      LYS  25 -14.564   3.306  -0.827
  161    HB3  LYS  25           2HB      LYS  25 -14.750   4.613   0.335
  162    HG2  LYS  25           1HG      LYS  25 -12.286   5.172  -0.460
  163    HG3  LYS  25           2HG      LYS  25 -12.833   4.319  -1.906
  164    HD2  LYS  25           1HD      LYS  25 -14.674   5.838  -2.175
  165    HD3  LYS  25           2HD      LYS  25 -14.322   6.609  -0.627
  166    HE2  LYS  25           1HE      LYS  25 -13.473   8.037  -2.326
  167    HE3  LYS  25           2HE      LYS  25 -12.086   7.253  -1.571
  168    HZ1  LYS  25           3HZ      LYS  25 -12.979   7.133  -4.280
  169    HZ2  LYS  25           1HZ      LYS  25 -12.778   5.588  -3.622
  170    HZ3  LYS  25           2HZ      LYS  25 -11.489   6.682  -3.618
  171    H    ALA  26           H        ALA  26 -14.033   4.984   2.455
  172    HA   ALA  26           HA       ALA  26 -11.987   6.725   2.720
  173    HB1  ALA  26           3HB      ALA  26 -13.996   7.161   3.887
  174    HB2  ALA  26           1HB      ALA  26 -13.842   5.692   4.850
  175    HB3  ALA  26           2HB      ALA  26 -12.734   7.040   5.113
  176    H    HIS  27           H        HIS  27 -12.219   3.574   4.298
  177    HA   HIS  27           HA       HIS  27  -9.968   3.826   5.965
  178    HB2  HIS  27           1HB      HIS  27 -11.333   1.411   4.777
  179    HB3  HIS  27           2HB      HIS  27  -9.990   1.287   5.909
  180    HD1  HIS  27           HD1      HIS  27 -12.900   0.240   6.486
  181    HD2  HIS  27           HD2      HIS  27 -11.323   3.854   7.795
  182    HE1  HIS  27           HE1      HIS  27 -14.253   0.870   8.510
  183    H    LEU  28           H        LEU  28 -10.324   2.587   2.666
  184    HA   LEU  28           HA       LEU  28  -7.646   1.744   2.356
  185    HB2  LEU  28           1HB      LEU  28  -9.217   0.867   0.847
  186    HB3  LEU  28           2HB      LEU  28  -9.826   2.466   0.425
  187    HG   LEU  28           HG       LEU  28  -7.600   2.897  -0.679
  188   HD11  LEU  28          1HD1      LEU  28  -6.409   1.072   0.535
  189   HD12  LEU  28          2HD1      LEU  28  -6.182   1.052  -1.214
  190   HD13  LEU  28          3HD1      LEU  28  -7.291  -0.091  -0.456
  191   HD21  LEU  28          3HD2      LEU  28  -8.860   2.491  -2.460
  192   HD22  LEU  28          1HD2      LEU  28  -9.843   1.337  -1.559
  193   HD23  LEU  28          2HD2      LEU  28  -8.372   0.798  -2.370
  194    H    ALA  29           H        ALA  29  -9.293   4.672   1.157
  195    HA   ALA  29           HA       ALA  29  -7.054   5.932   0.082
  196    HB1  ALA  29           3HB      ALA  29  -8.558   7.469  -0.471
  197    HB2  ALA  29           1HB      ALA  29  -9.755   6.560   0.452
  198    HB3  ALA  29           2HB      ALA  29  -8.852   7.865   1.222
  199    H    GLN  30           H        GLN  30  -8.194   5.753   3.387
  200    HA   GLN  30           HA       GLN  30  -6.400   7.782   4.356
  201    HB2  GLN  30           1HB      GLN  30  -8.660   7.080   5.368
  202    HB3  GLN  30           2HB      GLN  30  -7.780   5.722   6.059
  203    HG2  GLN  30           1HG      GLN  30  -6.875   8.546   6.479
  204    HG3  GLN  30           2HG      GLN  30  -8.114   7.809   7.495
  205   HE21  GLN  30          1HE2      GLN  30  -7.430   5.517   8.247
  206   HE22  GLN  30          2HE2      GLN  30  -5.837   5.412   8.907
  207    H    HIS  31           H        HIS  31  -6.143   4.489   3.576
  208    HA   HIS  31           HA       HIS  31  -3.882   4.040   5.372
  209    HB2  HIS  31           1HB      HIS  31  -5.158   2.113   5.371
  210    HB3  HIS  31           2HB      HIS  31  -5.610   2.286   3.678
  211    HD1  HIS  31           HD1      HIS  31  -3.019   0.824   5.901
  212    HD2  HIS  31           HD2      HIS  31  -3.721   1.272   1.831
  213    HE1  HIS  31           HE1      HIS  31  -1.389  -0.717   4.764
  214    H    GLN  32           H        GLN  32  -4.575   3.689   1.889
  215    HA   GLN  32           HA       GLN  32  -2.076   3.193   0.926
  216    HB2  GLN  32           1HB      GLN  32  -4.407   4.696  -0.175
  217    HB3  GLN  32           2HB      GLN  32  -2.885   4.748  -1.056
  218    HG2  GLN  32           1HG      GLN  32  -2.970   2.161  -0.814
  219    HG3  GLN  32           2HG      GLN  32  -4.688   2.434  -0.526
  220   HE21  GLN  32          1HE2      GLN  32  -2.711   1.482  -2.812
  221   HE22  GLN  32          2HE2      GLN  32  -3.462   2.146  -4.219
  222    H    LYS  33           H        LYS  33  -3.300   6.209   2.174
  223    HA   LYS  33           HA       LYS  33  -1.512   8.045   1.158
  224    HB2  LYS  33           1HB      LYS  33  -2.133   9.463   2.900
  225    HB3  LYS  33           2HB      LYS  33  -3.505   8.370   2.774
  226    HG2  LYS  33           1HG      LYS  33  -2.857   7.176   4.702
  227    HG3  LYS  33           2HG      LYS  33  -1.262   7.933   4.723
  228    HD2  LYS  33           1HD      LYS  33  -2.637   8.934   6.432
  229    HD3  LYS  33           2HD      LYS  33  -2.355  10.116   5.152
  230    HE2  LYS  33           1HE      LYS  33  -4.595   9.260   4.190
  231    HE3  LYS  33           2HE      LYS  33  -4.851   8.589   5.800
  232    HZ1  LYS  33           3HZ      LYS  33  -5.849  10.731   5.721
  233    HZ2  LYS  33           1HZ      LYS  33  -4.447  11.442   5.094
  234    HZ3  LYS  33           2HZ      LYS  33  -4.463  10.863   6.683
  235    H    THR  34           H        THR  34  -1.066   5.777   3.823
  236    HA   THR  34           HA       THR  34   1.385   6.747   4.777
  237    HB   THR  34           HB       THR  34  -0.077   5.025   5.904
  238    HG1  THR  34           HG1      THR  34   1.723   4.955   7.010
  239   HG21  THR  34          3HG2      THR  34   0.652   3.541   3.540
  240   HG22  THR  34          1HG2      THR  34  -0.543   3.155   4.779
  241   HG23  THR  34          2HG2      THR  34   1.140   2.674   4.996
  242    H    HIS  35           H        HIS  35   0.603   5.006   1.916
  243    HA   HIS  35           HA       HIS  35   3.306   4.050   1.483
  244    HB2  HIS  35           1HB      HIS  35   0.847   3.960  -0.275
  245    HB3  HIS  35           2HB      HIS  35   2.392   3.219  -0.679
  246    HD1  HIS  35           HD1      HIS  35   3.031   1.932   2.062
  247    HD2  HIS  35           HD2      HIS  35  -0.660   1.729   0.165
  248    HE1  HIS  35           HE1      HIS  35   1.902  -0.108   3.004
  249    H    THR  36           H        THR  36   4.815   5.439   0.855
  250    HA   THR  36           HA       THR  36   4.168   7.903  -0.477
  251    HB   THR  36           HB       THR  36   6.665   8.213  -0.546
  252    HG1  THR  36           HG1      THR  36   7.502   6.190  -0.500
  253   HG21  THR  36          3HG2      THR  36   5.061   8.822   1.395
  254   HG22  THR  36          1HG2      THR  36   6.799   8.843   1.691
  255   HG23  THR  36          2HG2      THR  36   5.828   7.475   2.236
  256    H    GLY  37           H        GLY  37   5.270   8.581  -2.490
  257    HA2  GLY  37           1HA      GLY  37   6.474   7.819  -4.499
  258    HA3  GLY  37           2HA      GLY  37   5.584   6.310  -4.356
  259    H    GLU  38           H        GLU  38   5.673   9.356  -5.789
  260    HA   GLU  38           HA       GLU  38   2.814   9.358  -6.408
  261    HB2  GLU  38           1HB      GLU  38   4.278  11.435  -5.721
  262    HB3  GLU  38           2HB      GLU  38   4.710  11.434  -7.425
  263    HG2  GLU  38           1HG      GLU  38   1.908  11.587  -6.338
  264    HG3  GLU  38           2HG      GLU  38   2.855  12.950  -6.932
  265    H    LYS  39           H        LYS  39   2.195   8.226  -8.117
  266    HA   LYS  39           HA       LYS  39   4.011   7.433 -10.183
  267    HB2  LYS  39           1HB      LYS  39   2.085   6.048  -9.382
  268    HB3  LYS  39           2HB      LYS  39   0.998   7.199 -10.147
  269    HG2  LYS  39           1HG      LYS  39   1.971   6.687 -12.323
  270    HG3  LYS  39           2HG      LYS  39   3.078   5.543 -11.561
  271    HD2  LYS  39           1HD      LYS  39   0.809   4.543 -10.624
  272    HD3  LYS  39           2HD      LYS  39   0.157   5.320 -12.069
  273    HE2  LYS  39           1HE      LYS  39   0.710   3.065 -12.632
  274    HE3  LYS  39           2HE      LYS  39   1.892   4.122 -13.404
  275    HZ1  LYS  39           3HZ      LYS  39   3.558   3.319 -12.150
  276    HZ2  LYS  39           1HZ      LYS  39   2.545   1.976 -11.977
  277    HZ3  LYS  39           2HZ      LYS  39   2.604   3.152 -10.763
  278    HA   PRO  40           HA       PRO  40   3.490  11.133 -12.608
  279    HB2  PRO  40           1HB      PRO  40   5.046  10.327 -14.681
  280    HB3  PRO  40           2HB      PRO  40   5.711  10.905 -13.149
  281    HG2  PRO  40           1HG      PRO  40   5.325   8.095 -14.105
  282    HG3  PRO  40           2HG      PRO  40   6.710   8.808 -13.258
  283    HD2  PRO  40           1HD      PRO  40   4.841   7.313 -11.993
  284    HD3  PRO  40           2HD      PRO  40   5.689   8.654 -11.197
  285    H    SER  41           H        SER  41   2.325  11.750 -14.417
  286    HA   SER  41           HA       SER  41   0.567  11.591 -15.869
  287    HB2  SER  41           1HB      SER  41   2.282   9.291 -16.833
  288    HB3  SER  41           2HB      SER  41   0.942   9.986 -17.743
  289    HG   SER  41           HG       SER  41   2.058  11.930 -17.841
  290    H    GLY  42           H        GLY  42  -0.339  10.667 -13.590
  291    HA2  GLY  42           1HA      GLY  42  -1.272   7.940 -13.772
  292    HA3  GLY  42           2HA      GLY  42  -1.665   9.098 -12.509
  293    HA   PRO  43           HA       PRO  43  -5.229   8.451 -15.579
  294    HB2  PRO  43           1HB      PRO  43  -6.872   7.036 -13.945
  295    HB3  PRO  43           2HB      PRO  43  -5.695   6.271 -15.020
  296    HG2  PRO  43           1HG      PRO  43  -5.492   6.843 -12.088
  297    HG3  PRO  43           2HG      PRO  43  -5.017   5.385 -12.979
  298    HD2  PRO  43           1HD      PRO  43  -3.230   7.265 -12.203
  299    HD3  PRO  43           2HD      PRO  43  -3.030   6.314 -13.689
  300    H    SER  44           H        SER  44  -4.564   9.810 -12.582
  301    HA   SER  44           HA       SER  44  -6.945  10.695 -11.550
  302    HB2  SER  44           1HB      SER  44  -4.424  11.158 -10.870
  303    HB3  SER  44           2HB      SER  44  -4.709  12.670 -11.733
  304    HG   SER  44           HG       SER  44  -5.567  11.901  -9.282
  305    H    SER  45           H        SER  45  -8.371  12.344 -11.943
  306    HA   SER  45           HA       SER  45  -8.182  13.568 -14.605
  307    HB2  SER  45           1HB      SER  45 -10.574  13.806 -14.547
  308    HB3  SER  45           2HB      SER  45 -10.192  12.161 -14.036
  309    HG   SER  45           HG       SER  45 -11.161  12.583 -12.234
  310    H    GLY  46           H        GLY  46  -8.465  15.773 -14.910
  311    HA2  GLY  46           1HA      GLY  46  -7.863  17.394 -12.553
  312    HA3  GLY  46           2HA      GLY  46  -7.712  17.902 -14.229
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1 -19.586 -32.439  -4.246
    2    HA2  GLY   1           1HA      GLY   1 -17.564 -31.920  -2.156
    3    HA3  GLY   1           2HA      GLY   1 -17.102 -32.262  -3.816
    4    H    SER   2           H        SER   2 -15.975 -30.171  -3.565
    5    HA   SER   2           HA       SER   2 -15.762 -27.933  -3.933
    6    HB2  SER   2           1HB      SER   2 -17.032 -28.857  -6.037
    7    HB3  SER   2           2HB      SER   2 -18.385 -27.933  -5.384
    8    HG   SER   2           HG       SER   2 -17.129 -26.693  -6.835
    9    H    SER   3           H        SER   3 -16.891 -28.551  -1.478
   10    HA   SER   3           HA       SER   3 -18.838 -26.366  -1.120
   11    HB2  SER   3           1HB      SER   3 -20.001 -28.352  -0.570
   12    HB3  SER   3           2HB      SER   3 -18.611 -29.028   0.279
   13    HG   SER   3           HG       SER   3 -18.915 -27.520   1.911
   14    H    GLY   4           H        GLY   4 -17.535 -24.702  -0.535
   15    HA2  GLY   4           1HA      GLY   4 -16.053 -25.045   1.982
   16    HA3  GLY   4           2HA      GLY   4 -15.239 -24.329   0.600
   17    H    SER   5           H        SER   5 -16.705 -22.508  -0.441
   18    HA   SER   5           HA       SER   5 -18.094 -20.935   1.569
   19    HB2  SER   5           1HB      SER   5 -16.687 -18.983   1.347
   20    HB3  SER   5           2HB      SER   5 -15.670 -20.349   1.807
   21    HG   SER   5           HG       SER   5 -15.855 -19.009  -0.652
   22    H    SER   6           H        SER   6 -19.873 -20.215   0.627
   23    HA   SER   6           HA       SER   6 -19.751 -19.418  -2.206
   24    HB2  SER   6           1HB      SER   6 -20.974 -21.650  -1.611
   25    HB3  SER   6           2HB      SER   6 -22.252 -20.586  -1.023
   26    HG   SER   6           HG       SER   6 -22.644 -21.056  -3.175
   27    H    GLY   7           H        GLY   7 -20.522 -17.446  -2.654
   28    HA2  GLY   7           1HA      GLY   7 -22.502 -15.932  -2.132
   29    HA3  GLY   7           2HA      GLY   7 -21.912 -16.017  -0.479
   30    H    THR   8           H        THR   8 -19.614 -15.301  -0.163
   31    HA   THR   8           HA       THR   8 -19.287 -12.723  -1.409
   32    HB   THR   8           HB       THR   8 -17.302 -12.519   0.098
   33    HG1  THR   8           HG1      THR   8 -17.574 -14.399   1.799
   34   HG21  THR   8          3HG2      THR   8 -19.466 -13.446   1.890
   35   HG22  THR   8          1HG2      THR   8 -19.902 -12.220   0.701
   36   HG23  THR   8          2HG2      THR   8 -18.605 -11.908   1.855
   37    H    GLY   9           H        GLY   9 -17.075 -12.031  -2.159
   38    HA2  GLY   9           1HA      GLY   9 -15.648 -14.209  -3.534
   39    HA3  GLY   9           2HA      GLY   9 -16.197 -12.812  -4.447
   40    H    GLU  10           H        GLU  10 -15.325 -10.703  -3.839
   41    HA   GLU  10           HA       GLU  10 -12.897 -10.708  -2.246
   42    HB2  GLU  10           1HB      GLU  10 -12.246 -11.388  -4.586
   43    HB3  GLU  10           2HB      GLU  10 -12.800  -9.809  -5.126
   44    HG2  GLU  10           1HG      GLU  10 -11.162  -8.900  -3.337
   45    HG3  GLU  10           2HG      GLU  10 -10.442 -10.506  -3.434
   46    H    LYS  11           H        LYS  11 -12.607  -8.818  -1.224
   47    HA   LYS  11           HA       LYS  11 -14.537  -6.886  -1.030
   48    HB2  LYS  11           1HB      LYS  11 -11.633  -6.972  -0.400
   49    HB3  LYS  11           2HB      LYS  11 -12.406  -5.393  -0.398
   50    HG2  LYS  11           1HG      LYS  11 -12.707  -5.964   1.778
   51    HG3  LYS  11           2HG      LYS  11 -14.181  -6.654   1.094
   52    HD2  LYS  11           1HD      LYS  11 -11.749  -8.360   1.163
   53    HD3  LYS  11           2HD      LYS  11 -12.581  -8.048   2.688
   54    HE2  LYS  11           1HE      LYS  11 -13.929  -9.093   0.203
   55    HE3  LYS  11           2HE      LYS  11 -13.328 -10.117   1.506
   56    HZ1  LYS  11           3HZ      LYS  11 -15.326  -7.960   1.900
   57    HZ2  LYS  11           1HZ      LYS  11 -14.859  -9.140   3.018
   58    HZ3  LYS  11           2HZ      LYS  11 -15.735  -9.581   1.640
   59    HA   PRO  12           HA       PRO  12 -14.362  -4.440  -4.682
   60    HB2  PRO  12           1HB      PRO  12 -15.336  -2.100  -3.709
   61    HB3  PRO  12           2HB      PRO  12 -16.350  -3.520  -3.988
   62    HG2  PRO  12           1HG      PRO  12 -15.149  -2.523  -1.434
   63    HG3  PRO  12           2HG      PRO  12 -16.779  -3.153  -1.733
   64    HD2  PRO  12           1HD      PRO  12 -14.821  -4.652  -0.615
   65    HD3  PRO  12           2HD      PRO  12 -16.083  -5.348  -1.651
   66    H    TYR  13           H        TYR  13 -12.616  -3.606  -1.828
   67    HA   TYR  13           HA       TYR  13 -10.833  -1.907  -3.437
   68    HB2  TYR  13           1HB      TYR  13 -11.510  -1.396  -0.536
   69    HB3  TYR  13           2HB      TYR  13 -10.518  -0.392  -1.587
   70    HD1  TYR  13           HD1      TYR  13 -11.578   0.910  -3.412
   71    HD2  TYR  13           HD2      TYR  13 -13.893  -1.241  -0.564
   72    HE1  TYR  13           HE1      TYR  13 -13.565   2.208  -4.056
   73    HE2  TYR  13           HE2      TYR  13 -15.887   0.050  -1.201
   74    HH   TYR  13           HH       TYR  13 -16.728   1.356  -3.028
   75    H    GLU  14           H        GLU  14  -8.901  -2.815  -3.564
   76    HA   GLU  14           HA       GLU  14  -7.782  -4.120  -1.187
   77    HB2  GLU  14           1HB      GLU  14  -8.754  -5.791  -2.850
   78    HB3  GLU  14           2HB      GLU  14  -7.473  -5.293  -3.946
   79    HG2  GLU  14           1HG      GLU  14  -6.476  -7.093  -2.995
   80    HG3  GLU  14           2HG      GLU  14  -5.950  -5.844  -1.868
   81    H    CYS  15           H        CYS  15  -5.731  -3.568  -0.774
   82    HA   CYS  15           HA       CYS  15  -4.451  -1.597  -2.410
   83    HB2  CYS  15           1HB      CYS  15  -4.327  -1.636   0.087
   84    HB3  CYS  15           2HB      CYS  15  -3.324  -3.078  -0.027
   85    H    LYS  16           H        LYS  16  -2.140  -1.811  -3.063
   86    HA   LYS  16           HA       LYS  16  -1.688  -4.469  -4.242
   87    HB2  LYS  16           1HB      LYS  16  -0.862  -1.709  -5.131
   88    HB3  LYS  16           2HB      LYS  16  -0.161  -3.168  -5.817
   89    HG2  LYS  16           1HG      LYS  16  -1.834  -2.642  -7.318
   90    HG3  LYS  16           2HG      LYS  16  -2.604  -3.850  -6.286
   91    HD2  LYS  16           1HD      LYS  16  -3.434  -1.836  -4.913
   92    HD3  LYS  16           2HD      LYS  16  -3.004  -0.876  -6.331
   93    HE2  LYS  16           1HE      LYS  16  -4.479  -2.252  -7.710
   94    HE3  LYS  16           2HE      LYS  16  -4.896  -3.228  -6.303
   95    HZ1  LYS  16           3HZ      LYS  16  -6.393  -1.738  -5.666
   96    HZ2  LYS  16           1HZ      LYS  16  -6.192  -0.976  -7.163
   97    HZ3  LYS  16           2HZ      LYS  16  -5.309  -0.449  -5.821
   98    H    VAL  17           H        VAL  17  -0.219  -1.876  -2.391
   99    HA   VAL  17           HA       VAL  17   2.421  -2.884  -2.359
  100    HB   VAL  17           HB       VAL  17   1.082  -1.188  -0.248
  101   HG11  VAL  17          1HG1      VAL  17   3.962  -0.959  -0.903
  102   HG12  VAL  17          2HG1      VAL  17   3.131  -0.773   0.643
  103   HG13  VAL  17          3HG1      VAL  17   3.451  -2.385  -0.001
  104   HG21  VAL  17          3HG2      VAL  17   2.802   0.012  -2.341
  105   HG22  VAL  17          1HG2      VAL  17   1.178  -0.485  -2.817
  106   HG23  VAL  17          2HG2      VAL  17   1.397   0.677  -1.509
  107    H    CYS  18           H        CYS  18  -0.015  -2.930   0.252
  108    HA   CYS  18           HA       CYS  18   1.343  -5.285   1.368
  109    HB2  CYS  18           1HB      CYS  18   0.057  -4.737   3.449
  110    HB3  CYS  18           2HB      CYS  18   1.196  -3.489   2.956
  111    H    SER  19           H        SER  19  -0.650  -5.179  -0.884
  112    HA   SER  19           HA       SER  19  -2.688  -6.094  -1.494
  113    HB2  SER  19           1HB      SER  19  -2.572  -8.469  -1.424
  114    HB3  SER  19           2HB      SER  19  -0.900  -7.911  -1.482
  115    HG   SER  19           HG       SER  19  -1.485  -9.586   0.137
  116    H    LYS  20           H        LYS  20  -2.911  -4.636   0.974
  117    HA   LYS  20           HA       LYS  20  -4.383  -6.153   2.884
  118    HB2  LYS  20           1HB      LYS  20  -3.186  -4.071   3.457
  119    HB3  LYS  20           2HB      LYS  20  -4.306  -3.160   2.453
  120    HG2  LYS  20           1HG      LYS  20  -5.039  -2.874   4.667
  121    HG3  LYS  20           2HG      LYS  20  -6.152  -4.035   3.939
  122    HD2  LYS  20           1HD      LYS  20  -5.702  -5.048   5.958
  123    HD3  LYS  20           2HD      LYS  20  -4.486  -5.798   4.921
  124    HE2  LYS  20           1HE      LYS  20  -3.821  -3.283   6.386
  125    HE3  LYS  20           2HE      LYS  20  -3.827  -4.815   7.258
  126    HZ1  LYS  20           3HZ      LYS  20  -2.431  -5.283   4.929
  127    HZ2  LYS  20           1HZ      LYS  20  -1.789  -5.134   6.487
  128    HZ3  LYS  20           2HZ      LYS  20  -1.878  -3.781   5.477
  129    H    ALA  21           H        ALA  21  -6.640  -5.894   3.406
  130    HA   ALA  21           HA       ALA  21  -8.301  -5.169   1.082
  131    HB1  ALA  21           3HB      ALA  21  -8.576  -7.435   1.025
  132    HB2  ALA  21           1HB      ALA  21  -8.322  -7.622   2.761
  133    HB3  ALA  21           2HB      ALA  21  -9.861  -7.009   2.155
  134    H    PHE  22           H        PHE  22  -9.901  -3.770   1.464
  135    HA   PHE  22           HA       PHE  22 -10.686  -3.287   4.262
  136    HB2  PHE  22           1HB      PHE  22 -10.627  -1.148   2.138
  137    HB3  PHE  22           2HB      PHE  22 -10.782  -0.944   3.879
  138    HD1  PHE  22           HD1      PHE  22  -8.480  -1.584   1.116
  139    HD2  PHE  22           HD2      PHE  22  -8.851  -1.071   5.325
  140    HE1  PHE  22           HE1      PHE  22  -6.044  -1.289   1.291
  141    HE2  PHE  22           HE2      PHE  22  -6.416  -0.775   5.507
  142    HZ   PHE  22           HZ       PHE  22  -5.009  -0.882   3.488
  143    H    THR  23           H        THR  23 -12.851  -2.610   4.616
  144    HA   THR  23           HA       THR  23 -14.702  -3.732   2.679
  145    HB   THR  23           HB       THR  23 -15.005  -4.310   5.036
  146    HG1  THR  23           HG1      THR  23 -17.288  -3.263   5.123
  147   HG21  THR  23          3HG2      THR  23 -14.233  -1.840   5.670
  148   HG22  THR  23          1HG2      THR  23 -15.236  -2.814   6.744
  149   HG23  THR  23          2HG2      THR  23 -15.978  -1.589   5.715
  150    H    GLN  24           H        GLN  24 -13.857  -0.614   4.055
  151    HA   GLN  24           HA       GLN  24 -15.815   0.656   2.258
  152    HB2  GLN  24           1HB      GLN  24 -14.780   1.459   4.961
  153    HB3  GLN  24           2HB      GLN  24 -15.462   2.655   3.866
  154    HG2  GLN  24           1HG      GLN  24 -17.555   1.386   3.796
  155    HG3  GLN  24           2HG      GLN  24 -16.870   0.211   4.917
  156   HE21  GLN  24          1HE2      GLN  24 -18.685   0.734   6.271
  157   HE22  GLN  24          2HE2      GLN  24 -18.629   2.134   7.281
  158    H    LYS  25           H        LYS  25 -15.013   3.131   1.991
  159    HA   LYS  25           HA       LYS  25 -12.511   2.887   0.540
  160    HB2  LYS  25           1HB      LYS  25 -14.474   5.178   0.743
  161    HB3  LYS  25           2HB      LYS  25 -13.065   5.149  -0.308
  162    HG2  LYS  25           1HG      LYS  25 -14.591   4.460  -1.817
  163    HG3  LYS  25           2HG      LYS  25 -14.234   2.884  -1.107
  164    HD2  LYS  25           1HD      LYS  25 -16.593   3.051  -1.189
  165    HD3  LYS  25           2HD      LYS  25 -16.142   3.318   0.496
  166    HE2  LYS  25           1HE      LYS  25 -16.261   5.766   0.074
  167    HE3  LYS  25           2HE      LYS  25 -16.860   5.417  -1.547
  168    HZ1  LYS  25           3HZ      LYS  25 -18.579   5.905   0.217
  169    HZ2  LYS  25           1HZ      LYS  25 -18.206   4.395   0.883
  170    HZ3  LYS  25           2HZ      LYS  25 -18.822   4.498  -0.689
  171    H    ALA  26           H        ALA  26 -13.870   5.051   3.023
  172    HA   ALA  26           HA       ALA  26 -11.829   6.723   3.565
  173    HB1  ALA  26           3HB      ALA  26 -12.909   7.192   5.477
  174    HB2  ALA  26           1HB      ALA  26 -14.118   6.064   4.863
  175    HB3  ALA  26           2HB      ALA  26 -12.900   5.512   6.014
  176    H    HIS  27           H        HIS  27 -12.041   3.363   4.685
  177    HA   HIS  27           HA       HIS  27  -9.739   3.312   6.258
  178    HB2  HIS  27           1HB      HIS  27 -11.221   1.196   4.722
  179    HB3  HIS  27           2HB      HIS  27  -9.736   0.805   5.585
  180    HD1  HIS  27           HD1      HIS  27 -13.288   0.939   6.047
  181    HD2  HIS  27           HD2      HIS  27  -9.972   1.581   8.467
  182    HE1  HIS  27           HE1      HIS  27 -14.133   0.757   8.409
  183    H    LEU  28           H        LEU  28 -10.123   2.448   2.825
  184    HA   LEU  28           HA       LEU  28  -7.389   1.897   2.378
  185    HB2  LEU  28           1HB      LEU  28  -9.126   1.061   0.908
  186    HB3  LEU  28           2HB      LEU  28  -9.564   2.706   0.454
  187    HG   LEU  28           HG       LEU  28  -7.139   2.854  -0.439
  188   HD11  LEU  28          1HD1      LEU  28  -6.566   0.461  -1.335
  189   HD12  LEU  28          2HD1      LEU  28  -7.465  -0.061   0.089
  190   HD13  LEU  28          3HD1      LEU  28  -6.044   0.969   0.272
  191   HD21  LEU  28          3HD2      LEU  28  -7.857   2.108  -2.588
  192   HD22  LEU  28          1HD2      LEU  28  -9.258   2.799  -1.769
  193   HD23  LEU  28          2HD2      LEU  28  -9.076   1.048  -1.878
  194    H    ALA  29           H        ALA  29  -9.343   4.728   1.430
  195    HA   ALA  29           HA       ALA  29  -7.372   6.308   0.358
  196    HB1  ALA  29           3HB      ALA  29 -10.004   6.751   1.513
  197    HB2  ALA  29           1HB      ALA  29  -8.929   8.136   1.705
  198    HB3  ALA  29           2HB      ALA  29  -9.250   7.484   0.097
  199    H    GLN  30           H        GLN  30  -8.265   6.002   3.778
  200    HA   GLN  30           HA       GLN  30  -6.359   7.911   4.693
  201    HB2  GLN  30           1HB      GLN  30  -8.384   7.313   5.973
  202    HB3  GLN  30           2HB      GLN  30  -7.738   5.697   6.222
  203    HG2  GLN  30           1HG      GLN  30  -6.159   8.072   7.092
  204    HG3  GLN  30           2HG      GLN  30  -7.506   7.499   8.075
  205   HE21  GLN  30          1HE2      GLN  30  -7.414   4.909   8.110
  206   HE22  GLN  30          2HE2      GLN  30  -5.897   4.297   8.665
  207    H    HIS  31           H        HIS  31  -6.128   4.671   3.679
  208    HA   HIS  31           HA       HIS  31  -3.708   4.132   5.206
  209    HB2  HIS  31           1HB      HIS  31  -4.939   2.178   5.075
  210    HB3  HIS  31           2HB      HIS  31  -5.505   2.520   3.442
  211    HD1  HIS  31           HD1      HIS  31  -2.139   1.767   5.072
  212    HD2  HIS  31           HD2      HIS  31  -4.317   0.911   1.638
  213    HE1  HIS  31           HE1      HIS  31  -0.701   0.193   3.738
  214    H    GLN  32           H        GLN  32  -4.561   3.879   1.749
  215    HA   GLN  32           HA       GLN  32  -2.183   3.645   0.560
  216    HB2  GLN  32           1HB      GLN  32  -4.459   5.459  -0.215
  217    HB3  GLN  32           2HB      GLN  32  -3.050   5.242  -1.244
  218    HG2  GLN  32           1HG      GLN  32  -4.751   2.959  -0.285
  219    HG3  GLN  32           2HG      GLN  32  -5.045   3.822  -1.794
  220   HE21  GLN  32          1HE2      GLN  32  -4.727   1.756  -2.810
  221   HE22  GLN  32          2HE2      GLN  32  -3.125   1.194  -3.131
  222    H    LYS  33           H        LYS  33  -3.464   6.741   1.742
  223    HA   LYS  33           HA       LYS  33  -1.657   8.561   0.975
  224    HB2  LYS  33           1HB      LYS  33  -2.165   9.834   2.872
  225    HB3  LYS  33           2HB      LYS  33  -3.568   8.790   2.683
  226    HG2  LYS  33           1HG      LYS  33  -2.584   7.265   4.383
  227    HG3  LYS  33           2HG      LYS  33  -1.303   8.453   4.637
  228    HD2  LYS  33           1HD      LYS  33  -4.235   9.088   4.924
  229    HD3  LYS  33           2HD      LYS  33  -3.220   8.559   6.268
  230    HE2  LYS  33           1HE      LYS  33  -1.680  10.528   5.399
  231    HE3  LYS  33           2HE      LYS  33  -3.212  11.126   4.765
  232    HZ1  LYS  33           3HZ      LYS  33  -3.261  10.229   7.523
  233    HZ2  LYS  33           1HZ      LYS  33  -3.979  11.585   6.811
  234    HZ3  LYS  33           2HZ      LYS  33  -2.341  11.618   7.230
  235    H    THR  34           H        THR  34  -1.129   6.279   3.647
  236    HA   THR  34           HA       THR  34   1.411   7.144   4.408
  237    HB   THR  34           HB       THR  34   1.694   5.056   5.522
  238    HG1  THR  34           HG1      THR  34   1.185   3.644   3.811
  239   HG21  THR  34          3HG2      THR  34  -1.119   4.829   5.911
  240   HG22  THR  34          1HG2      THR  34  -0.722   6.533   5.697
  241   HG23  THR  34          2HG2      THR  34   0.078   5.592   6.956
  242    H    HIS  35           H        HIS  35   0.454   4.747   1.977
  243    HA   HIS  35           HA       HIS  35   3.063   3.928   1.286
  244    HB2  HIS  35           1HB      HIS  35   0.424   3.821  -0.163
  245    HB3  HIS  35           2HB      HIS  35   1.907   3.219  -0.897
  246    HD1  HIS  35           HD1      HIS  35   2.987   2.004   1.878
  247    HD2  HIS  35           HD2      HIS  35  -0.692   1.284   0.088
  248    HE1  HIS  35           HE1      HIS  35   2.219  -0.211   2.789
  249    H    THR  36           H        THR  36   4.587   4.838   0.063
  250    HA   THR  36           HA       THR  36   4.111   7.473  -1.037
  251    HB   THR  36           HB       THR  36   6.634   5.807  -0.961
  252    HG1  THR  36           HG1      THR  36   6.943   6.699   0.941
  253   HG21  THR  36          3HG2      THR  36   6.573   8.762  -1.414
  254   HG22  THR  36          1HG2      THR  36   6.320   7.667  -2.772
  255   HG23  THR  36          2HG2      THR  36   7.817   7.588  -1.842
  256    H    GLY  37           H        GLY  37   4.896   4.236  -2.224
  257    HA2  GLY  37           1HA      GLY  37   4.162   3.402  -4.312
  258    HA3  GLY  37           2HA      GLY  37   3.970   5.055  -4.877
  259    H    GLU  38           H        GLU  38   6.141   6.304  -4.930
  260    HA   GLU  38           HA       GLU  38   7.900   4.782  -6.636
  261    HB2  GLU  38           1HB      GLU  38   7.143   7.285  -6.839
  262    HB3  GLU  38           2HB      GLU  38   8.486   7.580  -5.744
  263    HG2  GLU  38           1HG      GLU  38  10.007   6.503  -7.335
  264    HG3  GLU  38           2HG      GLU  38   8.656   6.251  -8.439
  265    H    LYS  39           H        LYS  39   9.607   3.685  -5.961
  266    HA   LYS  39           HA       LYS  39  10.518   3.812  -3.260
  267    HB2  LYS  39           1HB      LYS  39  12.082   2.090  -3.887
  268    HB3  LYS  39           2HB      LYS  39  10.529   1.737  -4.633
  269    HG2  LYS  39           1HG      LYS  39  11.334   2.623  -6.755
  270    HG3  LYS  39           2HG      LYS  39  12.888   3.007  -6.010
  271    HD2  LYS  39           1HD      LYS  39  11.764   0.219  -6.015
  272    HD3  LYS  39           2HD      LYS  39  12.735   0.840  -7.352
  273    HE2  LYS  39           1HE      LYS  39  13.716   1.009  -4.525
  274    HE3  LYS  39           2HE      LYS  39  13.904  -0.475  -5.458
  275    HZ1  LYS  39           3HZ      LYS  39  14.809   2.118  -6.540
  276    HZ2  LYS  39           1HZ      LYS  39  15.306   0.558  -6.967
  277    HZ3  LYS  39           2HZ      LYS  39  15.793   1.227  -5.492
  278    HA   PRO  40           HA       PRO  40  13.483   7.057  -3.690
  279    HB2  PRO  40           1HB      PRO  40  14.888   6.575  -1.418
  280    HB3  PRO  40           2HB      PRO  40  13.286   7.321  -1.416
  281    HG2  PRO  40           1HG      PRO  40  14.051   4.475  -0.888
  282    HG3  PRO  40           2HG      PRO  40  12.886   5.498  -0.028
  283    HD2  PRO  40           1HD      PRO  40  12.130   3.650  -1.857
  284    HD3  PRO  40           2HD      PRO  40  11.238   5.165  -1.605
  285    H    SER  41           H        SER  41  15.817   7.373  -3.842
  286    HA   SER  41           HA       SER  41  17.195   4.919  -4.716
  287    HB2  SER  41           1HB      SER  41  17.240   7.731  -5.763
  288    HB3  SER  41           2HB      SER  41  18.628   6.674  -6.023
  289    HG   SER  41           HG       SER  41  16.444   6.764  -7.444
  290    H    GLY  42           H        GLY  42  18.021   4.472  -2.634
  291    HA2  GLY  42           1HA      GLY  42  19.454   4.681  -0.838
  292    HA3  GLY  42           2HA      GLY  42  20.577   5.225  -2.075
  293    HA   PRO  43           HA       PRO  43  18.533   9.105   0.040
  294    HB2  PRO  43           1HB      PRO  43  17.601   8.638   2.546
  295    HB3  PRO  43           2HB      PRO  43  16.586   8.510   1.105
  296    HG2  PRO  43           1HG      PRO  43  17.945   6.345   2.662
  297    HG3  PRO  43           2HG      PRO  43  16.305   6.377   1.988
  298    HD2  PRO  43           1HD      PRO  43  18.351   5.078   0.780
  299    HD3  PRO  43           2HD      PRO  43  17.030   5.837  -0.132
  300    H    SER  44           H        SER  44  20.427   6.638   1.553
  301    HA   SER  44           HA       SER  44  21.885   8.655   3.121
  302    HB2  SER  44           1HB      SER  44  21.533   5.686   3.449
  303    HB3  SER  44           2HB      SER  44  22.884   6.523   4.213
  304    HG   SER  44           HG       SER  44  21.492   6.956   5.722
  305    H    SER  45           H        SER  45  22.387   5.834   1.018
  306    HA   SER  45           HA       SER  45  25.197   6.302   0.750
  307    HB2  SER  45           1HB      SER  45  24.028   4.059   0.504
  308    HB3  SER  45           2HB      SER  45  23.474   4.619  -1.074
  309    HG   SER  45           HG       SER  45  26.135   4.203  -0.201
  310    H    GLY  46           H        GLY  46  22.484   6.546  -1.560
  311    HA2  GLY  46           1HA      GLY  46  22.431   8.778  -2.745
  312    HA3  GLY  46           2HA      GLY  46  24.122   8.460  -3.102
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -16.445 -25.772 -14.990
    2    HA2  GLY   1           1HA      GLY   1 -17.066 -23.551 -15.835
    3    HA3  GLY   1           2HA      GLY   1 -18.606 -24.250 -16.311
    4    H    SER   2           H        SER   2 -16.659 -24.208 -13.321
    5    HA   SER   2           HA       SER   2 -19.060 -23.250 -11.906
    6    HB2  SER   2           1HB      SER   2 -16.964 -25.138 -10.806
    7    HB3  SER   2           2HB      SER   2 -18.414 -24.583  -9.970
    8    HG   SER   2           HG       SER   2 -19.233 -26.338 -10.807
    9    H    SER   3           H        SER   3 -18.715 -21.203 -11.360
   10    HA   SER   3           HA       SER   3 -16.250 -19.919 -11.203
   11    HB2  SER   3           1HB      SER   3 -18.937 -19.246 -10.005
   12    HB3  SER   3           2HB      SER   3 -17.541 -18.180  -9.847
   13    HG   SER   3           HG       SER   3 -17.844 -17.553 -11.823
   14    H    GLY   4           H        GLY   4 -18.333 -20.956  -8.493
   15    HA2  GLY   4           1HA      GLY   4 -16.714 -22.264  -6.862
   16    HA3  GLY   4           2HA      GLY   4 -16.078 -20.638  -6.663
   17    H    SER   5           H        SER   5 -17.205 -19.142  -5.468
   18    HA   SER   5           HA       SER   5 -19.892 -19.538  -4.609
   19    HB2  SER   5           1HB      SER   5 -19.593 -20.125  -2.341
   20    HB3  SER   5           2HB      SER   5 -18.528 -21.218  -3.224
   21    HG   SER   5           HG       SER   5 -17.652 -20.061  -1.304
   22    H    SER   6           H        SER   6 -20.756 -17.683  -3.800
   23    HA   SER   6           HA       SER   6 -18.917 -15.500  -3.103
   24    HB2  SER   6           1HB      SER   6 -21.315 -15.234  -4.933
   25    HB3  SER   6           2HB      SER   6 -20.272 -13.916  -4.400
   26    HG   SER   6           HG       SER   6 -18.528 -15.234  -5.404
   27    H    GLY   7           H        GLY   7 -19.885 -13.800  -1.820
   28    HA2  GLY   7           1HA      GLY   7 -22.253 -13.310  -0.814
   29    HA3  GLY   7           2HA      GLY   7 -21.974 -14.877  -0.068
   30    H    THR   8           H        THR   8 -20.698 -11.592  -0.341
   31    HA   THR   8           HA       THR   8 -19.456 -10.310   1.074
   32    HB   THR   8           HB       THR   8 -20.456 -12.000   3.352
   33    HG1  THR   8           HG1      THR   8 -21.953 -10.722   1.486
   34   HG21  THR   8          3HG2      THR   8 -18.879 -10.081   3.729
   35   HG22  THR   8          1HG2      THR   8 -20.418  -9.949   4.579
   36   HG23  THR   8          2HG2      THR   8 -20.138  -9.011   3.112
   37    H    GLY   9           H        GLY   9 -18.002 -12.350  -0.094
   38    HA2  GLY   9           1HA      GLY   9 -16.420 -13.604   2.017
   39    HA3  GLY   9           2HA      GLY   9 -16.276 -13.903   0.291
   40    H    GLU  10           H        GLU  10 -15.483 -11.934  -0.987
   41    HA   GLU  10           HA       GLU  10 -13.183 -10.824   0.464
   42    HB2  GLU  10           1HB      GLU  10 -13.611 -11.079  -2.518
   43    HB3  GLU  10           2HB      GLU  10 -12.145 -10.516  -1.727
   44    HG2  GLU  10           1HG      GLU  10 -11.948 -12.745  -0.644
   45    HG3  GLU  10           2HG      GLU  10 -13.319 -13.282  -1.613
   46    H    LYS  11           H        LYS  11 -12.622  -8.632   0.241
   47    HA   LYS  11           HA       LYS  11 -14.910  -6.887  -0.154
   48    HB2  LYS  11           1HB      LYS  11 -12.225  -6.627   1.118
   49    HB3  LYS  11           2HB      LYS  11 -13.024  -5.162   0.561
   50    HG2  LYS  11           1HG      LYS  11 -13.726  -5.276   2.742
   51    HG3  LYS  11           2HG      LYS  11 -15.053  -6.083   1.903
   52    HD2  LYS  11           1HD      LYS  11 -12.777  -7.749   2.844
   53    HD3  LYS  11           2HD      LYS  11 -13.908  -7.133   4.051
   54    HE2  LYS  11           1HE      LYS  11 -14.926  -8.477   1.580
   55    HE3  LYS  11           2HE      LYS  11 -14.339  -9.443   2.933
   56    HZ1  LYS  11           3HZ      LYS  11 -16.672  -9.154   3.182
   57    HZ2  LYS  11           1HZ      LYS  11 -16.562  -7.479   2.969
   58    HZ3  LYS  11           2HZ      LYS  11 -15.923  -8.199   4.360
   59    HA   PRO  12           HA       PRO  12 -13.783  -5.565  -4.199
   60    HB2  PRO  12           1HB      PRO  12 -15.026  -3.152  -4.225
   61    HB3  PRO  12           2HB      PRO  12 -15.901  -4.684  -4.338
   62    HG2  PRO  12           1HG      PRO  12 -15.465  -2.922  -1.957
   63    HG3  PRO  12           2HG      PRO  12 -16.940  -3.760  -2.474
   64    HD2  PRO  12           1HD      PRO  12 -15.340  -4.708  -0.506
   65    HD3  PRO  12           2HD      PRO  12 -16.256  -5.776  -1.589
   66    H    TYR  13           H        TYR  13 -12.983  -3.730  -1.365
   67    HA   TYR  13           HA       TYR  13 -11.130  -2.041  -2.885
   68    HB2  TYR  13           1HB      TYR  13 -11.684  -1.802   0.064
   69    HB3  TYR  13           2HB      TYR  13 -11.082  -0.573  -1.043
   70    HD1  TYR  13           HD1      TYR  13 -12.717   0.164  -2.931
   71    HD2  TYR  13           HD2      TYR  13 -13.939  -1.842   0.617
   72    HE1  TYR  13           HE1      TYR  13 -15.008   1.000  -3.254
   73    HE2  TYR  13           HE2      TYR  13 -16.233  -1.013   0.302
   74    HH   TYR  13           HH       TYR  13 -17.452   0.651  -0.817
   75    H    GLU  14           H        GLU  14  -9.145  -2.810  -3.128
   76    HA   GLU  14           HA       GLU  14  -7.775  -3.963  -0.820
   77    HB2  GLU  14           1HB      GLU  14  -8.768  -5.805  -2.267
   78    HB3  GLU  14           2HB      GLU  14  -7.642  -5.301  -3.519
   79    HG2  GLU  14           1HG      GLU  14  -5.885  -5.605  -1.579
   80    HG3  GLU  14           2HG      GLU  14  -7.126  -6.683  -0.944
   81    H    CYS  15           H        CYS  15  -5.587  -3.584  -0.768
   82    HA   CYS  15           HA       CYS  15  -4.630  -1.519  -2.551
   83    HB2  CYS  15           1HB      CYS  15  -4.237  -1.574  -0.039
   84    HB3  CYS  15           2HB      CYS  15  -3.084  -2.870  -0.339
   85    H    LYS  16           H        LYS  16  -2.391  -1.674  -3.449
   86    HA   LYS  16           HA       LYS  16  -2.000  -4.336  -4.637
   87    HB2  LYS  16           1HB      LYS  16  -1.070  -3.290  -6.537
   88    HB3  LYS  16           2HB      LYS  16  -2.473  -2.317  -6.116
   89    HG2  LYS  16           1HG      LYS  16  -1.220  -0.524  -5.495
   90    HG3  LYS  16           2HG      LYS  16   0.147  -1.515  -4.982
   91    HD2  LYS  16           1HD      LYS  16   1.030  -0.639  -6.893
   92    HD3  LYS  16           2HD      LYS  16   0.238  -2.060  -7.579
   93    HE2  LYS  16           1HE      LYS  16  -1.234   0.536  -7.355
   94    HE3  LYS  16           2HE      LYS  16  -0.111   0.263  -8.686
   95    HZ1  LYS  16           3HZ      LYS  16  -1.563  -1.989  -8.726
   96    HZ2  LYS  16           1HZ      LYS  16  -1.898  -0.626  -9.671
   97    HZ3  LYS  16           2HZ      LYS  16  -2.728  -0.872  -8.218
   98    H    VAL  17           H        VAL  17  -0.470  -1.804  -2.802
   99    HA   VAL  17           HA       VAL  17   2.196  -2.819  -3.048
  100    HB   VAL  17           HB       VAL  17   1.018  -0.900  -1.033
  101   HG11  VAL  17          1HG1      VAL  17   3.030  -1.966  -0.165
  102   HG12  VAL  17          2HG1      VAL  17   3.904  -1.540  -1.638
  103   HG13  VAL  17          3HG1      VAL  17   3.334  -0.272  -0.551
  104   HG21  VAL  17          3HG2      VAL  17   1.206   0.690  -2.578
  105   HG22  VAL  17          1HG2      VAL  17   2.871   0.224  -2.927
  106   HG23  VAL  17          2HG2      VAL  17   1.539  -0.574  -3.762
  107    H    CYS  18           H        CYS  18   0.168  -2.520  -0.129
  108    HA   CYS  18           HA       CYS  18   1.609  -4.695   1.124
  109    HB2  CYS  18           1HB      CYS  18   0.293  -4.166   3.105
  110    HB3  CYS  18           2HB      CYS  18   0.972  -2.693   2.420
  111    H    SER  19           H        SER  19  -1.182  -4.329  -0.772
  112    HA   SER  19           HA       SER  19  -2.805  -5.770  -1.453
  113    HB2  SER  19           1HB      SER  19  -0.802  -7.691  -0.287
  114    HB3  SER  19           2HB      SER  19  -2.343  -8.264  -0.926
  115    HG   SER  19           HG       SER  19  -1.561  -8.043  -2.853
  116    H    LYS  20           H        LYS  20  -3.436  -4.374   0.767
  117    HA   LYS  20           HA       LYS  20  -4.666  -6.317   2.601
  118    HB2  LYS  20           1HB      LYS  20  -3.118  -4.414   3.429
  119    HB3  LYS  20           2HB      LYS  20  -4.487  -3.359   3.107
  120    HG2  LYS  20           1HG      LYS  20  -5.857  -4.767   4.625
  121    HG3  LYS  20           2HG      LYS  20  -4.399  -5.678   5.023
  122    HD2  LYS  20           1HD      LYS  20  -3.346  -3.647   5.867
  123    HD3  LYS  20           2HD      LYS  20  -4.779  -2.711   5.433
  124    HE2  LYS  20           1HE      LYS  20  -5.180  -3.089   7.658
  125    HE3  LYS  20           2HE      LYS  20  -5.998  -4.478   6.943
  126    HZ1  LYS  20           3HZ      LYS  20  -3.185  -4.630   7.837
  127    HZ2  LYS  20           1HZ      LYS  20  -4.267  -5.897   7.547
  128    HZ3  LYS  20           2HZ      LYS  20  -4.468  -4.907   8.903
  129    H    ALA  21           H        ALA  21  -6.824  -6.504   2.731
  130    HA   ALA  21           HA       ALA  21  -8.436  -4.922   0.886
  131    HB1  ALA  21           3HB      ALA  21  -8.644  -7.577   2.112
  132    HB2  ALA  21           1HB      ALA  21 -10.169  -6.699   1.995
  133    HB3  ALA  21           2HB      ALA  21  -9.210  -7.000   0.545
  134    H    PHE  22           H        PHE  22 -10.221  -3.711   1.490
  135    HA   PHE  22           HA       PHE  22 -10.552  -3.235   4.377
  136    HB2  PHE  22           1HB      PHE  22 -10.674  -1.107   2.231
  137    HB3  PHE  22           2HB      PHE  22 -10.819  -0.860   3.968
  138    HD1  PHE  22           HD1      PHE  22  -8.493  -1.843   1.275
  139    HD2  PHE  22           HD2      PHE  22  -8.913  -0.623   5.331
  140    HE1  PHE  22           HE1      PHE  22  -6.059  -1.513   1.424
  141    HE2  PHE  22           HE2      PHE  22  -6.480  -0.290   5.487
  142    HZ   PHE  22           HZ       PHE  22  -5.050  -0.734   3.532
  143    H    THR  23           H        THR  23 -12.645  -2.501   5.034
  144    HA   THR  23           HA       THR  23 -14.761  -3.684   3.457
  145    HB   THR  23           HB       THR  23 -14.821  -4.092   5.831
  146    HG1  THR  23           HG1      THR  23 -16.949  -2.982   6.261
  147   HG21  THR  23          3HG2      THR  23 -15.535  -1.486   6.810
  148   HG22  THR  23          1HG2      THR  23 -13.951  -1.428   6.038
  149   HG23  THR  23          2HG2      THR  23 -14.250  -2.566   7.352
  150    H    GLN  24           H        GLN  24 -13.573  -0.507   4.226
  151    HA   GLN  24           HA       GLN  24 -15.753   0.650   2.620
  152    HB2  GLN  24           1HB      GLN  24 -14.412   1.799   5.069
  153    HB3  GLN  24           2HB      GLN  24 -15.441   2.737   3.995
  154    HG2  GLN  24           1HG      GLN  24 -16.292   0.295   5.536
  155    HG3  GLN  24           2HG      GLN  24 -16.631   1.965   5.986
  156   HE21  GLN  24          1HE2      GLN  24 -18.313   3.002   5.073
  157   HE22  GLN  24          2HE2      GLN  24 -19.371   2.303   3.900
  158    H    LYS  25           H        LYS  25 -15.114   2.870   1.748
  159    HA   LYS  25           HA       LYS  25 -12.662   2.552   0.280
  160    HB2  LYS  25           1HB      LYS  25 -14.585   4.885   0.301
  161    HB3  LYS  25           2HB      LYS  25 -13.335   4.575  -0.897
  162    HG2  LYS  25           1HG      LYS  25 -14.506   2.850  -1.872
  163    HG3  LYS  25           2HG      LYS  25 -15.453   2.530  -0.417
  164    HD2  LYS  25           1HD      LYS  25 -16.355   4.962  -0.874
  165    HD3  LYS  25           2HD      LYS  25 -15.837   4.605  -2.524
  166    HE2  LYS  25           1HE      LYS  25 -17.351   2.867  -2.758
  167    HE3  LYS  25           2HE      LYS  25 -17.511   2.637  -1.017
  168    HZ1  LYS  25           3HZ      LYS  25 -19.489   3.653  -1.886
  169    HZ2  LYS  25           1HZ      LYS  25 -18.598   4.900  -2.603
  170    HZ3  LYS  25           2HZ      LYS  25 -18.680   4.780  -0.918
  171    H    ALA  26           H        ALA  26 -13.922   5.022   2.519
  172    HA   ALA  26           HA       ALA  26 -11.848   6.756   2.685
  173    HB1  ALA  26           3HB      ALA  26 -13.844   5.790   4.638
  174    HB2  ALA  26           1HB      ALA  26 -12.463   6.673   5.289
  175    HB3  ALA  26           2HB      ALA  26 -13.501   7.426   4.077
  176    H    HIS  27           H        HIS  27 -12.059   3.634   4.358
  177    HA   HIS  27           HA       HIS  27  -9.714   3.801   5.851
  178    HB2  HIS  27           1HB      HIS  27 -11.344   1.543   4.768
  179    HB3  HIS  27           2HB      HIS  27  -9.764   1.186   5.457
  180    HD1  HIS  27           HD1      HIS  27 -11.002  -0.127   7.364
  181    HD2  HIS  27           HD2      HIS  27 -11.779   3.953   7.251
  182    HE1  HIS  27           HE1      HIS  27 -12.068   0.416   9.577
  183    H    LEU  28           H        LEU  28 -10.182   2.347   2.630
  184    HA   LEU  28           HA       LEU  28  -7.475   1.717   2.200
  185    HB2  LEU  28           1HB      LEU  28  -9.058   0.626   0.851
  186    HB3  LEU  28           2HB      LEU  28  -9.808   2.144   0.361
  187    HG   LEU  28           HG       LEU  28  -7.489   2.579  -0.774
  188   HD11  LEU  28          1HD1      LEU  28  -7.390  -0.281  -0.047
  189   HD12  LEU  28          2HD1      LEU  28  -6.084   0.877  -0.294
  190   HD13  LEU  28          3HD1      LEU  28  -6.880   0.138  -1.683
  191   HD21  LEU  28          3HD2      LEU  28  -9.071   2.516  -2.363
  192   HD22  LEU  28          1HD2      LEU  28  -9.895   1.138  -1.631
  193   HD23  LEU  28          2HD2      LEU  28  -8.479   0.879  -2.651
  194    H    ALA  29           H        ALA  29  -9.409   4.433   0.932
  195    HA   ALA  29           HA       ALA  29  -7.438   5.789  -0.430
  196    HB1  ALA  29           3HB      ALA  29 -10.047   6.413   0.640
  197    HB2  ALA  29           1HB      ALA  29  -8.963   7.802   0.736
  198    HB3  ALA  29           2HB      ALA  29  -9.253   7.014  -0.816
  199    H    GLN  30           H        GLN  30  -8.303   6.120   3.006
  200    HA   GLN  30           HA       GLN  30  -6.312   8.059   3.576
  201    HB2  GLN  30           1HB      GLN  30  -8.151   6.350   5.175
  202    HB3  GLN  30           2HB      GLN  30  -6.767   7.054   6.001
  203    HG2  GLN  30           1HG      GLN  30  -7.476   9.275   5.381
  204    HG3  GLN  30           2HG      GLN  30  -8.809   8.614   4.435
  205   HE21  GLN  30          1HE2      GLN  30  -8.203  10.170   7.160
  206   HE22  GLN  30          2HE2      GLN  30  -9.448   9.548   8.183
  207    H    HIS  31           H        HIS  31  -6.419   4.543   3.784
  208    HA   HIS  31           HA       HIS  31  -4.140   4.017   5.238
  209    HB2  HIS  31           1HB      HIS  31  -5.289   2.093   4.718
  210    HB3  HIS  31           2HB      HIS  31  -5.575   2.585   3.052
  211    HD1  HIS  31           HD1      HIS  31  -2.748   1.303   5.232
  212    HD2  HIS  31           HD2      HIS  31  -3.888   1.456   1.240
  213    HE1  HIS  31           HE1      HIS  31  -1.056  -0.087   3.996
  214    H    GLN  32           H        GLN  32  -4.371   4.510   1.720
  215    HA   GLN  32           HA       GLN  32  -1.863   4.113   0.851
  216    HB2  GLN  32           1HB      GLN  32  -3.732   6.383   0.204
  217    HB3  GLN  32           2HB      GLN  32  -2.197   6.180  -0.631
  218    HG2  GLN  32           1HG      GLN  32  -2.907   3.934  -1.340
  219    HG3  GLN  32           2HG      GLN  32  -4.465   4.203  -0.559
  220   HE21  GLN  32          1HE2      GLN  32  -5.790   5.943  -1.366
  221   HE22  GLN  32          2HE2      GLN  32  -5.684   6.396  -3.029
  222    H    LYS  33           H        LYS  33  -2.931   7.063   2.520
  223    HA   LYS  33           HA       LYS  33  -0.807   8.688   2.462
  224    HB2  LYS  33           1HB      LYS  33  -2.475   7.910   4.849
  225    HB3  LYS  33           2HB      LYS  33  -1.268   9.187   4.930
  226    HG2  LYS  33           1HG      LYS  33  -2.465  10.594   3.556
  227    HG3  LYS  33           2HG      LYS  33  -3.358   9.270   2.803
  228    HD2  LYS  33           1HD      LYS  33  -4.964  10.227   4.166
  229    HD3  LYS  33           2HD      LYS  33  -4.341   8.929   5.188
  230    HE2  LYS  33           1HE      LYS  33  -4.455  10.824   6.579
  231    HE3  LYS  33           2HE      LYS  33  -2.752  10.655   6.156
  232    HZ1  LYS  33           3HZ      LYS  33  -3.245  12.304   4.322
  233    HZ2  LYS  33           1HZ      LYS  33  -3.242  12.914   5.900
  234    HZ3  LYS  33           2HZ      LYS  33  -4.708  12.613   5.113
  235    H    THR  34           H        THR  34  -1.020   5.801   4.512
  236    HA   THR  34           HA       THR  34   1.385   6.048   5.876
  237    HB   THR  34           HB       THR  34   1.330   3.612   6.175
  238    HG1  THR  34           HG1      THR  34   0.035   2.342   4.966
  239   HG21  THR  34          3HG2      THR  34  -1.278   5.095   6.405
  240   HG22  THR  34          1HG2      THR  34  -0.087   4.771   7.664
  241   HG23  THR  34          2HG2      THR  34  -1.071   3.456   7.022
  242    H    HIS  35           H        HIS  35   0.759   4.366   2.799
  243    HA   HIS  35           HA       HIS  35   3.365   3.494   2.318
  244    HB2  HIS  35           1HB      HIS  35   1.071   4.154   0.483
  245    HB3  HIS  35           2HB      HIS  35   2.618   3.595  -0.146
  246    HD1  HIS  35           HD1      HIS  35   3.311   1.348   1.740
  247    HD2  HIS  35           HD2      HIS  35  -0.535   1.985   0.303
  248    HE1  HIS  35           HE1      HIS  35   2.144  -0.871   1.936
  249    H    THR  36           H        THR  36   4.878   5.071   2.804
  250    HA   THR  36           HA       THR  36   5.094   7.220   0.810
  251    HB   THR  36           HB       THR  36   6.046   8.697   2.611
  252    HG1  THR  36           HG1      THR  36   6.070   6.616   4.057
  253   HG21  THR  36          3HG2      THR  36   3.917   9.347   1.989
  254   HG22  THR  36          1HG2      THR  36   3.698   9.039   3.711
  255   HG23  THR  36          2HG2      THR  36   3.184   7.836   2.528
  256    H    GLY  37           H        GLY  37   6.385   4.738   0.684
  257    HA2  GLY  37           1HA      GLY  37   8.889   4.510   1.821
  258    HA3  GLY  37           2HA      GLY  37   8.479   3.916   0.219
  259    H    GLU  38           H        GLU  38   8.008   6.297  -1.118
  260    HA   GLU  38           HA       GLU  38  10.591   7.061  -1.867
  261    HB2  GLU  38           1HB      GLU  38   8.590   7.291  -3.305
  262    HB3  GLU  38           2HB      GLU  38   8.019   8.597  -2.276
  263    HG2  GLU  38           1HG      GLU  38   9.073   9.412  -4.329
  264    HG3  GLU  38           2HG      GLU  38   9.912   9.961  -2.879
  265    H    LYS  39           H        LYS  39   8.188   8.821   0.082
  266    HA   LYS  39           HA       LYS  39   8.446  10.356   1.750
  267    HB2  LYS  39           1HB      LYS  39  10.489   8.820   2.262
  268    HB3  LYS  39           2HB      LYS  39  11.433  10.131   1.568
  269    HG2  LYS  39           1HG      LYS  39  11.493  10.707   3.771
  270    HG3  LYS  39           2HG      LYS  39  10.053  11.590   3.260
  271    HD2  LYS  39           1HD      LYS  39   8.609  10.049   4.253
  272    HD3  LYS  39           2HD      LYS  39   9.850   8.797   4.332
  273    HE2  LYS  39           1HE      LYS  39   9.460   9.664   6.544
  274    HE3  LYS  39           2HE      LYS  39  11.061  10.165   6.002
  275    HZ1  LYS  39           3HZ      LYS  39   8.731  11.936   5.638
  276    HZ2  LYS  39           1HZ      LYS  39  10.372  12.340   5.711
  277    HZ3  LYS  39           2HZ      LYS  39   9.549  11.887   7.118
  278    HA   PRO  40           HA       PRO  40   9.775  13.247  -1.743
  279    HB2  PRO  40           1HB      PRO  40   7.287  14.104  -2.410
  280    HB3  PRO  40           2HB      PRO  40   8.049  12.693  -3.155
  281    HG2  PRO  40           1HG      PRO  40   6.031  12.811  -0.947
  282    HG3  PRO  40           2HG      PRO  40   6.100  11.719  -2.343
  283    HD2  PRO  40           1HD      PRO  40   6.921  10.978   0.129
  284    HD3  PRO  40           2HD      PRO  40   7.669  10.351  -1.354
  285    H    SER  41           H        SER  41   7.984  13.329   1.165
  286    HA   SER  41           HA       SER  41   7.685  16.204   1.249
  287    HB2  SER  41           1HB      SER  41   5.980  14.894   2.340
  288    HB3  SER  41           2HB      SER  41   7.184  14.048   3.311
  289    HG   SER  41           HG       SER  41   6.050  16.525   3.674
  290    H    GLY  42           H        GLY  42   9.392  13.858   3.336
  291    HA2  GLY  42           1HA      GLY  42  11.227  14.136   4.701
  292    HA3  GLY  42           2HA      GLY  42  11.902  14.951   3.298
  293    HA   PRO  43           HA       PRO  43   9.939  18.452   5.988
  294    HB2  PRO  43           1HB      PRO  43   8.954  17.734   8.414
  295    HB3  PRO  43           2HB      PRO  43   7.972  17.747   6.944
  296    HG2  PRO  43           1HG      PRO  43   9.309  15.442   8.309
  297    HG3  PRO  43           2HG      PRO  43   7.684  15.536   7.604
  298    HD2  PRO  43           1HD      PRO  43   9.763  14.370   6.320
  299    HD3  PRO  43           2HD      PRO  43   8.459  15.211   5.458
  300    H    SER  44           H        SER  44  11.397  15.807   7.856
  301    HA   SER  44           HA       SER  44  13.591  17.549   8.611
  302    HB2  SER  44           1HB      SER  44  11.657  17.656  10.369
  303    HB3  SER  44           2HB      SER  44  12.244  16.062  10.844
  304    HG   SER  44           HG       SER  44  14.331  17.051  11.105
  305    H    SER  45           H        SER  45  15.474  16.452   9.088
  306    HA   SER  45           HA       SER  45  15.446  13.612   8.399
  307    HB2  SER  45           1HB      SER  45  17.854  13.850   8.074
  308    HB3  SER  45           2HB      SER  45  17.002  15.120   7.195
  309    HG   SER  45           HG       SER  45  18.370  15.340   9.668
  310    H    GLY  46           H        GLY  46  14.400  14.176  10.911
  311    HA2  GLY  46           1HA      GLY  46  15.576  12.361  12.571
  312    HA3  GLY  46           2HA      GLY  46  16.420  13.859  12.935
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1 -15.984 -32.243 -13.192
    2    HA2  GLY   1           1HA      GLY   1 -15.066 -32.036 -10.391
    3    HA3  GLY   1           2HA      GLY   1 -14.437 -30.996 -11.660
    4    H    SER   2           H        SER   2 -17.239 -31.756  -9.695
    5    HA   SER   2           HA       SER   2 -18.994 -29.819 -10.728
    6    HB2  SER   2           1HB      SER   2 -18.811 -31.139  -8.018
    7    HB3  SER   2           2HB      SER   2 -20.100 -30.013  -8.441
    8    HG   SER   2           HG       SER   2 -19.534 -32.550  -9.537
    9    H    SER   3           H        SER   3 -17.084 -29.682  -7.715
   10    HA   SER   3           HA       SER   3 -17.575 -27.074  -7.011
   11    HB2  SER   3           1HB      SER   3 -16.211 -28.855  -5.762
   12    HB3  SER   3           2HB      SER   3 -14.835 -28.298  -6.714
   13    HG   SER   3           HG       SER   3 -14.677 -26.924  -5.113
   14    H    GLY   4           H        GLY   4 -16.607 -25.080  -7.408
   15    HA2  GLY   4           1HA      GLY   4 -14.479 -24.838  -9.347
   16    HA3  GLY   4           2HA      GLY   4 -16.047 -24.311  -9.942
   17    H    SER   5           H        SER   5 -13.932 -23.881  -7.106
   18    HA   SER   5           HA       SER   5 -14.329 -20.994  -7.319
   19    HB2  SER   5           1HB      SER   5 -14.961 -20.710  -5.031
   20    HB3  SER   5           2HB      SER   5 -16.023 -21.952  -5.695
   21    HG   SER   5           HG       SER   5 -14.675 -22.198  -3.551
   22    H    SER   6           H        SER   6 -12.418 -20.034  -7.255
   23    HA   SER   6           HA       SER   6 -10.300 -21.182  -5.570
   24    HB2  SER   6           1HB      SER   6 -10.061 -21.739  -8.065
   25    HB3  SER   6           2HB      SER   6  -9.720 -20.024  -8.294
   26    HG   SER   6           HG       SER   6  -8.310 -21.491  -6.354
   27    H    GLY   7           H        GLY   7 -10.163 -19.669  -4.016
   28    HA2  GLY   7           1HA      GLY   7  -9.932 -17.615  -3.004
   29    HA3  GLY   7           2HA      GLY   7  -8.842 -17.286  -4.342
   30    H    THR   8           H        THR   8 -12.000 -16.772  -3.019
   31    HA   THR   8           HA       THR   8 -12.503 -14.770  -5.121
   32    HB   THR   8           HB       THR   8 -14.937 -15.219  -4.880
   33    HG1  THR   8           HG1      THR   8 -14.468 -16.378  -2.748
   34   HG21  THR   8          3HG2      THR   8 -14.179 -16.241  -6.786
   35   HG22  THR   8          1HG2      THR   8 -14.728 -17.657  -5.891
   36   HG23  THR   8          2HG2      THR   8 -13.014 -17.241  -5.919
   37    H    GLY   9           H        GLY   9 -12.972 -12.773  -4.415
   38    HA2  GLY   9           1HA      GLY   9 -13.844 -12.443  -1.622
   39    HA3  GLY   9           2HA      GLY   9 -12.457 -11.541  -2.215
   40    H    GLU  10           H        GLU  10 -15.176 -10.725  -1.210
   41    HA   GLU  10           HA       GLU  10 -16.163  -9.305  -3.584
   42    HB2  GLU  10           1HB      GLU  10 -17.423 -10.026  -0.953
   43    HB3  GLU  10           2HB      GLU  10 -18.105  -8.760  -1.963
   44    HG2  GLU  10           1HG      GLU  10 -18.413 -10.332  -3.778
   45    HG3  GLU  10           2HG      GLU  10 -17.653 -11.607  -2.827
   46    H    LYS  11           H        LYS  11 -13.751  -8.480  -2.299
   47    HA   LYS  11           HA       LYS  11 -14.496  -6.059  -0.839
   48    HB2  LYS  11           1HB      LYS  11 -12.009  -7.661  -1.140
   49    HB3  LYS  11           2HB      LYS  11 -11.826  -5.935  -0.856
   50    HG2  LYS  11           1HG      LYS  11 -11.780  -6.780   1.280
   51    HG3  LYS  11           2HG      LYS  11 -13.481  -6.345   1.102
   52    HD2  LYS  11           1HD      LYS  11 -12.648  -9.089   0.316
   53    HD3  LYS  11           2HD      LYS  11 -12.730  -8.709   2.038
   54    HE2  LYS  11           1HE      LYS  11 -15.021  -7.921   0.314
   55    HE3  LYS  11           2HE      LYS  11 -14.825  -9.629   0.704
   56    HZ1  LYS  11           3HZ      LYS  11 -14.968  -7.441   2.706
   57    HZ2  LYS  11           1HZ      LYS  11 -14.881  -9.098   3.036
   58    HZ3  LYS  11           2HZ      LYS  11 -16.256  -8.456   2.289
   59    HA   PRO  12           HA       PRO  12 -14.174  -4.013  -4.846
   60    HB2  PRO  12           1HB      PRO  12 -15.322  -1.702  -4.002
   61    HB3  PRO  12           2HB      PRO  12 -16.258  -3.136  -4.442
   62    HG2  PRO  12           1HG      PRO  12 -15.463  -2.152  -1.729
   63    HG3  PRO  12           2HG      PRO  12 -17.021  -2.805  -2.271
   64    HD2  PRO  12           1HD      PRO  12 -15.221  -4.285  -0.893
   65    HD3  PRO  12           2HD      PRO  12 -16.304  -4.989  -2.111
   66    H    TYR  13           H        TYR  13 -12.645  -3.474  -1.896
   67    HA   TYR  13           HA       TYR  13 -10.841  -1.520  -3.145
   68    HB2  TYR  13           1HB      TYR  13 -11.703  -1.392  -0.251
   69    HB3  TYR  13           2HB      TYR  13 -10.677  -0.245  -1.105
   70    HD1  TYR  13           HD1      TYR  13 -11.673   1.214  -2.871
   71    HD2  TYR  13           HD2      TYR  13 -14.071  -1.237  -0.352
   72    HE1  TYR  13           HE1      TYR  13 -13.652   2.545  -3.470
   73    HE2  TYR  13           HE2      TYR  13 -16.057   0.086  -0.945
   74    HH   TYR  13           HH       TYR  13 -15.817   3.038  -2.781
   75    H    GLU  14           H        GLU  14  -8.963  -2.535  -3.363
   76    HA   GLU  14           HA       GLU  14  -7.847  -3.931  -1.042
   77    HB2  GLU  14           1HB      GLU  14  -8.685  -5.750  -2.319
   78    HB3  GLU  14           2HB      GLU  14  -8.112  -5.051  -3.827
   79    HG2  GLU  14           1HG      GLU  14  -6.106  -5.706  -1.740
   80    HG3  GLU  14           2HG      GLU  14  -6.847  -7.032  -2.635
   81    H    CYS  15           H        CYS  15  -5.692  -3.641  -0.750
   82    HA   CYS  15           HA       CYS  15  -4.409  -1.631  -2.386
   83    HB2  CYS  15           1HB      CYS  15  -4.270  -1.691   0.130
   84    HB3  CYS  15           2HB      CYS  15  -3.254  -3.120  -0.025
   85    H    LYS  16           H        LYS  16  -2.151  -1.920  -3.118
   86    HA   LYS  16           HA       LYS  16  -1.736  -4.650  -4.147
   87    HB2  LYS  16           1HB      LYS  16  -1.008  -1.975  -5.347
   88    HB3  LYS  16           2HB      LYS  16  -0.435  -3.512  -5.981
   89    HG2  LYS  16           1HG      LYS  16  -3.337  -2.757  -5.717
   90    HG3  LYS  16           2HG      LYS  16  -2.384  -2.590  -7.194
   91    HD2  LYS  16           1HD      LYS  16  -1.900  -5.058  -7.025
   92    HD3  LYS  16           2HD      LYS  16  -3.102  -5.127  -5.734
   93    HE2  LYS  16           1HE      LYS  16  -4.813  -4.315  -7.251
   94    HE3  LYS  16           2HE      LYS  16  -3.620  -4.138  -8.537
   95    HZ1  LYS  16           3HZ      LYS  16  -5.007  -6.488  -7.641
   96    HZ2  LYS  16           1HZ      LYS  16  -3.338  -6.723  -7.781
   97    HZ3  LYS  16           2HZ      LYS  16  -4.231  -6.187  -9.114
   98    H    VAL  17           H        VAL  17  -0.394  -2.053  -2.333
   99    HA   VAL  17           HA       VAL  17   2.346  -2.863  -2.530
  100    HB   VAL  17           HB       VAL  17   0.987  -1.077  -0.507
  101   HG11  VAL  17          1HG1      VAL  17   3.685  -2.132  -0.664
  102   HG12  VAL  17          2HG1      VAL  17   3.656  -0.368  -0.671
  103   HG13  VAL  17          3HG1      VAL  17   2.888  -1.259   0.644
  104   HG21  VAL  17          3HG2      VAL  17   2.781   0.198  -2.381
  105   HG22  VAL  17          1HG2      VAL  17   1.476  -0.650  -3.212
  106   HG23  VAL  17          2HG2      VAL  17   1.101   0.574  -1.998
  107    H    CYS  18           H        CYS  18  -0.113  -3.104   0.038
  108    HA   CYS  18           HA       CYS  18   1.486  -5.270   1.238
  109    HB2  CYS  18           1HB      CYS  18   0.363  -4.700   3.377
  110    HB3  CYS  18           2HB      CYS  18   1.325  -3.371   2.738
  111    H    SER  19           H        SER  19  -0.862  -5.061  -0.816
  112    HA   SER  19           HA       SER  19  -2.769  -6.203  -1.341
  113    HB2  SER  19           1HB      SER  19  -0.930  -7.994  -1.146
  114    HB3  SER  19           2HB      SER  19  -1.687  -8.421   0.388
  115    HG   SER  19           HG       SER  19  -3.509  -9.024  -0.669
  116    H    LYS  20           H        LYS  20  -2.751  -4.627   1.189
  117    HA   LYS  20           HA       LYS  20  -4.455  -6.071   3.011
  118    HB2  LYS  20           1HB      LYS  20  -2.855  -4.383   3.821
  119    HB3  LYS  20           2HB      LYS  20  -3.720  -3.138   2.929
  120    HG2  LYS  20           1HG      LYS  20  -5.603  -3.295   4.334
  121    HG3  LYS  20           2HG      LYS  20  -5.038  -4.806   5.050
  122    HD2  LYS  20           1HD      LYS  20  -3.301  -2.406   5.297
  123    HD3  LYS  20           2HD      LYS  20  -4.759  -2.480   6.289
  124    HE2  LYS  20           1HE      LYS  20  -3.259  -3.501   7.686
  125    HE3  LYS  20           2HE      LYS  20  -3.882  -4.902   6.815
  126    HZ1  LYS  20           3HZ      LYS  20  -1.807  -5.349   6.234
  127    HZ2  LYS  20           1HZ      LYS  20  -1.236  -3.913   6.923
  128    HZ3  LYS  20           2HZ      LYS  20  -1.770  -3.928   5.318
  129    H    ALA  21           H        ALA  21  -6.544  -6.382   2.660
  130    HA   ALA  21           HA       ALA  21  -7.993  -4.611   0.847
  131    HB1  ALA  21           3HB      ALA  21  -9.814  -6.367   1.151
  132    HB2  ALA  21           1HB      ALA  21  -8.344  -6.869   0.315
  133    HB3  ALA  21           2HB      ALA  21  -8.596  -7.316   2.003
  134    H    PHE  22           H        PHE  22  -9.978  -3.632   1.403
  135    HA   PHE  22           HA       PHE  22 -10.540  -3.447   4.283
  136    HB2  PHE  22           1HB      PHE  22 -10.499  -1.109   2.364
  137    HB3  PHE  22           2HB      PHE  22 -10.901  -1.039   4.076
  138    HD1  PHE  22           HD2      PHE  22  -9.175  -1.232   5.769
  139    HD2  PHE  22           HD1      PHE  22  -8.219  -1.336   1.623
  140    HE1  PHE  22           HE2      PHE  22  -6.806  -0.847   6.310
  141    HE2  PHE  22           HE1      PHE  22  -5.848  -0.953   2.157
  142    HZ   PHE  22           HZ       PHE  22  -5.139  -0.707   4.502
  143    H    THR  23           H        THR  23 -12.719  -2.449   4.704
  144    HA   THR  23           HA       THR  23 -14.649  -3.645   2.866
  145    HB   THR  23           HB       THR  23 -14.837  -4.224   5.248
  146    HG1  THR  23           HG1      THR  23 -16.850  -4.374   4.603
  147   HG21  THR  23          3HG2      THR  23 -14.161  -1.653   5.771
  148   HG22  THR  23          1HG2      THR  23 -14.931  -2.728   6.938
  149   HG23  THR  23          2HG2      THR  23 -15.907  -1.588   6.012
  150    H    GLN  24           H        GLN  24 -13.719  -0.541   4.209
  151    HA   GLN  24           HA       GLN  24 -15.659   0.749   2.405
  152    HB2  GLN  24           1HB      GLN  24 -14.974   1.327   5.248
  153    HB3  GLN  24           2HB      GLN  24 -15.360   2.683   4.197
  154    HG2  GLN  24           1HG      GLN  24 -17.157   0.297   4.480
  155    HG3  GLN  24           2HG      GLN  24 -17.262   1.703   5.538
  156   HE21  GLN  24          1HE2      GLN  24 -18.952   0.431   3.299
  157   HE22  GLN  24          2HE2      GLN  24 -19.410   1.788   2.334
  158    H    LYS  25           H        LYS  25 -14.901   2.290   1.064
  159    HA   LYS  25           HA       LYS  25 -12.245   2.466   0.375
  160    HB2  LYS  25           1HB      LYS  25 -12.816   4.310  -0.998
  161    HB3  LYS  25           2HB      LYS  25 -14.255   3.301  -0.926
  162    HG2  LYS  25           1HG      LYS  25 -15.213   5.328  -0.587
  163    HG3  LYS  25           2HG      LYS  25 -14.840   4.915   1.088
  164    HD2  LYS  25           1HD      LYS  25 -13.954   7.016   1.021
  165    HD3  LYS  25           2HD      LYS  25 -12.547   6.099   0.477
  166    HE2  LYS  25           1HE      LYS  25 -14.492   7.032  -1.569
  167    HE3  LYS  25           2HE      LYS  25 -13.430   8.229  -0.831
  168    HZ1  LYS  25           3HZ      LYS  25 -12.537   5.745  -2.192
  169    HZ2  LYS  25           1HZ      LYS  25 -11.526   6.912  -1.503
  170    HZ3  LYS  25           2HZ      LYS  25 -12.472   7.302  -2.849
  171    H    ALA  26           H        ALA  26 -14.018   4.359   2.749
  172    HA   ALA  26           HA       ALA  26 -12.276   6.431   3.241
  173    HB1  ALA  26           3HB      ALA  26 -13.164   6.432   5.551
  174    HB2  ALA  26           1HB      ALA  26 -14.424   6.308   4.324
  175    HB3  ALA  26           2HB      ALA  26 -13.928   4.876   5.227
  176    H    HIS  27           H        HIS  27 -12.117   3.110   4.450
  177    HA   HIS  27           HA       HIS  27  -9.909   3.509   6.174
  178    HB2  HIS  27           1HB      HIS  27 -11.148   1.082   4.904
  179    HB3  HIS  27           2HB      HIS  27  -9.668   0.950   5.850
  180    HD1  HIS  27           HD1      HIS  27 -12.343  -0.391   6.712
  181    HD2  HIS  27           HD2      HIS  27 -10.973   3.286   8.078
  182    HE1  HIS  27           HE1      HIS  27 -13.482  -0.028   8.924
  183    H    LEU  28           H        LEU  28 -10.149   2.320   2.837
  184    HA   LEU  28           HA       LEU  28  -7.412   1.802   2.466
  185    HB2  LEU  28           1HB      LEU  28  -9.055   0.903   0.962
  186    HB3  LEU  28           2HB      LEU  28  -9.574   2.521   0.495
  187    HG   LEU  28           HG       LEU  28  -7.116   2.758  -0.353
  188   HD11  LEU  28          1HD1      LEU  28  -7.229  -0.009   0.442
  189   HD12  LEU  28          2HD1      LEU  28  -5.853   0.951  -0.098
  190   HD13  LEU  28          3HD1      LEU  28  -6.882   0.142  -1.280
  191   HD21  LEU  28          3HD2      LEU  28  -9.179   2.772  -1.725
  192   HD22  LEU  28          1HD2      LEU  28  -9.083   1.014  -1.830
  193   HD23  LEU  28          2HD2      LEU  28  -7.809   2.010  -2.534
  194    H    ALA  29           H        ALA  29  -9.337   4.607   1.387
  195    HA   ALA  29           HA       ALA  29  -7.322   6.151   0.330
  196    HB1  ALA  29           3HB      ALA  29 -10.014   6.578   1.231
  197    HB2  ALA  29           1HB      ALA  29  -9.003   7.959   1.656
  198    HB3  ALA  29           2HB      ALA  29  -9.106   7.424  -0.022
  199    H    GLN  30           H        GLN  30  -8.234   5.768   3.714
  200    HA   GLN  30           HA       GLN  30  -6.434   7.783   4.665
  201    HB2  GLN  30           1HB      GLN  30  -8.132   5.680   5.960
  202    HB3  GLN  30           2HB      GLN  30  -6.917   6.530   6.904
  203    HG2  GLN  30           1HG      GLN  30  -8.809   8.144   5.287
  204    HG3  GLN  30           2HG      GLN  30  -9.410   7.370   6.753
  205   HE21  GLN  30          1HE2      GLN  30  -7.284   9.773   5.440
  206   HE22  GLN  30          2HE2      GLN  30  -6.925  10.568   6.931
  207    H    HIS  31           H        HIS  31  -6.118   4.520   3.720
  208    HA   HIS  31           HA       HIS  31  -3.698   4.087   5.286
  209    HB2  HIS  31           1HB      HIS  31  -4.855   2.094   5.230
  210    HB3  HIS  31           2HB      HIS  31  -5.471   2.374   3.604
  211    HD1  HIS  31           HD1      HIS  31  -2.106   1.638   5.232
  212    HD2  HIS  31           HD2      HIS  31  -4.230   0.855   1.748
  213    HE1  HIS  31           HE1      HIS  31  -0.649   0.089   3.889
  214    H    GLN  32           H        GLN  32  -4.559   3.765   1.836
  215    HA   GLN  32           HA       GLN  32  -2.166   3.509   0.657
  216    HB2  GLN  32           1HB      GLN  32  -4.289   5.454  -0.264
  217    HB3  GLN  32           2HB      GLN  32  -3.017   4.773  -1.268
  218    HG2  GLN  32           1HG      GLN  32  -5.097   3.113   0.130
  219    HG3  GLN  32           2HG      GLN  32  -5.268   3.715  -1.518
  220   HE21  GLN  32          1HE2      GLN  32  -4.751   2.303  -3.011
  221   HE22  GLN  32          2HE2      GLN  32  -3.580   1.041  -2.869
  222    H    LYS  33           H        LYS  33  -3.491   6.605   1.781
  223    HA   LYS  33           HA       LYS  33  -1.729   8.444   0.956
  224    HB2  LYS  33           1HB      LYS  33  -2.230   9.741   2.843
  225    HB3  LYS  33           2HB      LYS  33  -3.621   8.677   2.679
  226    HG2  LYS  33           1HG      LYS  33  -2.578   7.182   4.386
  227    HG3  LYS  33           2HG      LYS  33  -1.346   8.422   4.630
  228    HD2  LYS  33           1HD      LYS  33  -3.382   9.999   4.990
  229    HD3  LYS  33           2HD      LYS  33  -4.268   8.498   5.273
  230    HE2  LYS  33           1HE      LYS  33  -1.712   9.171   6.709
  231    HE3  LYS  33           2HE      LYS  33  -3.296   9.656   7.314
  232    HZ1  LYS  33           3HZ      LYS  33  -3.824   7.550   7.883
  233    HZ2  LYS  33           1HZ      LYS  33  -2.144   7.377   7.980
  234    HZ3  LYS  33           2HZ      LYS  33  -2.969   6.850   6.602
  235    H    THR  34           H        THR  34  -1.121   6.206   3.645
  236    HA   THR  34           HA       THR  34   1.385   7.123   4.413
  237    HB   THR  34           HB       THR  34   1.782   4.941   5.383
  238    HG1  THR  34           HG1      THR  34   0.029   3.314   4.884
  239   HG21  THR  34          3HG2      THR  34   0.310   5.518   6.950
  240   HG22  THR  34          1HG2      THR  34  -0.968   4.741   6.017
  241   HG23  THR  34          2HG2      THR  34  -0.612   6.450   5.771
  242    H    HIS  35           H        HIS  35   0.601   4.586   2.039
  243    HA   HIS  35           HA       HIS  35   3.189   3.916   1.292
  244    HB2  HIS  35           1HB      HIS  35   0.607   3.904  -0.267
  245    HB3  HIS  35           2HB      HIS  35   2.114   3.283  -0.933
  246    HD1  HIS  35           HD1      HIS  35   3.072   1.901   1.755
  247    HD2  HIS  35           HD2      HIS  35  -0.650   1.458  -0.038
  248    HE1  HIS  35           HE1      HIS  35   2.182  -0.299   2.587
  249    H    THR  36           H        THR  36   4.696   4.764  -0.043
  250    HA   THR  36           HA       THR  36   4.640   7.514  -0.640
  251    HB   THR  36           HB       THR  36   6.746   6.319  -0.309
  252    HG1  THR  36           HG1      THR  36   7.748   7.103  -2.385
  253   HG21  THR  36          3HG2      THR  36   7.588   4.689  -1.762
  254   HG22  THR  36          1HG2      THR  36   6.431   5.089  -3.031
  255   HG23  THR  36          2HG2      THR  36   5.890   4.250  -1.577
  256    H    GLY  37           H        GLY  37   3.388   8.449  -2.118
  257    HA2  GLY  37           1HA      GLY  37   3.478   7.544  -4.860
  258    HA3  GLY  37           2HA      GLY  37   1.903   7.358  -4.103
  259    H    GLU  38           H        GLU  38   4.280   9.950  -3.662
  260    HA   GLU  38           HA       GLU  38   2.696  11.805  -5.215
  261    HB2  GLU  38           1HB      GLU  38   2.131  13.299  -3.454
  262    HB3  GLU  38           2HB      GLU  38   1.607  11.702  -2.942
  263    HG2  GLU  38           1HG      GLU  38   3.300  11.511  -1.366
  264    HG3  GLU  38           2HG      GLU  38   4.277  12.767  -2.123
  265    H    LYS  39           H        LYS  39   3.742  13.857  -5.517
  266    HA   LYS  39           HA       LYS  39   6.649  13.654  -5.193
  267    HB2  LYS  39           1HB      LYS  39   4.849  14.992  -7.154
  268    HB3  LYS  39           2HB      LYS  39   6.411  15.737  -6.837
  269    HG2  LYS  39           1HG      LYS  39   7.525  13.639  -7.438
  270    HG3  LYS  39           2HG      LYS  39   5.953  12.914  -7.783
  271    HD2  LYS  39           1HD      LYS  39   6.592  13.576  -9.888
  272    HD3  LYS  39           2HD      LYS  39   5.690  14.998  -9.358
  273    HE2  LYS  39           1HE      LYS  39   7.976  15.846  -8.509
  274    HE3  LYS  39           2HE      LYS  39   8.655  14.609  -9.566
  275    HZ1  LYS  39           3HZ      LYS  39   6.654  16.224 -10.846
  276    HZ2  LYS  39           1HZ      LYS  39   8.212  15.819 -11.367
  277    HZ3  LYS  39           2HZ      LYS  39   7.985  17.124 -10.316
  278    HA   PRO  40           HA       PRO  40   6.713  16.821  -2.135
  279    HB2  PRO  40           1HB      PRO  40   9.269  17.676  -2.460
  280    HB3  PRO  40           2HB      PRO  40   8.861  16.138  -1.690
  281    HG2  PRO  40           1HG      PRO  40   9.753  16.674  -4.497
  282    HG3  PRO  40           2HG      PRO  40  10.257  15.383  -3.390
  283    HD2  PRO  40           1HD      PRO  40   8.446  14.985  -5.363
  284    HD3  PRO  40           2HD      PRO  40   8.383  14.111  -3.820
  285    H    SER  41           H        SER  41   7.499  19.180  -1.925
  286    HA   SER  41           HA       SER  41   6.591  20.617  -4.318
  287    HB2  SER  41           1HB      SER  41   5.438  20.906  -2.047
  288    HB3  SER  41           2HB      SER  41   6.882  21.791  -1.554
  289    HG   SER  41           HG       SER  41   5.902  23.425  -2.441
  290    H    GLY  42           H        GLY  42   7.565  22.973  -4.345
  291    HA2  GLY  42           1HA      GLY  42  10.389  22.618  -4.786
  292    HA3  GLY  42           2HA      GLY  42   9.458  24.075  -5.098
  293    HA   PRO  43           HA       PRO  43  12.217  24.926  -1.489
  294    HB2  PRO  43           1HB      PRO  43  12.952  27.396  -2.345
  295    HB3  PRO  43           2HB      PRO  43  13.779  25.918  -2.852
  296    HG2  PRO  43           1HG      PRO  43  11.698  27.513  -4.296
  297    HG3  PRO  43           2HG      PRO  43  13.184  26.781  -4.927
  298    HD2  PRO  43           1HD      PRO  43  10.749  25.642  -5.248
  299    HD3  PRO  43           2HD      PRO  43  12.236  24.686  -5.082
  300    H    SER  44           H        SER  44   9.815  26.933  -3.133
  301    HA   SER  44           HA       SER  44   9.003  27.988  -0.503
  302    HB2  SER  44           1HB      SER  44   9.226  29.374  -3.162
  303    HB3  SER  44           2HB      SER  44   8.111  29.968  -1.932
  304    HG   SER  44           HG       SER  44  10.141  29.778  -0.539
  305    H    SER  45           H        SER  45   6.709  28.596  -0.361
  306    HA   SER  45           HA       SER  45   5.027  26.496  -1.138
  307    HB2  SER  45           1HB      SER  45   3.281  27.675  -0.081
  308    HB3  SER  45           2HB      SER  45   4.731  28.190   0.781
  309    HG   SER  45           HG       SER  45   4.338  30.147   0.155
  310    H    GLY  46           H        GLY  46   3.879  26.100  -2.924
  311    HA2  GLY  46           1HA      GLY  46   2.555  27.858  -4.560
  312    HA3  GLY  46           2HA      GLY  46   4.185  27.792  -5.215