*HEADER    TRANSCRIPTION                           05-APR-07   2YTD              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 426-          
*TITLE    2 458) OF HUMAN ZINC FINGER PROTEIN 473                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 473;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2;                                                   
*COMPND   5 SYNONYM: ZINC FINGER PROTEIN 100 HOMOLOG, ZFP-100;                   
*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: ZNF473;                                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P070115-57;                               
*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 2YTD    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
 24 ARG  HN     27 HIS  HN      4.95 #SUP  0.38  #QF  0.38
 24 ARG  HN     28 LEU  HN      4.90 #SUP  0.52  #QF  0.52
 22 PHE  HB2    24 ARG  HN      4.11 #SUP  0.97  #QF  0.97
 23 HIS  HN     24 ARG  HN      4.87 #SUP  0.77  #QF  0.77
 22 PHE  HB3    24 ARG  HN      3.69 #SUP  0.93  #QF  0.93
 23 HIS  QB     24 ARG  HN      3.49 #SUP  0.77  #QF  0.61
 24 ARG  HN     24 ARG  HB2     4.20 #SUP  1.00
 24 ARG  HN     24 ARG  QG      3.92 #SUP  0.97  #QF  0.97
 24 ARG  HN     24 ARG  HB3     4.20 #SUP  0.96  #QF  0.96
 28 LEU  HN     30 GLU  HN      4.95 #SUP  0.79  #QF  0.79
 28 LEU  HN     29 ASN  HN      3.36 #SUP  0.99  #QF  0.99
 27 HIS  HN     28 LEU  HN      3.48 #SUP  0.93  #QF  0.93
 25 HIS  HA     28 LEU  HN      3.82 #SUP  0.79  #QF  0.49
 22 PHE  HB2    28 LEU  HN      4.30 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HB2     3.22 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HG      4.56 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HB3     3.47 #SUP  1.00
 28 LEU  HN     28 LEU  QD2     4.64 #SUP  1.00  #QF  0.99
 28 LEU  HN     28 LEU  QD1     4.98 #SUP  1.00  #QF  0.99
 17 GLU  QB     19 GLY  HN      4.69 #SUP  0.72  #QF  0.72
 18 CYSS HN     19 GLY  HN      2.99 #SUP  0.81  #QF  0.81
 15 CYSS HB3    19 GLY  HN      3.82 #SUP  0.91  #QF  0.51
 14 LYS  QG     19 GLY  HN      5.50 #SUP  0.81  #QF  0.67
 36 THR  HN     36 THR  QG2     4.98 #SUP  0.96  #QF  0.96
 38 TYR  HN     38 TYR  HB2     4.06 #SUP  0.99  #QF  0.99
 38 TYR  HN     38 TYR  HB3     4.06 #SUP  1.00
 10 GLU  HN     10 GLU  HB3     4.17 #SUP  0.98  #QF  0.98
 26 THR  QG2    27 HIS  HN      4.63 #SUP  0.91  #QF  0.91
 27 HIS  HN     29 ASN  HN      4.98 #SUP  0.98  #QF  0.98
 27 HIS  HN     27 HIS  HD2     3.81 #SUP  0.99  #QF  0.30
 26 THR  HB     27 HIS  HN      4.59 #SUP  0.89  #QF  0.89
 24 ARG  HB2    27 HIS  HN      4.08 #SUP  0.94  #QF  0.94
 24 ARG  QG     27 HIS  HN      5.05 #SUP  0.98  #QF  0.98
 24 ARG  HB3    27 HIS  HN      4.08 #SUP  0.94  #QF  0.94
 31 HIS  HN     32 ARG  HN      3.50 #SUP  0.99  #QF  0.99
 31 HIS  HN     31 HIS  HB2     3.27 #SUP  0.98  #QF  0.98
 31 HIS  HN     31 HIS  HB3     3.27 #SUP  0.99  #QF  0.99
 30 GLU  QB     31 HIS  HN      3.42 #SUP  0.91  #QF  0.91
 28 LEU  HN     31 HIS  HN      4.97 #SUP  0.93  #QF  0.93
 27 HIS  HA     31 HIS  HN      4.80 #SUP  0.94  #QF  0.94
 15 CYSS HN     22 PHE  HN      4.80 #SUP  0.97  #QF  0.97
 15 CYSS HN     20 LYS  HN      4.57 #SUP  0.94  #QF  0.94
 14 LYS  QB     15 CYSS HN      4.22 #SUP  0.98  #QF  0.97
 14 LYS  QD     15 CYSS HN      4.56 #SUP  0.98  #QF  0.97
 15 CYSS HN     22 PHE  QE      4.53 #SUP  0.95  #QF  0.95
 14 LYS  HA     15 CYSS HN      3.05 #SUP  0.91  #QF  0.91
 15 CYSS HN     15 CYSS HB3     3.28 #SUP  0.99  #QF  0.99
 14 LYS  QG     15 CYSS HN      3.96 #SUP  0.93  #QF  0.91
 15 CYSS HN     28 LEU  QD1     4.11 #SUP  0.99  #QF  0.21
 15 CYSS HN     22 PHE  QD      4.94 #SUP  1.00
 15 CYSS HN     21 ALA  HA      3.92 #SUP  0.97  #QF  0.97
 15 CYSS HN     15 CYSS HB2     3.38 #SUP  1.00
 27 HIS  HA     30 GLU  HN      4.04 #SUP  0.97  #QF  0.97
 29 ASN  HB3    30 GLU  HN      3.76 #SUP  0.78  #QF  0.78
 30 GLU  HN     30 GLU  QB      3.10 #SUP  0.97  #QF  0.97
 30 GLU  HN     30 GLU  HG2     4.53 #SUP  0.94  #QF  0.94
 34 ILE  HN     35 HIS  HN      3.37 #SUP  0.99  #QF  0.99
 35 HIS  HN     35 HIS  HD2     4.30 #SUP  0.98  #QF  0.98
 33 ARG  HA     35 HIS  HN      4.33 #SUP  1.00  #QF  0.83
 32 ARG  HA     35 HIS  HN      4.13 #SUP  0.95  #QF  0.95
 35 HIS  HN     35 HIS  HB3     3.79 #SUP  0.97  #QF  0.97
 35 HIS  HN     35 HIS  HB2     3.79 #SUP  0.94  #QF  0.94
 34 ILE  HG13   35 HIS  HN      4.45 #SUP  0.97  #QF  0.91
 34 ILE  QG2    35 HIS  HN      4.15 #SUP  0.98  #QF  0.98
 35 HIS  HN     36 THR  HN      4.21 #SUP  0.85  #QF  0.85
 35 HIS  HN     36 THR  QG2     5.09 #SUP  0.75  #QF  0.75
 34 ILE  HG12   35 HIS  HN      4.45 #SUP  1.00
 34 ILE  HB     35 HIS  HN      4.23 #SUP  0.99  #QF  0.99
 27 HIS  HA     29 ASN  HN      5.17 #SUP  0.95  #QF  0.95
 38 TYR  HA     39 ARG  HN      3.40 #SUP  0.93  #QF  0.93
 25 HIS  HA     29 ASN  HN      4.50 #SUP  0.76  #QF  0.33
 28 LEU  HG     29 ASN  HN      4.32 #SUP  1.00
 28 LEU  HB3    29 ASN  HN      4.04 #SUP  0.99  #QF  0.99
 28 LEU  QD2    29 ASN  HN      4.23 #SUP  0.99  #QF  0.99
 26 THR  HA     29 ASN  HN      4.07 #SUP  0.99  #QF  0.99
 29 ASN  HN     29 ASN  HB3     3.21 #SUP  0.92  #QF  0.92
 13 TYR  HN     13 TYR  QD      3.57 #SUP  1.00
 11 LYS  HA     13 TYR  HN      4.58 #SUP  0.95  #QF  0.95
 12 PRO  HB2    13 TYR  HN      4.52 #SUP  0.99  #QF  0.99
 13 TYR  HN     28 LEU  QD2     5.29 #SUP  0.99  #QF  0.99
 12 PRO  HD3    13 TYR  HN      4.31 #SUP  0.88  #QF  0.88
 13 TYR  HN     13 TYR  HB2     3.76 #SUP  1.00
 13 TYR  HN     13 TYR  HB3     3.76 #SUP  0.99  #QF  0.99
 12 PRO  HB3    13 TYR  HN      4.52 #SUP  0.94  #QF  0.94
 32 ARG  QG     33 ARG  HN      4.59 #SUP  0.98  #QF  0.98
 33 ARG  HN     34 ILE  HN      3.58 #SUP  1.00
 33 ARG  HN     33 ARG  QD      4.32 #SUP  0.99  #QF  0.99
 32 ARG  HB2    33 ARG  HN      4.70 #SUP  0.57  #QF  0.57
 33 ARG  HN     33 ARG  HB2     3.84 #SUP  0.84  #QF  0.57
 33 ARG  HN     33 ARG  HG2     3.74 #SUP  0.84  #QF  0.57
 33 ARG  HN     33 ARG  HG3     3.74 #SUP  1.00
 31 HIS  HA     33 ARG  HN      4.86 #SUP  0.91  #QF  0.91
 13 TYR  QD     14 LYS  HN      4.69 #SUP  0.98  #QF  0.98
 13 TYR  HA     14 LYS  HN      2.93 #SUP  0.88  #QF  0.88
 13 TYR  HB2    14 LYS  HN      4.72 #SUP  0.99  #QF  0.99
 14 LYS  HN     14 LYS  QB      3.25 #SUP  0.90  #QF  0.90
 14 LYS  HN     14 LYS  QG      4.45 #SUP  0.97  #QF  0.97
 14 LYS  HN     28 LEU  QD2     4.13 #SUP  0.98  #QF  0.96
 14 LYS  HN     28 LEU  QD1     4.56 #SUP  0.98  #QF  0.96
 13 TYR  HN     14 LYS  HN      4.57 #SUP  0.98  #QF  0.98
 13 TYR  HB3    14 LYS  HN      4.72 #SUP  0.99  #QF  0.99
 13 TYR  QD     22 PHE  HN      5.04 #SUP  0.76  #QF  0.76
 21 ALA  HN     22 PHE  HN      5.03 #SUP  0.99  #QF  0.99
 13 TYR  HN     22 PHE  HN      4.47 #SUP  0.98  #QF  0.98
 22 PHE  HN     22 PHE  QD      3.37 #SUP  0.98  #QF  0.98
 22 PHE  HN     22 PHE  QE      5.09 #SUP  0.95  #QF  0.95
 21 ALA  HA     22 PHE  HN      2.95 #SUP  0.93  #QF  0.93
 14 LYS  HA     22 PHE  HN      4.15 #SUP  0.88  #QF  0.88
 22 PHE  HN     22 PHE  HB3     4.07 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  HB2     3.57 #SUP  0.87  #QF  0.87
 21 ALA  QB     22 PHE  HN      3.40 #SUP  0.94  #QF  0.94
 20 LYS  HA     21 ALA  HN      2.75 #SUP  0.99  #QF  0.99
 21 ALA  HN     21 ALA  QB      3.10 #SUP  0.95  #QF  0.27
 20 LYS  HG2    21 ALA  HN      4.76 #SUP  0.98  #QF  0.98
 32 ARG  HA     34 ILE  HN      4.46 #SUP  0.99  #QF  0.99
 31 HIS  HA     34 ILE  HN      4.66 #SUP  0.67  #QF  0.67
 34 ILE  HN     34 ILE  QG2     3.41 #SUP  0.98  #QF  0.98
 15 CYSS HB3    20 LYS  HN      3.41 #SUP  0.97  #QF  0.97
 15 CYSS HB2    20 LYS  HN      3.85 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HB2     3.80 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HB3     3.80 #SUP  1.00
 32 ARG  HN     33 ARG  HN      3.55 #SUP  0.99  #QF  0.99
 31 HIS  HB2    32 ARG  HN      4.06 #SUP  0.99  #QF  0.99
 31 HIS  HB3    32 ARG  HN      4.06 #SUP  1.00
 32 ARG  HN     32 ARG  QG      3.34 #SUP  0.99  #QF  0.99
 28 LEU  QD1    32 ARG  HN      4.52 #SUP  0.99  #QF  0.99
 15 CYSS HB2    17 GLU  HN      5.18 #SUP  0.95  #QF  0.95
 17 GLU  HN     18 CYSS HN      3.22 #SUP  0.99  #QF  0.99
 15 CYSS HB3    18 CYSS HN      4.20 #SUP  0.97  #QF  0.42
 17 GLU  QB     18 CYSS HN      3.33 #SUP  0.89  #QF  0.89
 17 GLU  HN     19 GLY  HN      4.18 #SUP  0.98  #QF  0.98
 15 CYSS HA     17 GLU  HN      4.47 #SUP  0.76  #QF  0.76
 17 GLU  HN     17 GLU  HG3     4.36 #SUP  0.86  #QF  0.86
 17 GLU  HN     17 GLU  QB      3.07 #SUP  0.95  #QF  0.95
 27 HIS  HA     27 HIS  HD2     3.66 #SUP  0.86  #QF  0.86
 18 CYSS HB3    35 HIS  HE1     3.89 #SUP  0.99  #QF  0.99
 17 GLU  QB     35 HIS  HE1     4.77 #SUP  0.67  #QF  0.67
 31 HIS  HE1    34 ILE  QD1     3.48 #SUP  0.95  #QF  0.95
 38 TYR  HA     38 TYR  QD      3.75 #SUP  1.00
 13 TYR  HA     13 TYR  QD      3.75 #SUP  0.99  #QF  0.99
 13 TYR  QD     28 LEU  QD2     3.76 #SUP  1.00
 21 ALA  HA     22 PHE  QD      4.10 #SUP  0.98  #QF  0.98
 22 PHE  HA     22 PHE  QD      4.59 #SUP  0.99  #QF  0.99
 22 PHE  QD     28 LEU  HG      4.73 #SUP  0.97  #QF  0.97
 22 PHE  QD     28 LEU  QD1     3.47 #SUP  1.00
 22 PHE  QD     28 LEU  HB2     4.58 #SUP  0.98  #QF  0.98
 20 LYS  HB3    22 PHE  QE      4.54 #SUP  1.00
 15 CYSS HB2    22 PHE  QE      4.06 #SUP  0.89  #QF  0.78
 22 PHE  QE     28 LEU  HA      4.42 #SUP  0.75  #QF  0.67
 22 PHE  HZ     31 HIS  HB3     4.48 #SUP  0.98  #QF  0.98
 22 PHE  HZ     31 HIS  HB2     4.48 #SUP  1.00
 22 PHE  HZ     28 LEU  QD1     5.35 #SUP  0.98  #QF  0.79
 31 HIS  HD2    35 HIS  HD2     4.10 #SUP  0.72  #QF  0.72
 32 ARG  QG     35 HIS  HD2     4.15 #SUP  0.98  #QF  0.98
 17 GLU  QB     35 HIS  HD2     4.14 #SUP  0.83  #QF  0.83
 31 HIS  HD2    32 ARG  HN      4.38 #SUP  0.99  #QF  0.99
 15 CYSS HB2    31 HIS  HD2     3.47 #SUP  0.97  #QF  0.97
 31 HIS  HD2    32 ARG  QG      3.83 #SUP  0.99  #QF  0.99
 14 LYS  HA     21 ALA  HA      3.73 #SUP  0.94  #QF  0.94
 14 LYS  QB     21 ALA  HA      4.71 #SUP  0.95  #QF  0.94
 25 HIS  HD2    28 LEU  QD2     4.44 #SUP  0.71  #QF  0.71
 13 TYR  QE     25 HIS  HA      4.71 #SUP  0.95  #QF  0.95
 13 TYR  QE     25 HIS  HB3     4.58 #SUP  0.42  #QF  0.42
 13 TYR  QE     28 LEU  QD2     4.77 #SUP  0.97  #QF  0.97
 13 TYR  HN     13 TYR  QE      4.78 #SUP  0.97  #QF  0.97
 38 TYR  QE     40 PRO  HA      4.51 #SUP  0.92  #QF  0.92
 14 LYS  HA     21 ALA  QB      4.17 #SUP  0.91  #QF  0.91
 20 LYS  HA     21 ALA  QB      4.17 #SUP  0.87  #QF  0.87
 14 LYS  QE     21 ALA  QB      4.58 #SUP  0.38  #QF  0.38
 28 LEU  QD1    31 HIS  HD2     3.52 #SUP  1.00
 22 PHE  QE     28 LEU  QD1     3.78 #SUP  0.98  #QF  0.98
 15 CYSS HA     28 LEU  QD1     3.57 #SUP  0.98  #QF  0.98
 22 PHE  HB2    28 LEU  QD1     4.69 #SUP  1.00
 28 LEU  QD1    32 ARG  QG      3.60 #SUP  0.98  #QF  0.98
 33 ARG  HA     36 THR  QG2     4.39 #SUP  0.95  #QF  0.95
 22 PHE  HB3    28 LEU  HN      4.47 #SUP  0.93  #QF  0.93
 22 PHE  HB3    27 HIS  HB3     3.92 #SUP  0.99  #QF  0.99
 22 PHE  HB3    27 HIS  HB2     3.92 #SUP  0.85  #QF  0.85
 22 PHE  HB2    27 HIS  HB3     4.61 #SUP  0.99  #QF  0.99
 22 PHE  HB2    27 HIS  HB2     4.61 #SUP  1.00  #QF  0.55
 22 PHE  HB2    28 LEU  HB3     4.10 #SUP  0.98  #QF  0.98
 22 PHE  HB2    28 LEU  QD2     5.20 #SUP  1.00  #QF  0.88
 22 PHE  HB3    28 LEU  QD1     5.17 #SUP  0.99  #QF  0.99
 28 LEU  HG     32 ARG  HD2     4.39 #SUP  0.99  #QF  0.99
 28 LEU  HG     32 ARG  HD3     4.39 #SUP  0.99  #QF  0.99
 30 GLU  QB     33 ARG  QD      4.72 #SUP  0.94  #QF  0.94
 30 GLU  HA     33 ARG  QD      3.72 #SUP  0.87  #QF  0.87
 11 LYS  HG2    11 LYS  QE      4.06 #SUP  0.95  #QF  0.95
 11 LYS  HG3    11 LYS  QE      4.06 #SUP  0.99  #QF  0.99
 14 LYS  QE     19 GLY  HA1     4.44 #SUP  0.95  #QF  0.95
 14 LYS  QE     19 GLY  HA2     4.44 #SUP  0.96  #QF  0.96
 14 LYS  QG     14 LYS  QE      3.55 #SUP  0.88  #QF  0.88
 26 THR  HA     29 ASN  HB3     3.45 #SUP  0.89  #QF  0.89
 26 THR  HA     26 THR  QG2     3.31 #SUP  0.95  #QF  0.95
 26 THR  HA     30 GLU  HN      4.86 #SUP  0.95  #QF  0.95
 28 LEU  HB2    29 ASN  HN      3.85 #SUP  1.00
 13 TYR  HB2    28 LEU  HB2     4.60 #SUP  1.00
 28 LEU  HB2    28 LEU  QD1     3.90 #SUP  1.00
 22 PHE  QD     28 LEU  HB3     4.23 #SUP  1.00
 28 LEU  HB3    29 ASN  HB2     4.41 #SUP  0.77  #QF  0.77
 28 LEU  HB3    28 LEU  QD2     3.38 #SUP  1.00  #QF  0.99
 22 PHE  HB2    28 LEU  HB2     4.56 #SUP  1.00
 31 HIS  HE1    34 ILE  QG2     4.46 #SUP  0.43  #QF  0.43
 34 ILE  HA     34 ILE  HB      3.01 #SUP  1.00
 34 ILE  HA     34 ILE  QG2     3.22 #SUP  0.99  #QF  0.99
 36 THR  HA     36 THR  QG2     3.35 #SUP  0.85  #QF  0.85
 13 TYR  HB2    28 LEU  HB3     4.51 #SUP  1.00
 13 TYR  HB2    28 LEU  QD2     3.88 #SUP  1.00  #QF  0.99
 13 TYR  HB3    28 LEU  HB2     4.60 #SUP  0.98  #QF  0.98
 13 TYR  HB3    28 LEU  HB3     4.51 #SUP  0.99  #QF  0.99
 34 ILE  HN     34 ILE  HB      3.82 #SUP  1.00
 34 ILE  HB     34 ILE  QD1     3.67 #SUP  1.00
 34 ILE  HN     34 ILE  QD1     4.27 #SUP  0.99  #QF  0.99
 34 ILE  HA     34 ILE  QD1     4.20 #SUP  1.00
 29 ASN  HN     29 ASN  HB2     3.68 #SUP  0.99  #QF  0.99
 29 ASN  HB2    30 GLU  HN      4.13 #SUP  0.98  #QF  0.98
 26 THR  HA     29 ASN  HB2     4.01 #SUP  0.98  #QF  0.98
 31 HIS  HD2    32 ARG  HA      3.81 #SUP  0.99  #QF  0.99
 32 ARG  HA     35 HIS  HD2     3.37 #SUP  0.99  #QF  0.99
 32 ARG  HA     32 ARG  QG      3.37 #SUP  1.00
 17 GLU  HN     17 GLU  HG2     4.36 #SUP  1.00
 17 GLU  HA     17 GLU  HG3     4.10 #SUP  1.00
 13 TYR  QD     25 HIS  HA      4.08 #SUP  0.97  #QF  0.83
 25 HIS  HA     25 HIS  HD2     4.34 #SUP  0.94  #QF  0.94
 13 TYR  HB2    25 HIS  HA      4.62 #SUP  0.99  #QF  0.99
 13 TYR  HB3    25 HIS  HA      4.62 #SUP  0.99  #QF  0.99
 25 HIS  HA     28 LEU  HB2     3.72 #SUP  0.95  #QF  0.95
 25 HIS  HA     28 LEU  HB3     4.07 #SUP  0.98  #QF  0.98
 25 HIS  HA     28 LEU  QD2     4.09 #SUP  0.98  #QF  0.98
 30 GLU  HA     30 GLU  HG2     4.15 #SUP  1.00
 30 GLU  HN     30 GLU  HG3     4.53 #SUP  1.00
 31 HIS  HA     34 ILE  QG2     4.24 #SUP  0.61  #QF  0.61
 30 GLU  HA     30 GLU  HG3     4.15 #SUP  0.99  #QF  0.99
 17 GLU  HA     17 GLU  HG2     4.10 #SUP  0.92  #QF  0.92
 33 ARG  HA     36 THR  HB      4.56 #SUP  0.67  #QF  0.67
 33 ARG  HA     33 ARG  QD      4.38 #SUP  1.00
 33 ARG  HA     33 ARG  HG2     3.67 #SUP  0.90  #QF  0.73
 33 ARG  HA     33 ARG  HG3     3.67 #SUP  1.00
 20 LYS  HA     20 LYS  HG2     4.20 #SUP  1.00
 22 PHE  HB2    28 LEU  HA      4.75 #SUP  0.95  #QF  0.95
 28 LEU  HA     32 ARG  HN      4.69 #SUP  0.92  #QF  0.92
 28 LEU  HA     31 HIS  HN      4.19 #SUP  0.91  #QF  0.91
 22 PHE  QD     28 LEU  HA      4.04 #SUP  0.98  #QF  0.98
 28 LEU  HA     29 ASN  HA      5.02 #SUP  0.79  #QF  0.79
 28 LEU  HA     28 LEU  HG      4.05 #SUP  1.00
 28 LEU  HA     28 LEU  QD1     3.20 #SUP  1.00
 27 HIS  HA     30 GLU  QB      3.54 #SUP  0.91  #QF  0.91
 20 LYS  HB2    21 ALA  HN      4.48 #SUP  1.00
 20 LYS  HB2    22 PHE  QE      4.54 #SUP  0.99  #QF  0.99
 20 LYS  HB3    21 ALA  HN      4.48 #SUP  0.99  #QF  0.99
 29 ASN  HA     32 ARG  QG      3.96 #SUP  0.98  #QF  0.98
 29 ASN  HA     32 ARG  HN      4.32 #SUP  0.92  #QF  0.92
 29 ASN  HA     32 ARG  HD2     4.45 #SUP  0.83  #QF  0.83
 29 ASN  HA     32 ARG  HD3     4.45 #SUP  1.00
 28 LEU  HG     29 ASN  HA      4.29 #SUP  1.00
 28 LEU  QD2    29 ASN  HA      4.77 #SUP  0.99  #QF  0.98
 28 LEU  QD1    29 ASN  HA      5.33 #SUP  0.99  #QF  0.98
 22 PHE  QD     27 HIS  HB3     4.03 #SUP  0.96  #QF  0.96
 22 PHE  QD     27 HIS  HB2     4.03 #SUP  0.96  #QF  0.96
 39 ARG  HB3    40 PRO  HD2     4.97 #SUP  0.99  #QF  0.99
 11 LYS  HA     11 LYS  HG2     4.00 #SUP  0.98  #QF  0.98
 11 LYS  HA     11 LYS  HG3     4.00 #SUP  1.00
 33 ARG  HN     33 ARG  HB3     3.84 #SUP  1.00
 33 ARG  HB3    33 ARG  QD      3.87 #SUP  1.00
 33 ARG  HB2    33 ARG  QD      3.87 #SUP  1.00
 13 TYR  QE     25 HIS  HB2     4.58 #SUP  0.60  #QF  0.60
 10 GLU  HN     10 GLU  HB2     4.17 #SUP  1.00  #QF  0.62
 15 CYSS HB3    20 LYS  HB2     4.49 #SUP  0.96  #QF  0.96
 15 CYSS HB3    21 ALA  HA      5.49 #SUP  0.89  #QF  0.89
 15 CYSS HB2    22 PHE  QD      4.89 #SUP  0.95  #QF  0.95
 32 ARG  HB3    33 ARG  HN      4.70 #SUP  0.98  #QF  0.98
 15 CYSS HB3    17 GLU  HN      4.86 #SUP  1.00
 15 CYSS HB3    31 HIS  HD2     4.28 #SUP  0.99  #QF  0.99
 15 CYSS HB3    22 PHE  QE      4.39 #SUP  0.95  #QF  0.95
 14 LYS  HA     15 CYSS HB3     4.69 #SUP  0.98  #QF  0.98
 15 CYSS HB3    20 LYS  HB3     4.49 #SUP  0.95  #QF  0.36
 15 CYSS HB3    28 LEU  QD1     3.89 #SUP  0.99  #QF  0.99
 14 LYS  HA     15 CYSS HB2     4.91 #SUP  0.99  #QF  0.99
 15 CYSS HB2    28 LEU  QD1     3.50 #SUP  1.00
 11 LYS  HA     11 LYS  QD      4.71 #SUP  1.00
 20 LYS  HD3    22 PHE  HZ      4.73 #SUP  0.88  #QF  0.88
 20 LYS  HD2    22 PHE  HZ      4.73 #SUP  0.95  #QF  0.95
 28 LEU  HG     32 ARG  QG      4.32 #SUP  0.96  #QF  0.96
 17 GLU  QB     35 HIS  HB3     5.48 #SUP  0.91  #QF  0.91
 17 GLU  QB     35 HIS  HB2     5.48 #SUP  0.78  #QF  0.68
 30 GLU  QB     31 HIS  HB2     4.89 #SUP  0.23  #QF  0.23
 30 GLU  QB     31 HIS  HB3     4.89 #SUP  0.64  #QF  0.64
 12 PRO  HD2    13 TYR  HN      4.31 #SUP  1.00
 11 LYS  HA     12 PRO  HD2     3.33 #SUP  0.97  #QF  0.97
 11 LYS  HA     12 PRO  HD3     3.33 #SUP  0.97  #QF  0.97
 39 ARG  HA     40 PRO  HD2     3.24 #SUP  0.95  #QF  0.95
 39 ARG  HB2    40 PRO  HD2     4.97 #SUP  0.82  #QF  0.82
 39 ARG  HA     40 PRO  HD3     3.24 #SUP  0.98  #QF  0.98
 39 ARG  HB3    40 PRO  HD3     4.97 #SUP  0.89  #QF  0.89
 39 ARG  HB2    40 PRO  HD3     4.97 #SUP  0.98  #QF  0.98
 23 HIS  HD2    24 ARG  QG      4.84 #SUP  0.96  #QF  0.96
 23 HIS  QB     24 ARG  QG      3.99 #SUP  0.91  #QF  0.91
 22 PHE  QD     28 LEU  QD2     5.04 #SUP  1.00  #QF  0.20
 13 TYR  HA     28 LEU  QD2     4.48 #SUP  0.99  #QF  0.99
 13 TYR  HB3    28 LEU  QD2     3.88 #SUP  1.00
 28 LEU  HB2    28 LEU  QD2     3.51 #SUP  1.00
 20 LYS  HN     20 LYS  HG3     5.10 #SUP  1.00
 20 LYS  HG3    31 HIS  HE1     5.50 #SUP  1.00
 20 LYS  HA     20 LYS  HG3     4.20 #SUP  1.00
 20 LYS  HG3    21 ALA  HN      4.76 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HG2     5.10 #SUP  0.99  #QF  0.99
 20 LYS  HG2    31 HIS  HE1     5.50 #SUP  0.99  #QF  0.99
 18 CYSS HB2    35 HIS  HE1     3.89 #SUP  0.99  #QF  0.99
 11 LYS  HA     11 LYS  QG      3.47 
 11 LYS  QB     12 PRO  QD      4.38 
 12 PRO  QB     13 TYR  HN      3.74 
 12 PRO  QB     13 TYR  QD      4.46 
 12 PRO  QB     13 TYR  QE      4.56 
 12 PRO  QG     13 TYR  HN      4.04 
 12 PRO  QG     13 TYR  QD      3.99 
 12 PRO  QG     13 TYR  QE      3.86 
 12 PRO  QD     13 TYR  HN      3.52 
 12 PRO  QD     13 TYR  QD      3.75 
 12 PRO  QD     13 TYR  QE      4.58 
 13 TYR  HN     13 TYR  QB      3.12 
 13 TYR  QB     14 LYS  HN      3.89 
 13 TYR  QB     22 PHE  HN      4.53 
 13 TYR  QB     22 PHE  HB2     4.17 
 13 TYR  QB     28 LEU  HN      5.23 
 13 TYR  QB     28 LEU  HB2     4.00 
 13 TYR  QB     28 LEU  HB3     3.76 
 13 TYR  QB     28 LEU  QD1     4.33 
 13 TYR  QB     28 LEU  QD2     3.18 
 13 TYR  QE     25 HIS  QB      3.95 
 14 LYS  QG     19 GLY  QA      4.15 
 14 LYS  QD     19 GLY  QA      4.53 
 14 LYS  QE     19 GLY  QA      3.88 
 15 CYSS HB2    20 LYS  QB      4.81 
 16 SER  HA     16 SER  QB      2.64 
 17 GLU  HN     17 GLU  QG      3.52 
 17 GLU  HA     17 GLU  QG      3.53 
 17 GLU  QB     35 HIS  QB      4.66 
 17 GLU  QG     35 HIS  QB      4.15 
 17 GLU  QG     35 HIS  HD2     5.03 
 18 CYSS HN     18 CYSS QB      3.50 
 18 CYSS HN     19 GLY  QA      4.55 
 18 CYSS HA     19 GLY  QA      4.74 
 18 CYSS QB     19 GLY  HN      4.12 
 18 CYSS QB     35 HIS  HE1     3.21 
 19 GLY  HN     20 LYS  QB      5.34 
 20 LYS  HN     20 LYS  QB      2.98 
 20 LYS  HA     20 LYS  QG      3.56 
 20 LYS  HA     20 LYS  QD      4.69 
 20 LYS  QB     21 ALA  HN      3.77 
 20 LYS  QB     22 PHE  QE      3.87 
 20 LYS  QB     22 PHE  HZ      4.04 
 20 LYS  QG     21 ALA  HN      4.01 
 20 LYS  QG     22 PHE  HZ      4.73 
 20 LYS  QD     22 PHE  QE      5.07 
 20 LYS  QD     22 PHE  HZ      4.10 
 20 LYS  QD     31 HIS  HE1     3.72 
 22 PHE  HB2    27 HIS  QB      3.85 
 22 PHE  HB3    27 HIS  QB      3.40 
 22 PHE  QD     27 HIS  QB      3.49 
 22 PHE  QE     31 HIS  QB      4.21 
 22 PHE  HZ     31 HIS  QB      3.65 
 23 HIS  QB     24 ARG  QB      5.22 
 24 ARG  HN     24 ARG  QB      3.46 
 24 ARG  QB     27 HIS  HN      3.47 
 24 ARG  QB     27 HIS  QB      5.18 
 26 THR  HA     29 ASN  QD2     4.69 
 27 HIS  HN     27 HIS  QB      3.37 
 27 HIS  QB     28 LEU  HN      3.96 
 28 LEU  HA     31 HIS  QB      3.83 
 28 LEU  HG     32 ARG  QD      3.85 
 28 LEU  QD1    31 HIS  QB      3.97 
 28 LEU  QD1    32 ARG  QD      4.16 
 28 LEU  QD2    32 ARG  QD      3.97 
 29 ASN  HA     32 ARG  QB      3.78 
 30 GLU  HN     30 GLU  QG      3.86 
 30 GLU  HA     30 GLU  QG      3.55 
 30 GLU  HA     33 ARG  QG      3.81 
 30 GLU  QB     31 HIS  QB      4.27 
 30 GLU  QB     33 ARG  QB      4.91 
 31 HIS  HN     31 HIS  QB      2.81 
 31 HIS  QB     32 ARG  HN      3.31 
 31 HIS  HD2    32 ARG  QB      4.62 
 31 HIS  HD2    32 ARG  QD      4.96 
 32 ARG  HN     32 ARG  QB      3.22 
 32 ARG  HA     35 HIS  QB      4.41 
 32 ARG  QB     32 ARG  QD      3.20 
 32 ARG  QB     33 ARG  HN      3.92 
 33 ARG  HN     33 ARG  QB      3.05 
 33 ARG  HN     33 ARG  QG      3.22 
 33 ARG  HA     33 ARG  QG      3.21 
 33 ARG  QB     33 ARG  QD      3.38 
 33 ARG  QB     34 ILE  HN      3.30 
 34 ILE  HN     34 ILE  QG1     3.53 
 34 ILE  HA     34 ILE  QG1     3.71 
 34 ILE  QG1    35 HIS  HN      3.84 
 34 ILE  QG1    35 HIS  HD2     5.19 
 35 HIS  HN     35 HIS  QB      3.16 
 35 HIS  QB     35 HIS  HD2     3.42 
 35 HIS  QB     36 THR  QG2     4.58 
 38 TYR  QE     40 PRO  QB      4.67 
 39 ARG  QB     40 PRO  QD      3.61 
 40 PRO  QB     41 SER  QB      5.06 
     21   ALA  PHI  -158.00     -98.00
     21   ALA  PSI   118.00     178.00
     22   PHE  PHI  -169.00    -109.00
     22   PHE  PSI   125.00     185.00
     25   HIS  PHI   -88.00     -28.00
     25   HIS  PSI   -73.00     -13.00
     26   THR  PHI   -92.00     -32.00
     26   THR  PSI   -67.00      -7.00
     27   HIS  PHI   -96.00     -36.00
     27   HIS  PSI   -72.00     -12.00
     28   LEU  PHI   -90.00     -30.00
     28   LEU  PSI   -75.00     -15.00
     29   ASN  PHI   -91.00     -31.00
     29   ASN  PSI   -69.00      -9.00
     30   GLU  PHI   -95.00     -35.00
     30   GLU  PSI   -70.00     -10.00
     31   HIS  PHI   -96.00     -36.00
     31   HIS  PSI   -72.00     -12.00
     32   ARG  PHI   -92.00     -32.00
     32   ARG  PSI   -75.00     -15.00
     33   ARG  PHI   -96.00     -36.00
     33   ARG  PSI   -69.00      -9.00
     34   ILE  PHI  -102.00     -42.00
     34   ILE  PSI   -58.00       2.00
     35   HIS  PHI  -129.00     -69.00
     35   HIS  PSI   -35.00      25.00

     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  -0.235 -28.264   4.971
    2    HA2  GLY   1           1HA      GLY   1   0.933 -26.561   2.905
    3    HA3  GLY   1           2HA      GLY   1  -0.806 -26.806   2.842
    4    H    SER   2           H        SER   2  -0.937 -24.479   3.106
    5    HA   SER   2           HA       SER   2  -0.330 -23.534   5.818
    6    HB2  SER   2           1HB      SER   2  -0.729 -22.159   3.184
    7    HB3  SER   2           2HB      SER   2  -1.005 -21.267   4.679
    8    HG   SER   2           HG       SER   2   1.294 -21.724   3.505
    9    H    SER   3           H        SER   3  -1.942 -22.067   6.822
   10    HA   SER   3           HA       SER   3  -4.708 -22.670   6.055
   11    HB2  SER   3           1HB      SER   3  -5.343 -23.319   8.252
   12    HB3  SER   3           2HB      SER   3  -3.870 -24.222   7.898
   13    HG   SER   3           HG       SER   3  -3.409 -23.392   9.821
   14    H    GLY   4           H        GLY   4  -6.181 -21.058   6.470
   15    HA2  GLY   4           1HA      GLY   4  -6.188 -18.997   8.203
   16    HA3  GLY   4           2HA      GLY   4  -5.050 -18.441   6.985
   17    H    SER   5           H        SER   5  -5.945 -17.105   5.579
   18    HA   SER   5           HA       SER   5  -7.646 -15.922   4.549
   19    HB2  SER   5           1HB      SER   5  -8.529 -17.171   2.653
   20    HB3  SER   5           2HB      SER   5  -6.833 -17.590   2.899
   21    HG   SER   5           HG       SER   5  -9.129 -19.126   3.289
   22    H    SER   6           H        SER   6  -8.508 -16.618   7.100
   23    HA   SER   6           HA       SER   6 -11.235 -17.628   6.763
   24    HB2  SER   6           1HB      SER   6  -9.725 -16.965   9.303
   25    HB3  SER   6           2HB      SER   6 -11.300 -17.753   9.207
   26    HG   SER   6           HG       SER   6  -8.761 -18.765   8.686
   27    H    GLY   7           H        GLY   7 -12.900 -16.285   6.596
   28    HA2  GLY   7           1HA      GLY   7 -14.245 -14.463   7.253
   29    HA3  GLY   7           2HA      GLY   7 -12.829 -13.707   7.969
   30    H    SER   8           H        SER   8 -14.217 -14.609   4.825
   31    HA   SER   8           HA       SER   8 -12.570 -13.120   3.177
   32    HB2  SER   8           1HB      SER   8 -14.254 -14.711   2.341
   33    HB3  SER   8           2HB      SER   8 -15.540 -13.609   2.834
   34    HG   SER   8           HG       SER   8 -13.848 -13.500   0.654
   35    H    GLY   9           H        GLY   9 -12.687 -11.042   2.282
   36    HA2  GLY   9           1HA      GLY   9 -14.038  -8.947   2.142
   37    HA3  GLY   9           2HA      GLY   9 -14.288  -9.132   3.871
   38    H    GLU  10           H        GLU  10 -12.190  -7.999   1.397
   39    HA   GLU  10           HA       GLU  10 -10.426  -6.870   3.455
   40    HB2  GLU  10           1HB      GLU  10  -9.446  -8.913   2.233
   41    HB3  GLU  10           2HB      GLU  10  -9.340  -7.860   0.829
   42    HG2  GLU  10           1HG      GLU  10  -8.176  -6.900   3.383
   43    HG3  GLU  10           2HG      GLU  10  -7.326  -8.166   2.500
   44    H    LYS  11           H        LYS  11  -9.923  -4.771   3.173
   45    HA   LYS  11           HA       LYS  11 -11.357  -3.022   1.717
   46    HB2  LYS  11           1HB      LYS  11  -8.544  -2.946   2.705
   47    HB3  LYS  11           2HB      LYS  11  -9.083  -1.652   1.642
   48    HG2  LYS  11           1HG      LYS  11 -10.538  -0.802   3.182
   49    HG3  LYS  11           2HG      LYS  11 -10.783  -2.360   3.975
   50    HD2  LYS  11           1HD      LYS  11  -8.096  -1.062   4.093
   51    HD3  LYS  11           2HD      LYS  11  -9.387  -0.475   5.144
   52    HE2  LYS  11           1HE      LYS  11  -8.860  -3.405   5.004
   53    HE3  LYS  11           2HE      LYS  11  -7.753  -2.387   5.923
   54    HZ1  LYS  11           3HZ      LYS  11  -9.191  -2.498   7.586
   55    HZ2  LYS  11           1HZ      LYS  11 -10.336  -3.303   6.635
   56    HZ3  LYS  11           2HZ      LYS  11 -10.297  -1.612   6.663
   57    HA   PRO  12           HA       PRO  12 -10.475  -3.598  -2.557
   58    HB2  PRO  12           1HB      PRO  12 -11.169  -1.141  -3.479
   59    HB3  PRO  12           2HB      PRO  12 -12.357  -2.343  -2.961
   60    HG2  PRO  12           1HG      PRO  12 -11.269   0.010  -1.466
   61    HG3  PRO  12           2HG      PRO  12 -12.940  -0.573  -1.571
   62    HD2  PRO  12           1HD      PRO  12 -11.350  -1.085   0.560
   63    HD3  PRO  12           2HD      PRO  12 -12.597  -2.219   0.006
   64    H    TYR  13           H        TYR  13  -9.158  -0.776  -0.893
   65    HA   TYR  13           HA       TYR  13  -6.990  -0.638  -2.871
   66    HB2  TYR  13           1HB      TYR  13  -7.603   1.402  -0.734
   67    HB3  TYR  13           2HB      TYR  13  -6.599   1.606  -2.165
   68    HD1  TYR  13           HD1      TYR  13  -7.707   1.625  -4.431
   69    HD2  TYR  13           HD2      TYR  13  -9.922   1.830  -0.804
   70    HE1  TYR  13           HE1      TYR  13  -9.644   2.497  -5.671
   71    HE2  TYR  13           HE2      TYR  13 -11.866   2.701  -2.034
   72    HH   TYR  13           HH       TYR  13 -12.472   2.407  -4.965
   73    H    LYS  14           H        LYS  14  -4.980  -1.218  -2.347
   74    HA   LYS  14           HA       LYS  14  -4.219  -1.385   0.477
   75    HB2  LYS  14           1HB      LYS  14  -5.020  -3.635  -0.478
   76    HB3  LYS  14           2HB      LYS  14  -3.543  -3.612  -1.433
   77    HG2  LYS  14           1HG      LYS  14  -2.457  -3.168   0.943
   78    HG3  LYS  14           2HG      LYS  14  -3.918  -4.000   1.481
   79    HD2  LYS  14           1HD      LYS  14  -3.387  -5.931   0.189
   80    HD3  LYS  14           2HD      LYS  14  -2.077  -5.089  -0.642
   81    HE2  LYS  14           1HE      LYS  14  -0.953  -4.846   1.589
   82    HE3  LYS  14           2HE      LYS  14  -2.191  -5.910   2.255
   83    HZ1  LYS  14           3HZ      LYS  14  -1.295  -7.277   0.095
   84    HZ2  LYS  14           1HZ      LYS  14  -0.806  -7.544   1.693
   85    HZ3  LYS  14           2HZ      LYS  14   0.120  -6.557   0.679
   86    H    CYS  15           H        CYS  15  -2.170  -0.757   0.883
   87    HA   CYS  15           HA       CYS  15  -0.670   0.454  -1.233
   88    HB2  CYS  15           1HB      CYS  15  -0.627   1.532   0.902
   89    HB3  CYS  15           2HB      CYS  15  -0.112   0.053   1.707
   90    H    SER  16           H        SER  16   0.678  -0.559  -2.549
   91    HA   SER  16           HA       SER  16   1.748  -3.168  -1.778
   92    HB2  SER  16           1HB      SER  16   0.583  -2.866  -3.983
   93    HB3  SER  16           2HB      SER  16   1.904  -1.806  -4.475
   94    HG   SER  16           HG       SER  16   2.478  -4.375  -3.499
   95    H    GLU  17           H        GLU  17   2.899  -1.091  -0.394
   96    HA   GLU  17           HA       GLU  17   5.613  -1.068  -1.527
   97    HB2  GLU  17           1HB      GLU  17   4.203   1.233  -0.167
   98    HB3  GLU  17           2HB      GLU  17   5.920   1.206  -0.543
   99    HG2  GLU  17           1HG      GLU  17   3.680   1.048  -2.547
  100    HG3  GLU  17           2HG      GLU  17   4.651   2.475  -2.190
  101    H    CYS  18           H        CYS  18   3.625  -0.729   1.385
  102    HA   CYS  18           HA       CYS  18   5.869  -1.834   2.944
  103    HB2  CYS  18           1HB      CYS  18   4.996  -0.600   4.892
  104    HB3  CYS  18           2HB      CYS  18   5.446   0.484   3.580
  105    H    GLY  19           H        GLY  19   2.337  -1.638   2.664
  106    HA2  GLY  19           1HA      GLY  19   1.304  -3.949   2.659
  107    HA3  GLY  19           2HA      GLY  19   2.164  -4.169   4.176
  108    H    LYS  20           H        LYS  20   0.575  -1.196   3.184
  109    HA   LYS  20           HA       LYS  20  -1.167  -1.425   5.529
  110    HB2  LYS  20           1HB      LYS  20  -0.253   0.901   3.852
  111    HB3  LYS  20           2HB      LYS  20  -1.614   1.049   4.956
  112    HG2  LYS  20           1HG      LYS  20  -0.222   0.537   6.837
  113    HG3  LYS  20           2HG      LYS  20   1.143   0.165   5.782
  114    HD2  LYS  20           1HD      LYS  20   0.947   2.562   4.949
  115    HD3  LYS  20           2HD      LYS  20  -0.130   2.838   6.320
  116    HE2  LYS  20           1HE      LYS  20   2.549   1.588   6.759
  117    HE3  LYS  20           2HE      LYS  20   2.425   3.332   6.533
  118    HZ1  LYS  20           3HZ      LYS  20   2.345   2.759   8.868
  119    HZ2  LYS  20           1HZ      LYS  20   1.016   1.744   8.610
  120    HZ3  LYS  20           2HZ      LYS  20   0.862   3.413   8.385
  121    H    ALA  21           H        ALA  21  -3.399  -0.516   5.293
  122    HA   ALA  21           HA       ALA  21  -4.555  -0.725   2.632
  123    HB1  ALA  21           3HB      ALA  21  -5.122  -2.662   4.843
  124    HB2  ALA  21           1HB      ALA  21  -6.345  -2.295   3.626
  125    HB3  ALA  21           2HB      ALA  21  -4.793  -2.979   3.140
  126    H    PHE  22           H        PHE  22  -6.486   0.368   2.403
  127    HA   PHE  22           HA       PHE  22  -7.701   1.550   4.786
  128    HB2  PHE  22           1HB      PHE  22  -7.105   3.281   2.397
  129    HB3  PHE  22           2HB      PHE  22  -7.561   3.775   4.024
  130    HD1  PHE  22           HD1      PHE  22  -4.826   2.277   2.032
  131    HD2  PHE  22           HD2      PHE  22  -5.936   4.232   5.646
  132    HE1  PHE  22           HE1      PHE  22  -2.449   2.559   2.605
  133    HE2  PHE  22           HE2      PHE  22  -3.561   4.517   6.225
  134    HZ   PHE  22           HZ       PHE  22  -1.815   3.681   4.703
  135    H    HIS  23           H        HIS  23  -9.829   2.478   4.373
  136    HA   HIS  23           HA       HIS  23 -11.262   0.907   2.391
  137    HB2  HIS  23           1HB      HIS  23 -12.095   1.069   4.725
  138    HB3  HIS  23           2HB      HIS  23 -12.339   2.798   4.493
  139    HD1  HIS  23           HD1      HIS  23 -13.831  -0.515   3.734
  140    HD2  HIS  23           HD2      HIS  23 -14.519   3.478   2.817
  141    HE1  HIS  23           HE1      HIS  23 -16.143  -0.441   2.749
  142    H    ARG  24           H        ARG  24 -10.511   4.266   3.106
  143    HA   ARG  24           HA       ARG  24 -11.979   5.114   0.712
  144    HB2  ARG  24           1HB      ARG  24 -10.825   6.702   3.009
  145    HB3  ARG  24           2HB      ARG  24 -11.591   7.422   1.599
  146    HG2  ARG  24           1HG      ARG  24 -13.363   7.409   3.013
  147    HG3  ARG  24           2HG      ARG  24 -13.565   5.808   2.300
  148    HD2  ARG  24           1HD      ARG  24 -12.370   4.817   4.192
  149    HD3  ARG  24           2HD      ARG  24 -12.166   6.419   4.901
  150    HE   ARG  24           HE       ARG  24 -14.895   5.984   4.461
  151   HH11  ARG  24          1HH1      ARG  24 -12.303   4.793   6.456
  152   HH12  ARG  24          2HH1      ARG  24 -13.342   4.348   7.769
  153   HH21  ARG  24          1HH2      ARG  24 -16.274   5.403   6.182
  154   HH22  ARG  24          2HH2      ARG  24 -15.601   4.695   7.612
  155    H    HIS  25           H        HIS  25 -10.766   4.971  -1.067
  156    HA   HIS  25           HA       HIS  25  -8.117   4.747  -1.430
  157    HB2  HIS  25           1HB      HIS  25  -9.414   4.656  -3.378
  158    HB3  HIS  25           2HB      HIS  25 -10.155   6.224  -3.072
  159    HD1  HIS  25           HD1      HIS  25  -8.318   8.298  -3.227
  160    HD2  HIS  25           HD2      HIS  25  -7.437   4.759  -5.217
  161    HE1  HIS  25           HE1      HIS  25  -6.573   8.903  -4.933
  162    H    THR  26           H        THR  26  -9.817   7.809  -0.918
  163    HA   THR  26           HA       THR  26  -7.894   9.670  -1.370
  164    HB   THR  26           HB       THR  26  -9.743   9.630   1.024
  165    HG1  THR  26           HG1      THR  26 -10.815   9.494  -1.015
  166   HG21  THR  26          3HG2      THR  26  -8.021  11.286   1.346
  167   HG22  THR  26          1HG2      THR  26  -9.517  12.106   0.900
  168   HG23  THR  26          2HG2      THR  26  -8.239  11.891  -0.296
  169    H    HIS  27           H        HIS  27  -8.371   8.151   1.827
  170    HA   HIS  27           HA       HIS  27  -6.153   9.158   3.103
  171    HB2  HIS  27           1HB      HIS  27  -7.474   6.458   3.406
  172    HB3  HIS  27           2HB      HIS  27  -6.240   7.063   4.507
  173    HD1  HIS  27           HD1      HIS  27  -9.079   6.417   5.508
  174    HD2  HIS  27           HD2      HIS  27  -7.829  10.188   4.293
  175    HE1  HIS  27           HE1      HIS  27 -10.631   8.038   6.642
  176    H    LEU  28           H        LEU  28  -6.335   6.015   1.423
  177    HA   LEU  28           HA       LEU  28  -3.784   5.125   1.685
  178    HB2  LEU  28           1HB      LEU  28  -5.319   3.764   0.538
  179    HB3  LEU  28           2HB      LEU  28  -5.642   5.007  -0.668
  180    HG   LEU  28           HG       LEU  28  -3.278   4.669  -1.481
  181   HD11  LEU  28          1HD1      LEU  28  -2.845   2.038  -0.700
  182   HD12  LEU  28          2HD1      LEU  28  -3.269   2.884   0.787
  183   HD13  LEU  28          3HD1      LEU  28  -1.927   3.459  -0.200
  184   HD21  LEU  28          3HD2      LEU  28  -5.620   3.357  -2.095
  185   HD22  LEU  28          1HD2      LEU  28  -4.462   2.043  -1.887
  186   HD23  LEU  28          2HD2      LEU  28  -4.135   3.331  -3.047
  187    H    ASN  29           H        ASN  29  -4.896   7.292  -0.919
  188    HA   ASN  29           HA       ASN  29  -2.447   7.688  -2.165
  189    HB2  ASN  29           1HB      ASN  29  -4.703   8.437  -3.000
  190    HB3  ASN  29           2HB      ASN  29  -4.603   9.787  -1.874
  191   HD21  ASN  29          1HD2      ASN  29  -4.526  11.400  -3.355
  192   HD22  ASN  29          2HD2      ASN  29  -3.218  11.629  -4.460
  193    H    GLU  30           H        GLU  30  -3.946   9.594   0.439
  194    HA   GLU  30           HA       GLU  30  -1.976  11.530   0.719
  195    HB2  GLU  30           1HB      GLU  30  -4.306  11.198   1.903
  196    HB3  GLU  30           2HB      GLU  30  -3.330  10.434   3.149
  197    HG2  GLU  30           1HG      GLU  30  -2.568  13.130   2.134
  198    HG3  GLU  30           2HG      GLU  30  -3.893  12.969   3.285
  199    H    HIS  31           H        HIS  31  -2.050   8.220   1.828
  200    HA   HIS  31           HA       HIS  31   0.149   8.441   3.631
  201    HB2  HIS  31           1HB      HIS  31  -1.197   6.602   4.091
  202    HB3  HIS  31           2HB      HIS  31  -1.358   6.167   2.392
  203    HD1  HIS  31           HD1      HIS  31   1.407   6.255   5.010
  204    HD2  HIS  31           HD2      HIS  31   0.180   4.055   1.706
  205    HE1  HIS  31           HE1      HIS  31   3.018   4.330   4.848
  206    H    ARG  32           H        ARG  32  -0.143   6.974   0.392
  207    HA   ARG  32           HA       ARG  32   2.382   6.175  -0.111
  208    HB2  ARG  32           1HB      ARG  32   0.343   7.487  -1.862
  209    HB3  ARG  32           2HB      ARG  32   1.942   7.156  -2.513
  210    HG2  ARG  32           1HG      ARG  32   1.653   4.887  -2.449
  211    HG3  ARG  32           2HG      ARG  32   0.481   4.964  -1.132
  212    HD2  ARG  32           1HD      ARG  32  -1.050   6.130  -2.826
  213    HD3  ARG  32           2HD      ARG  32   0.073   5.538  -4.050
  214    HE   ARG  32           HE       ARG  32  -1.840   3.992  -2.549
  215   HH11  ARG  32          1HH1      ARG  32   1.099   3.920  -4.415
  216   HH12  ARG  32          2HH1      ARG  32   0.940   2.249  -4.843
  217   HH21  ARG  32          1HH2      ARG  32  -2.060   1.791  -3.106
  218   HH22  ARG  32          2HH2      ARG  32  -0.857   1.039  -4.099
  219    H    ARG  33           H        ARG  33   1.289   9.481   0.134
  220    HA   ARG  33           HA       ARG  33   3.211  10.953  -1.088
  221    HB2  ARG  33           1HB      ARG  33   1.797  11.342   1.529
  222    HB3  ARG  33           2HB      ARG  33   3.007  12.503   0.999
  223    HG2  ARG  33           1HG      ARG  33   1.745  12.966  -1.005
  224    HG3  ARG  33           2HG      ARG  33   0.567  11.722  -0.581
  225    HD2  ARG  33           1HD      ARG  33  -0.494  13.640   0.137
  226    HD3  ARG  33           2HD      ARG  33   0.306  13.096   1.611
  227    HE   ARG  33           HE       ARG  33   1.488  15.039   1.589
  228   HH11  ARG  33          1HH1      ARG  33   0.453  14.351  -1.663
  229   HH12  ARG  33          2HH1      ARG  33   1.099  15.819  -2.318
  230   HH21  ARG  33          1HH2      ARG  33   2.342  16.976   0.739
  231   HH22  ARG  33          2HH2      ARG  33   2.174  17.311  -0.951
  232    H    ILE  34           H        ILE  34   3.520   9.304   2.027
  233    HA   ILE  34           HA       ILE  34   6.158  10.263   2.545
  234    HB   ILE  34           HB       ILE  34   6.187   8.852   4.430
  235   HG12  ILE  34          1HG1      ILE  34   4.156   7.124   4.557
  236   HG13  ILE  34          2HG1      ILE  34   4.332   7.179   2.807
  237   HG21  ILE  34          1HG2      ILE  34   3.564  10.063   3.768
  238   HG22  ILE  34          2HG2      ILE  34   3.644   9.023   5.190
  239   HG23  ILE  34          3HG2      ILE  34   4.691  10.438   5.072
  240   HD11  ILE  34          3HD1      ILE  34   5.976   5.876   4.807
  241   HD12  ILE  34          1HD1      ILE  34   5.860   5.591   3.071
  242   HD13  ILE  34          2HD1      ILE  34   6.915   6.863   3.687
  243    H    HIS  35           H        HIS  35   4.816   7.548   0.831
  244    HA   HIS  35           HA       HIS  35   7.195   5.979   0.764
  245    HB2  HIS  35           1HB      HIS  35   4.545   5.914  -0.591
  246    HB3  HIS  35           2HB      HIS  35   5.869   5.038  -1.354
  247    HD1  HIS  35           HD1      HIS  35   7.228   3.515   0.673
  248    HD2  HIS  35           HD2      HIS  35   3.154   4.258   1.008
  249    HE1  HIS  35           HE1      HIS  35   6.348   1.747   2.230
  250    H    THR  36           H        THR  36   5.881   8.550  -1.200
  251    HA   THR  36           HA       THR  36   7.789   8.163  -3.337
  252    HB   THR  36           HB       THR  36   5.502   9.054  -3.768
  253    HG1  THR  36           HG1      THR  36   6.463  11.018  -4.965
  254   HG21  THR  36          3HG2      THR  36   5.478  11.670  -3.327
  255   HG22  THR  36          1HG2      THR  36   6.513  11.204  -1.978
  256   HG23  THR  36          2HG2      THR  36   4.892  10.523  -2.122
  257    H    GLY  37           H        GLY  37   8.930   8.571  -0.730
  258    HA2  GLY  37           1HA      GLY  37  10.361   9.981   0.441
  259    HA3  GLY  37           2HA      GLY  37  11.111  10.065  -1.146
  260    H    TYR  38           H        TYR  38   8.996  11.671   1.124
  261    HA   TYR  38           HA       TYR  38   8.742  14.007  -0.592
  262    HB2  TYR  38           1HB      TYR  38   6.830  13.158   0.800
  263    HB3  TYR  38           2HB      TYR  38   7.732  13.638   2.233
  264    HD1  TYR  38           HD2      TYR  38   8.229  16.058   2.616
  265    HD2  TYR  38           HD1      TYR  38   5.623  14.750  -0.483
  266    HE1  TYR  38           HE2      TYR  38   7.300  18.329   2.447
  267    HE2  TYR  38           HE1      TYR  38   4.688  17.018  -0.662
  268    HH   TYR  38           HH       TYR  38   5.026  19.331   1.624
  269    H    ARG  39           H        ARG  39  10.792  14.874  -0.706
  270    HA   ARG  39           HA       ARG  39  11.972  15.780   1.836
  271    HB2  ARG  39           1HB      ARG  39  13.328  15.364  -0.835
  272    HB3  ARG  39           2HB      ARG  39  14.115  15.889   0.647
  273    HG2  ARG  39           1HG      ARG  39  13.990  13.805   1.614
  274    HG3  ARG  39           2HG      ARG  39  12.627  13.306   0.611
  275    HD2  ARG  39           1HD      ARG  39  13.978  12.867  -1.227
  276    HD3  ARG  39           2HD      ARG  39  15.290  13.879  -0.625
  277    HE   ARG  39           HE       ARG  39  14.718  11.567   1.001
  278   HH11  ARG  39          1HH1      ARG  39  16.547  12.842  -1.673
  279   HH12  ARG  39          2HH1      ARG  39  17.795  11.646  -1.559
  280   HH21  ARG  39          1HH2      ARG  39  16.354   9.986   1.161
  281   HH22  ARG  39          2HH2      ARG  39  17.684  10.021   0.052
  282    HA   PRO  40           HA       PRO  40  11.136  19.946   0.688
  283    HB2  PRO  40           1HB      PRO  40  13.041  21.195   2.164
  284    HB3  PRO  40           2HB      PRO  40  11.590  20.481   2.876
  285    HG2  PRO  40           1HG      PRO  40  14.363  19.366   2.711
  286    HG3  PRO  40           2HG      PRO  40  13.228  19.347   4.074
  287    HD2  PRO  40           1HD      PRO  40  13.609  17.203   2.464
  288    HD3  PRO  40           2HD      PRO  40  12.046  17.559   3.227
  289    H    SER  41           H        SER  41  14.619  19.169   0.820
  290    HA   SER  41           HA       SER  41  15.266  21.134  -1.170
  291    HB2  SER  41           1HB      SER  41  16.933  18.912   0.037
  292    HB3  SER  41           2HB      SER  41  17.556  20.187  -1.010
  293    HG   SER  41           HG       SER  41  16.984  20.255   1.644
  294    H    GLY  42           H        GLY  42  15.420  20.894  -3.316
  295    HA2  GLY  42           1HA      GLY  42  14.826  18.237  -4.421
  296    HA3  GLY  42           2HA      GLY  42  14.610  19.768  -5.257
  297    HA   PRO  43           HA       PRO  43  18.491  17.788  -6.839
  298    HB2  PRO  43           1HB      PRO  43  17.932  18.240  -9.457
  299    HB3  PRO  43           2HB      PRO  43  17.365  16.810  -8.587
  300    HG2  PRO  43           1HG      PRO  43  15.900  19.340  -9.231
  301    HG3  PRO  43           2HG      PRO  43  15.334  17.663  -9.333
  302    HD2  PRO  43           1HD      PRO  43  14.701  19.290  -7.263
  303    HD3  PRO  43           2HD      PRO  43  14.905  17.537  -7.072
  304    H    SER  44           H        SER  44  16.925  20.849  -7.157
  305    HA   SER  44           HA       SER  44  19.526  22.094  -7.746
  306    HB2  SER  44           1HB      SER  44  17.854  22.081  -9.702
  307    HB3  SER  44           2HB      SER  44  16.926  23.242  -8.753
  308    HG   SER  44           HG       SER  44  18.368  24.734  -9.157
  309    H    SER  45           H        SER  45  19.477  24.495  -7.187
  310    HA   SER  45           HA       SER  45  17.952  24.878  -4.693
  311    HB2  SER  45           1HB      SER  45  20.422  24.531  -4.379
  312    HB3  SER  45           2HB      SER  45  20.691  26.013  -5.296
  313    HG   SER  45           HG       SER  45  20.448  26.970  -3.447
  314    H    GLY  46           H        GLY  46  16.494  26.440  -4.848
  315    HA2  GLY  46           1HA      GLY  46  17.185  28.973  -6.078
  316    HA3  GLY  46           2HA      GLY  46  15.914  28.080  -6.898
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1  -1.036 -16.588  18.384
    2    HA2  GLY   1           1HA      GLY   1  -2.627 -16.033  16.599
    3    HA3  GLY   1           2HA      GLY   1  -1.046 -15.368  16.211
    4    H    SER   2           H        SER   2  -2.316 -18.687  16.042
    5    HA   SER   2           HA       SER   2  -1.096 -19.092  13.479
    6    HB2  SER   2           1HB      SER   2  -1.298 -20.914  15.143
    7    HB3  SER   2           2HB      SER   2  -3.053 -20.854  14.975
    8    HG   SER   2           HG       SER   2  -1.560 -21.149  12.644
    9    H    SER   3           H        SER   3  -4.482 -19.137  14.600
   10    HA   SER   3           HA       SER   3  -5.589 -19.251  11.998
   11    HB2  SER   3           1HB      SER   3  -7.724 -18.759  13.091
   12    HB3  SER   3           2HB      SER   3  -6.822 -19.956  14.020
   13    HG   SER   3           HG       SER   3  -7.641 -18.383  15.406
   14    H    GLY   4           H        GLY   4  -7.144 -17.516  11.198
   15    HA2  GLY   4           1HA      GLY   4  -5.853 -14.874  11.496
   16    HA3  GLY   4           2HA      GLY   4  -6.481 -15.473   9.968
   17    H    SER   5           H        SER   5  -8.589 -15.163   9.467
   18    HA   SER   5           HA       SER   5 -10.656 -14.213   9.539
   19    HB2  SER   5           1HB      SER   5 -10.528 -15.037  12.450
   20    HB3  SER   5           2HB      SER   5 -11.992 -14.621  11.560
   21    HG   SER   5           HG       SER   5 -11.005 -16.420  10.085
   22    H    SER   6           H        SER   6  -8.648 -12.375   9.657
   23    HA   SER   6           HA       SER   6  -9.427 -10.465  11.744
   24    HB2  SER   6           1HB      SER   6  -7.026 -10.548   9.905
   25    HB3  SER   6           2HB      SER   6  -7.370  -9.220  11.015
   26    HG   SER   6           HG       SER   6  -6.100 -11.457  11.546
   27    H    GLY   7           H        GLY   7 -11.335  -9.652  10.904
   28    HA2  GLY   7           1HA      GLY   7 -12.504  -8.012   9.767
   29    HA3  GLY   7           2HA      GLY   7 -11.027  -7.616   8.899
   30    H    SER   8           H        SER   8 -11.819  -7.528   6.851
   31    HA   SER   8           HA       SER   8 -12.469 -10.071   5.615
   32    HB2  SER   8           1HB      SER   8 -14.570  -9.458   4.721
   33    HB3  SER   8           2HB      SER   8 -14.646  -8.968   6.413
   34    HG   SER   8           HG       SER   8 -15.172  -7.103   5.593
   35    H    GLY   9           H        GLY   9 -12.710  -9.783   3.181
   36    HA2  GLY   9           1HA      GLY   9 -10.425  -8.407   2.212
   37    HA3  GLY   9           2HA      GLY   9 -11.642  -9.207   1.229
   38    H    GLU  10           H        GLU  10 -12.056  -7.730  -0.315
   39    HA   GLU  10           HA       GLU  10 -12.770  -5.815  -1.318
   40    HB2  GLU  10           1HB      GLU  10 -14.230  -5.669   1.313
   41    HB3  GLU  10           2HB      GLU  10 -14.461  -4.470   0.049
   42    HG2  GLU  10           1HG      GLU  10 -15.492  -5.967  -1.372
   43    HG3  GLU  10           2HG      GLU  10 -14.785  -7.370  -0.573
   44    H    LYS  11           H        LYS  11 -10.237  -5.601  -0.329
   45    HA   LYS  11           HA       LYS  11 -10.159  -2.807   0.601
   46    HB2  LYS  11           1HB      LYS  11  -8.638  -5.191   1.559
   47    HB3  LYS  11           2HB      LYS  11  -7.826  -3.631   1.549
   48    HG2  LYS  11           1HG      LYS  11 -10.484  -4.072   2.878
   49    HG3  LYS  11           2HG      LYS  11  -8.942  -4.296   3.707
   50    HD2  LYS  11           1HD      LYS  11  -8.399  -1.913   2.924
   51    HD3  LYS  11           2HD      LYS  11 -10.126  -1.774   2.584
   52    HE2  LYS  11           1HE      LYS  11  -9.759  -0.901   4.768
   53    HE3  LYS  11           2HE      LYS  11 -10.554  -2.463   4.954
   54    HZ1  LYS  11           3HZ      LYS  11  -7.832  -1.669   5.651
   55    HZ2  LYS  11           1HZ      LYS  11  -8.054  -3.250   5.092
   56    HZ3  LYS  11           2HZ      LYS  11  -8.895  -2.710   6.456
   57    HA   PRO  12           HA       PRO  12  -7.943  -3.296  -3.467
   58    HB2  PRO  12           1HB      PRO  12  -9.143  -1.170  -4.655
   59    HB3  PRO  12           2HB      PRO  12  -9.835  -2.797  -4.671
   60    HG2  PRO  12           1HG      PRO  12 -10.502  -0.472  -2.908
   61    HG3  PRO  12           2HG      PRO  12 -11.593  -1.618  -3.709
   62    HD2  PRO  12           1HD      PRO  12 -10.936  -1.819  -1.089
   63    HD3  PRO  12           2HD      PRO  12 -11.275  -3.238  -2.101
   64    H    TYR  13           H        TYR  13  -8.328  -0.897  -1.054
   65    HA   TYR  13           HA       TYR  13  -6.269   0.829  -2.205
   66    HB2  TYR  13           1HB      TYR  13  -7.542   1.350   0.452
   67    HB3  TYR  13           2HB      TYR  13  -6.975   2.496  -0.758
   68    HD1  TYR  13           HD2      TYR  13  -9.672   0.057  -0.018
   69    HD2  TYR  13           HD1      TYR  13  -8.458   3.410  -2.338
   70    HE1  TYR  13           HE2      TYR  13 -11.973   0.306  -0.851
   71    HE2  TYR  13           HE1      TYR  13 -10.755   3.669  -3.177
   72    HH   TYR  13           HH       TYR  13 -13.191   2.921  -2.132
   73    H    LYS  14           H        LYS  14  -5.379  -1.706  -1.488
   74    HA   LYS  14           HA       LYS  14  -3.997  -1.362   1.070
   75    HB2  LYS  14           1HB      LYS  14  -4.915  -3.508   0.975
   76    HB3  LYS  14           2HB      LYS  14  -4.517  -3.708  -0.726
   77    HG2  LYS  14           1HG      LYS  14  -2.377  -4.354  -0.296
   78    HG3  LYS  14           2HG      LYS  14  -2.275  -3.417   1.196
   79    HD2  LYS  14           1HD      LYS  14  -3.469  -5.032   2.418
   80    HD3  LYS  14           2HD      LYS  14  -4.056  -5.825   0.954
   81    HE2  LYS  14           1HE      LYS  14  -1.667  -6.414   0.443
   82    HE3  LYS  14           2HE      LYS  14  -1.249  -5.822   2.050
   83    HZ1  LYS  14           3HZ      LYS  14  -2.489  -7.511   3.063
   84    HZ2  LYS  14           1HZ      LYS  14  -1.659  -8.291   1.811
   85    HZ3  LYS  14           2HZ      LYS  14  -3.298  -7.915   1.634
   86    H    CYS  15           H        CYS  15  -1.942  -0.744   1.174
   87    HA   CYS  15           HA       CYS  15  -0.456  -0.303  -1.267
   88    HB2  CYS  15           1HB      CYS  15  -0.387   1.408   0.454
   89    HB3  CYS  15           2HB      CYS  15   0.224   0.248   1.628
   90    H    SER  16           H        SER  16   1.177  -1.498  -2.040
   91    HA   SER  16           HA       SER  16   1.807  -3.987  -0.664
   92    HB2  SER  16           1HB      SER  16   2.251  -2.967  -3.459
   93    HB3  SER  16           2HB      SER  16   3.111  -4.390  -2.870
   94    HG   SER  16           HG       SER  16   1.366  -5.441  -3.350
   95    H    GLU  17           H        GLU  17   3.229  -0.920  -1.399
   96    HA   GLU  17           HA       GLU  17   5.943  -1.495  -1.266
   97    HB2  GLU  17           1HB      GLU  17   4.513   0.962  -0.235
   98    HB3  GLU  17           2HB      GLU  17   6.238   0.846  -0.551
   99    HG2  GLU  17           1HG      GLU  17   4.076   0.525  -2.619
  100    HG3  GLU  17           2HG      GLU  17   5.013   1.992  -2.342
  101    H    CYS  18           H        CYS  18   3.842  -0.416   1.410
  102    HA   CYS  18           HA       CYS  18   5.830  -1.451   3.306
  103    HB2  CYS  18           1HB      CYS  18   4.608  -0.111   4.995
  104    HB3  CYS  18           2HB      CYS  18   5.210   0.870   3.663
  105    H    GLY  19           H        GLY  19   2.388  -1.602   2.495
  106    HA2  GLY  19           1HA      GLY  19   1.296  -3.775   2.604
  107    HA3  GLY  19           2HA      GLY  19   2.243  -4.110   4.046
  108    H    LYS  20           H        LYS  20   0.274  -1.304   3.086
  109    HA   LYS  20           HA       LYS  20  -1.210  -1.619   5.611
  110    HB2  LYS  20           1HB      LYS  20  -0.248   0.769   4.108
  111    HB3  LYS  20           2HB      LYS  20  -1.758   0.911   4.999
  112    HG2  LYS  20           1HG      LYS  20  -0.409  -0.052   6.980
  113    HG3  LYS  20           2HG      LYS  20   1.003   0.420   6.032
  114    HD2  LYS  20           1HD      LYS  20   0.404   2.697   6.081
  115    HD3  LYS  20           2HD      LYS  20  -1.238   2.336   6.619
  116    HE2  LYS  20           1HE      LYS  20  -0.307   1.497   8.753
  117    HE3  LYS  20           2HE      LYS  20   1.299   1.979   8.211
  118    HZ1  LYS  20           3HZ      LYS  20   0.851   3.927   9.153
  119    HZ2  LYS  20           1HZ      LYS  20  -0.795   3.575   9.325
  120    HZ3  LYS  20           2HZ      LYS  20  -0.215   4.218   7.872
  121    H    ALA  21           H        ALA  21  -3.461  -0.616   5.500
  122    HA   ALA  21           HA       ALA  21  -4.729  -0.890   2.885
  123    HB1  ALA  21           3HB      ALA  21  -4.920  -3.122   3.683
  124    HB2  ALA  21           1HB      ALA  21  -5.443  -2.574   5.276
  125    HB3  ALA  21           2HB      ALA  21  -6.500  -2.364   3.879
  126    H    PHE  22           H        PHE  22  -6.328   0.545   2.592
  127    HA   PHE  22           HA       PHE  22  -7.398   1.920   4.968
  128    HB2  PHE  22           1HB      PHE  22  -6.953   3.216   2.277
  129    HB3  PHE  22           2HB      PHE  22  -7.392   4.005   3.789
  130    HD1  PHE  22           HD1      PHE  22  -4.676   2.220   2.033
  131    HD2  PHE  22           HD2      PHE  22  -5.749   4.699   5.323
  132    HE1  PHE  22           HE1      PHE  22  -2.294   2.605   2.516
  133    HE2  PHE  22           HE2      PHE  22  -3.369   5.088   5.810
  134    HZ   PHE  22           HZ       PHE  22  -1.638   4.041   4.405
  135    H    HIS  23           H        HIS  23  -9.545   2.812   4.731
  136    HA   HIS  23           HA       HIS  23 -11.278   1.022   3.284
  137    HB2  HIS  23           1HB      HIS  23 -11.932   1.702   5.511
  138    HB3  HIS  23           2HB      HIS  23 -11.861   3.402   5.056
  139    HD1  HIS  23           HD1      HIS  23 -14.234   4.131   5.224
  140    HD2  HIS  23           HD2      HIS  23 -13.836   0.555   3.147
  141    HE1  HIS  23           HE1      HIS  23 -16.529   3.608   4.340
  142    H    ARG  24           H        ARG  24 -10.650   4.525   3.247
  143    HA   ARG  24           HA       ARG  24 -12.077   4.713   0.691
  144    HB2  ARG  24           1HB      ARG  24 -11.130   6.878   2.578
  145    HB3  ARG  24           2HB      ARG  24 -11.990   7.160   1.070
  146    HG2  ARG  24           1HG      ARG  24 -13.958   6.108   1.909
  147    HG3  ARG  24           2HG      ARG  24 -13.107   5.549   3.350
  148    HD2  ARG  24           1HD      ARG  24 -12.691   7.984   3.888
  149    HD3  ARG  24           2HD      ARG  24 -13.830   8.372   2.600
  150    HE   ARG  24           HE       ARG  24 -14.458   7.434   5.224
  151   HH11  ARG  24          1HH1      ARG  24 -15.516   7.441   1.907
  152   HH12  ARG  24          2HH1      ARG  24 -17.186   7.205   2.303
  153   HH21  ARG  24          1HH2      ARG  24 -16.654   7.124   5.757
  154   HH22  ARG  24          2HH2      ARG  24 -17.833   7.026   4.493
  155    H    HIS  25           H        HIS  25 -11.124   6.109  -0.992
  156    HA   HIS  25           HA       HIS  25  -8.430   5.325  -1.525
  157    HB2  HIS  25           1HB      HIS  25 -10.232   5.622  -3.262
  158    HB3  HIS  25           2HB      HIS  25 -10.076   7.361  -3.034
  159    HD1  HIS  25           HD1      HIS  25  -9.524   6.654  -5.777
  160    HD2  HIS  25           HD2      HIS  25  -6.575   6.259  -2.878
  161    HE1  HIS  25           HE1      HIS  25  -7.345   6.653  -7.032
  162    H    THR  26           H        THR  26 -10.004   8.426  -0.811
  163    HA   THR  26           HA       THR  26  -7.972  10.203  -1.088
  164    HB   THR  26           HB       THR  26  -9.825  10.162   1.301
  165    HG1  THR  26           HG1      THR  26 -10.226  10.746  -1.403
  166   HG21  THR  26          3HG2      THR  26  -8.460  11.914   1.804
  167   HG22  THR  26          1HG2      THR  26  -9.544  12.749   0.693
  168   HG23  THR  26          2HG2      THR  26  -7.979  12.164   0.126
  169    H    HIS  27           H        HIS  27  -8.510   8.112   1.734
  170    HA   HIS  27           HA       HIS  27  -6.366   9.036   3.283
  171    HB2  HIS  27           1HB      HIS  27  -7.975   6.518   3.215
  172    HB3  HIS  27           2HB      HIS  27  -6.517   6.565   4.200
  173    HD1  HIS  27           HD1      HIS  27  -8.069   6.325   6.309
  174    HD2  HIS  27           HD2      HIS  27  -8.578   9.831   4.139
  175    HE1  HIS  27           HE1      HIS  27  -9.372   7.863   7.812
  176    H    LEU  28           H        LEU  28  -6.528   6.136   1.211
  177    HA   LEU  28           HA       LEU  28  -3.911   5.296   1.467
  178    HB2  LEU  28           1HB      LEU  28  -5.539   3.941   0.351
  179    HB3  LEU  28           2HB      LEU  28  -5.759   5.156  -0.907
  180    HG   LEU  28           HG       LEU  28  -3.320   4.714  -1.521
  181   HD11  LEU  28          1HD1      LEU  28  -3.728   2.074  -0.179
  182   HD12  LEU  28          2HD1      LEU  28  -3.016   3.424   0.704
  183   HD13  LEU  28          3HD1      LEU  28  -2.238   2.819  -0.758
  184   HD21  LEU  28          3HD2      LEU  28  -5.736   3.434  -2.236
  185   HD22  LEU  28          1HD2      LEU  28  -4.476   2.200  -2.199
  186   HD23  LEU  28          2HD2      LEU  28  -4.275   3.634  -3.206
  187    H    ASN  29           H        ASN  29  -5.216   7.399  -1.103
  188    HA   ASN  29           HA       ASN  29  -2.956   7.945  -2.520
  189    HB2  ASN  29           1HB      ASN  29  -5.398   8.862  -2.750
  190    HB3  ASN  29           2HB      ASN  29  -4.777  10.222  -1.818
  191   HD21  ASN  29          1HD2      ASN  29  -4.665  11.801  -3.275
  192   HD22  ASN  29          2HD2      ASN  29  -3.781  11.725  -4.757
  193    H    GLU  30           H        GLU  30  -4.008   9.608   0.440
  194    HA   GLU  30           HA       GLU  30  -1.884  11.431   0.588
  195    HB2  GLU  30           1HB      GLU  30  -3.701  10.247   2.676
  196    HB3  GLU  30           2HB      GLU  30  -2.448  11.408   3.093
  197    HG2  GLU  30           1HG      GLU  30  -4.452  12.026   0.963
  198    HG3  GLU  30           2HG      GLU  30  -4.845  12.244   2.668
  199    H    HIS  31           H        HIS  31  -2.303   8.326   2.292
  200    HA   HIS  31           HA       HIS  31   0.087   8.213   3.640
  201    HB2  HIS  31           1HB      HIS  31  -1.293   6.452   4.180
  202    HB3  HIS  31           2HB      HIS  31  -1.736   6.144   2.503
  203    HD1  HIS  31           HD1      HIS  31   0.777   5.260   5.101
  204    HD2  HIS  31           HD2      HIS  31   0.039   4.468   1.089
  205    HE1  HIS  31           HE1      HIS  31   2.280   3.333   4.508
  206    H    ARG  32           H        ARG  32  -0.540   6.985   0.354
  207    HA   ARG  32           HA       ARG  32   1.822   5.919  -0.367
  208    HB2  ARG  32           1HB      ARG  32   0.131   7.824  -1.991
  209    HB3  ARG  32           2HB      ARG  32   1.440   6.863  -2.665
  210    HG2  ARG  32           1HG      ARG  32   0.279   4.816  -2.021
  211    HG3  ARG  32           2HG      ARG  32  -1.031   5.776  -1.331
  212    HD2  ARG  32           1HD      ARG  32  -1.866   5.254  -3.420
  213    HD3  ARG  32           2HD      ARG  32  -1.146   6.840  -3.698
  214    HE   ARG  32           HE       ARG  32   0.419   5.862  -5.066
  215   HH11  ARG  32          1HH1      ARG  32  -1.273   3.398  -3.280
  216   HH12  ARG  32          2HH1      ARG  32  -0.599   2.090  -4.194
  217   HH21  ARG  32          1HH2      ARG  32   1.312   4.148  -6.276
  218   HH22  ARG  32          2HH2      ARG  32   0.872   2.517  -5.897
  219    H    ARG  33           H        ARG  33   1.259   9.254   0.379
  220    HA   ARG  33           HA       ARG  33   3.319  10.564  -0.879
  221    HB2  ARG  33           1HB      ARG  33   2.137  10.943   1.866
  222    HB3  ARG  33           2HB      ARG  33   3.370  12.021   1.226
  223    HG2  ARG  33           1HG      ARG  33   1.964  12.824  -0.457
  224    HG3  ARG  33           2HG      ARG  33   0.836  11.479  -0.276
  225    HD2  ARG  33           1HD      ARG  33  -0.157  12.380   1.579
  226    HD3  ARG  33           2HD      ARG  33   1.297  13.252   2.065
  227    HE   ARG  33           HE       ARG  33  -0.802  14.208   0.365
  228   HH11  ARG  33          1HH1      ARG  33   2.582  14.490   1.133
  229   HH12  ARG  33          2HH1      ARG  33   2.717  16.110   0.533
  230   HH21  ARG  33          1HH2      ARG  33  -0.637  16.340  -0.429
  231   HH22  ARG  33          2HH2      ARG  33   0.885  17.161  -0.354
  232    H    ILE  34           H        ILE  34   3.471   8.885   2.257
  233    HA   ILE  34           HA       ILE  34   6.102   9.364   2.915
  234    HB   ILE  34           HB       ILE  34   6.057   7.369   4.266
  235   HG12  ILE  34          1HG1      ILE  34   3.414   6.513   3.173
  236   HG13  ILE  34          2HG1      ILE  34   4.865   6.097   2.267
  237   HG21  ILE  34          1HG2      ILE  34   4.760   8.556   5.622
  238   HG22  ILE  34          2HG2      ILE  34   3.964   9.329   4.252
  239   HG23  ILE  34          3HG2      ILE  34   3.353   7.798   4.878
  240   HD11  ILE  34          3HD1      ILE  34   5.612   5.305   4.718
  241   HD12  ILE  34          1HD1      ILE  34   3.869   5.062   4.832
  242   HD13  ILE  34          2HD1      ILE  34   4.789   4.261   3.558
  243    H    HIS  35           H        HIS  35   4.886   7.518   0.310
  244    HA   HIS  35           HA       HIS  35   7.434   6.118  -0.060
  245    HB2  HIS  35           1HB      HIS  35   4.784   5.803  -1.483
  246    HB3  HIS  35           2HB      HIS  35   6.231   4.863  -1.834
  247    HD1  HIS  35           HD1      HIS  35   7.193   3.768   0.663
  248    HD2  HIS  35           HD2      HIS  35   3.124   4.343   0.050
  249    HE1  HIS  35           HE1      HIS  35   6.044   2.234   2.291
  250    H    THR  36           H        THR  36   5.376   8.567  -1.475
  251    HA   THR  36           HA       THR  36   7.224   8.886  -3.729
  252    HB   THR  36           HB       THR  36   5.527  10.406  -4.675
  253    HG1  THR  36           HG1      THR  36   3.681   9.613  -2.714
  254   HG21  THR  36          3HG2      THR  36   4.295   7.793  -3.802
  255   HG22  THR  36          1HG2      THR  36   5.467   7.950  -5.110
  256   HG23  THR  36          2HG2      THR  36   3.892   8.734  -5.238
  257    H    GLY  37           H        GLY  37   8.963   9.976  -2.894
  258    HA2  GLY  37           1HA      GLY  37   8.924  12.736  -2.742
  259    HA3  GLY  37           2HA      GLY  37   8.727  12.169  -1.090
  260    H    TYR  38           H        TYR  38  10.574  12.212  -0.014
  261    HA   TYR  38           HA       TYR  38  12.951  11.018  -1.179
  262    HB2  TYR  38           1HB      TYR  38  12.926  13.508  -1.752
  263    HB3  TYR  38           2HB      TYR  38  13.144  13.800  -0.030
  264    HD1  TYR  38           HD2      TYR  38  15.102  12.085   0.941
  265    HD2  TYR  38           HD1      TYR  38  14.860  13.741  -2.971
  266    HE1  TYR  38           HE2      TYR  38  17.533  11.816   0.682
  267    HE2  TYR  38           HE1      TYR  38  17.290  13.474  -3.241
  268    HH   TYR  38           HH       TYR  38  19.368  12.887  -0.700
  269    H    ARG  39           H        ARG  39  13.910   9.795   0.299
  270    HA   ARG  39           HA       ARG  39  13.899  10.607   3.102
  271    HB2  ARG  39           1HB      ARG  39  12.802   7.980   2.093
  272    HB3  ARG  39           2HB      ARG  39  13.239   8.269   3.772
  273    HG2  ARG  39           1HG      ARG  39  11.234   9.945   2.289
  274    HG3  ARG  39           2HG      ARG  39  10.802   8.507   3.216
  275    HD2  ARG  39           1HD      ARG  39  11.357   9.484   5.238
  276    HD3  ARG  39           2HD      ARG  39  12.429  10.666   4.487
  277    HE   ARG  39           HE       ARG  39  10.615  12.034   4.092
  278   HH11  ARG  39          1HH1      ARG  39   9.544   8.911   5.197
  279   HH12  ARG  39          2HH1      ARG  39   7.907   9.418   5.453
  280   HH21  ARG  39          1HH2      ARG  39   8.463  12.713   4.424
  281   HH22  ARG  39          2HH2      ARG  39   7.293  11.581   5.012
  282    HA   PRO  40           HA       PRO  40  18.006   9.054   3.056
  283    HB2  PRO  40           1HB      PRO  40  18.311   8.349   5.660
  284    HB3  PRO  40           2HB      PRO  40  18.262  10.031   5.120
  285    HG2  PRO  40           1HG      PRO  40  16.086   8.365   6.325
  286    HG3  PRO  40           2HG      PRO  40  16.523  10.051   6.663
  287    HD2  PRO  40           1HD      PRO  40  14.446   9.376   5.062
  288    HD3  PRO  40           2HD      PRO  40  15.413  10.842   4.804
  289    H    SER  41           H        SER  41  15.341   7.056   3.796
  290    HA   SER  41           HA       SER  41  16.277   4.664   4.629
  291    HB2  SER  41           1HB      SER  41  13.921   5.107   3.986
  292    HB3  SER  41           2HB      SER  41  14.387   5.010   2.288
  293    HG   SER  41           HG       SER  41  15.299   2.830   3.171
  294    H    GLY  42           H        GLY  42  16.005   5.337   1.133
  295    HA2  GLY  42           1HA      GLY  42  18.636   4.700   0.449
  296    HA3  GLY  42           2HA      GLY  42  17.706   3.210   0.383
  297    HA   PRO  43           HA       PRO  43  17.213   5.989  -3.492
  298    HB2  PRO  43           1HB      PRO  43  19.077   4.862  -5.113
  299    HB3  PRO  43           2HB      PRO  43  19.422   6.248  -4.071
  300    HG2  PRO  43           1HG      PRO  43  20.014   3.348  -3.624
  301    HG3  PRO  43           2HG      PRO  43  21.042   4.760  -3.316
  302    HD2  PRO  43           1HD      PRO  43  19.668   3.502  -1.351
  303    HD3  PRO  43           2HD      PRO  43  19.991   5.247  -1.323
  304    H    SER  44           H        SER  44  15.236   4.764  -3.476
  305    HA   SER  44           HA       SER  44  15.150   2.796  -5.581
  306    HB2  SER  44           1HB      SER  44  15.595   1.211  -3.896
  307    HB3  SER  44           2HB      SER  44  14.594   2.056  -2.715
  308    HG   SER  44           HG       SER  44  13.718   0.077  -3.789
  309    H    SER  45           H        SER  45  13.454   3.323  -6.771
  310    HA   SER  45           HA       SER  45  11.145   4.591  -5.452
  311    HB2  SER  45           1HB      SER  45  12.586   5.812  -7.283
  312    HB3  SER  45           2HB      SER  45  11.636   4.830  -8.398
  313    HG   SER  45           HG       SER  45  10.521   6.714  -8.102
  314    H    GLY  46           H        GLY  46   9.156   3.724  -5.682
  315    HA2  GLY  46           1HA      GLY  46   8.960   1.297  -7.355
  316    HA3  GLY  46           2HA      GLY  46   8.079   1.537  -5.853
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1   0.500 -23.722  10.161
    2    HA2  GLY   1           1HA      GLY   1  -1.542 -22.985  12.071
    3    HA3  GLY   1           2HA      GLY   1  -0.603 -21.628  11.469
    4    H    SER   2           H        SER   2  -3.140 -23.830  10.830
    5    HA   SER   2           HA       SER   2  -3.526 -22.599   8.181
    6    HB2  SER   2           1HB      SER   2  -4.541 -24.713   7.416
    7    HB3  SER   2           2HB      SER   2  -2.866 -24.946   7.915
    8    HG   SER   2           HG       SER   2  -4.308 -26.558   8.737
    9    H    SER   3           H        SER   3  -5.322 -21.443   8.048
   10    HA   SER   3           HA       SER   3  -7.832 -22.317   9.042
   11    HB2  SER   3           1HB      SER   3  -6.797 -21.584  11.180
   12    HB3  SER   3           2HB      SER   3  -6.594 -19.969  10.500
   13    HG   SER   3           HG       SER   3  -8.490 -19.938  11.625
   14    H    GLY   4           H        GLY   4  -9.377 -21.435   7.817
   15    HA2  GLY   4           1HA      GLY   4  -8.625 -19.224   6.054
   16    HA3  GLY   4           2HA      GLY   4 -10.011 -20.287   5.853
   17    H    SER   5           H        SER   5 -10.238 -17.545   5.568
   18    HA   SER   5           HA       SER   5 -11.537 -15.789   6.203
   19    HB2  SER   5           1HB      SER   5 -12.795 -17.700   8.181
   20    HB3  SER   5           2HB      SER   5 -13.512 -16.238   7.504
   21    HG   SER   5           HG       SER   5 -12.972 -17.536   5.409
   22    H    SER   6           H        SER   6  -9.086 -15.692   7.272
   23    HA   SER   6           HA       SER   6  -9.375 -15.168  10.137
   24    HB2  SER   6           1HB      SER   6  -6.777 -14.700   9.734
   25    HB3  SER   6           2HB      SER   6  -7.408 -16.334   9.943
   26    HG   SER   6           HG       SER   6  -7.069 -15.077   7.423
   27    H    GLY   7           H        GLY   7 -10.188 -13.488   7.615
   28    HA2  GLY   7           1HA      GLY   7  -8.939 -10.975   8.542
   29    HA3  GLY   7           2HA      GLY   7  -9.454 -11.258   6.886
   30    H    SER   8           H        SER   8 -10.194  -9.217   8.987
   31    HA   SER   8           HA       SER   8 -12.991  -9.751   9.497
   32    HB2  SER   8           1HB      SER   8 -12.821  -7.255  10.306
   33    HB3  SER   8           2HB      SER   8 -12.081  -8.543  11.257
   34    HG   SER   8           HG       SER   8 -10.623  -7.177   9.266
   35    H    GLY   9           H        GLY   9 -11.462  -9.008   6.774
   36    HA2  GLY   9           1HA      GLY   9 -13.178  -8.526   4.960
   37    HA3  GLY   9           2HA      GLY   9 -13.488  -7.059   5.876
   38    H    GLU  10           H        GLU  10 -11.621  -8.502   3.448
   39    HA   GLU  10           HA       GLU  10  -9.309  -6.868   3.568
   40    HB2  GLU  10           1HB      GLU  10  -8.934  -7.605   1.236
   41    HB3  GLU  10           2HB      GLU  10  -9.283  -8.943   2.321
   42    HG2  GLU  10           1HG      GLU  10 -10.483  -9.364   0.344
   43    HG3  GLU  10           2HG      GLU  10 -11.666  -8.821   1.532
   44    H    LYS  11           H        LYS  11  -8.721  -5.315   1.794
   45    HA   LYS  11           HA       LYS  11 -11.030  -3.692   0.963
   46    HB2  LYS  11           1HB      LYS  11  -8.424  -2.567   2.001
   47    HB3  LYS  11           2HB      LYS  11  -9.852  -1.656   1.529
   48    HG2  LYS  11           1HG      LYS  11 -10.098  -3.686   3.691
   49    HG3  LYS  11           2HG      LYS  11  -9.326  -2.139   4.048
   50    HD2  LYS  11           1HD      LYS  11 -11.467  -1.199   2.805
   51    HD3  LYS  11           2HD      LYS  11 -12.150  -2.740   3.329
   52    HE2  LYS  11           1HE      LYS  11 -10.693  -0.947   5.242
   53    HE3  LYS  11           2HE      LYS  11 -12.399  -0.698   4.876
   54    HZ1  LYS  11           3HZ      LYS  11 -12.011  -2.083   6.861
   55    HZ2  LYS  11           1HZ      LYS  11 -11.259  -3.245   5.889
   56    HZ3  LYS  11           2HZ      LYS  11 -12.897  -2.888   5.665
   57    HA   PRO  12           HA       PRO  12  -9.179  -3.816  -3.029
   58    HB2  PRO  12           1HB      PRO  12 -10.346  -1.619  -4.117
   59    HB3  PRO  12           2HB      PRO  12 -11.219  -3.129  -3.832
   60    HG2  PRO  12           1HG      PRO  12 -11.174  -0.629  -2.186
   61    HG3  PRO  12           2HG      PRO  12 -12.551  -1.657  -2.622
   62    HD2  PRO  12           1HD      PRO  12 -11.344  -1.787  -0.201
   63    HD3  PRO  12           2HD      PRO  12 -12.077  -3.204  -0.980
   64    H    TYR  13           H        TYR  13  -8.751  -1.187  -0.852
   65    HA   TYR  13           HA       TYR  13  -6.646  -0.031  -2.547
   66    HB2  TYR  13           1HB      TYR  13  -7.882   1.174  -0.066
   67    HB3  TYR  13           2HB      TYR  13  -6.825   1.975  -1.223
   68    HD1  TYR  13           HD1      TYR  13  -7.767   1.824  -3.749
   69    HD2  TYR  13           HD2      TYR  13 -10.125   1.663  -0.212
   70    HE1  TYR  13           HE1      TYR  13  -9.729   2.572  -5.030
   71    HE2  TYR  13           HE2      TYR  13 -12.094   2.410  -1.483
   72    HH   TYR  13           HH       TYR  13 -12.184   3.913  -4.019
   73    H    LYS  14           H        LYS  14  -4.904  -1.321  -2.138
   74    HA   LYS  14           HA       LYS  14  -3.961  -1.388   0.653
   75    HB2  LYS  14           1HB      LYS  14  -4.710  -3.615  -0.344
   76    HB3  LYS  14           2HB      LYS  14  -3.317  -3.490  -1.410
   77    HG2  LYS  14           1HG      LYS  14  -2.883  -3.209   1.516
   78    HG3  LYS  14           2HG      LYS  14  -3.203  -4.815   0.858
   79    HD2  LYS  14           1HD      LYS  14  -1.366  -4.213  -0.863
   80    HD3  LYS  14           2HD      LYS  14  -0.915  -2.961   0.297
   81    HE2  LYS  14           1HE      LYS  14   0.429  -4.868   0.761
   82    HE3  LYS  14           2HE      LYS  14  -0.781  -4.760   2.040
   83    HZ1  LYS  14           3HZ      LYS  14  -0.374  -6.817   0.070
   84    HZ2  LYS  14           1HZ      LYS  14  -1.988  -6.327   0.201
   85    HZ3  LYS  14           2HZ      LYS  14  -1.162  -6.892   1.565
   86    H    CYS  15           H        CYS  15  -2.111  -0.354   0.977
   87    HA   CYS  15           HA       CYS  15  -0.672   0.911  -1.078
   88    HB2  CYS  15           1HB      CYS  15  -0.686   1.708   1.252
   89    HB3  CYS  15           2HB      CYS  15   0.221   0.281   1.744
   90    H    SER  16           H        SER  16   0.456  -0.104  -2.596
   91    HA   SER  16           HA       SER  16   1.704  -2.666  -2.071
   92    HB2  SER  16           1HB      SER  16   0.493  -2.097  -4.223
   93    HB3  SER  16           2HB      SER  16   1.851  -1.043  -4.617
   94    HG   SER  16           HG       SER  16   1.751  -3.840  -4.440
   95    H    GLU  17           H        GLU  17   2.805  -0.612  -0.529
   96    HA   GLU  17           HA       GLU  17   5.534  -0.543  -1.617
   97    HB2  GLU  17           1HB      GLU  17   4.033   1.741  -0.338
   98    HB3  GLU  17           2HB      GLU  17   5.781   1.726  -0.522
   99    HG2  GLU  17           1HG      GLU  17   4.115   1.240  -2.929
  100    HG3  GLU  17           2HG      GLU  17   4.208   2.880  -2.288
  101    H    CYS  18           H        CYS  18   3.450  -0.345   1.227
  102    HA   CYS  18           HA       CYS  18   5.675  -1.417   2.835
  103    HB2  CYS  18           1HB      CYS  18   4.841  -0.195   4.760
  104    HB3  CYS  18           2HB      CYS  18   5.140   0.927   3.437
  105    H    GLY  19           H        GLY  19   2.202  -1.372   2.245
  106    HA2  GLY  19           1HA      GLY  19   1.016  -3.488   2.253
  107    HA3  GLY  19           2HA      GLY  19   2.038  -3.992   3.592
  108    H    LYS  20           H        LYS  20  -0.085  -1.214   2.876
  109    HA   LYS  20           HA       LYS  20  -1.432  -1.716   5.446
  110    HB2  LYS  20           1HB      LYS  20   0.228   0.330   5.228
  111    HB3  LYS  20           2HB      LYS  20  -1.148   1.079   4.429
  112    HG2  LYS  20           1HG      LYS  20  -2.510   0.794   6.383
  113    HG3  LYS  20           2HG      LYS  20  -1.239  -0.133   7.183
  114    HD2  LYS  20           1HD      LYS  20   0.191   2.010   6.774
  115    HD3  LYS  20           2HD      LYS  20  -1.379   2.799   6.612
  116    HE2  LYS  20           1HE      LYS  20  -0.656   1.078   8.971
  117    HE3  LYS  20           2HE      LYS  20  -0.332   2.810   8.923
  118    HZ1  LYS  20           3HZ      LYS  20  -2.736   1.497   9.549
  119    HZ2  LYS  20           1HZ      LYS  20  -2.983   2.432   8.160
  120    HZ3  LYS  20           2HZ      LYS  20  -2.404   3.156   9.574
  121    H    ALA  21           H        ALA  21  -3.580  -1.857   5.322
  122    HA   ALA  21           HA       ALA  21  -4.864  -1.157   2.779
  123    HB1  ALA  21           3HB      ALA  21  -5.039  -3.493   3.689
  124    HB2  ALA  21           1HB      ALA  21  -6.025  -2.832   4.994
  125    HB3  ALA  21           2HB      ALA  21  -6.576  -2.710   3.323
  126    H    PHE  22           H        PHE  22  -6.482   0.309   2.638
  127    HA   PHE  22           HA       PHE  22  -7.328   1.624   5.136
  128    HB2  PHE  22           1HB      PHE  22  -6.764   2.862   2.437
  129    HB3  PHE  22           2HB      PHE  22  -7.555   3.715   3.759
  130    HD1  PHE  22           HD2      PHE  22  -6.306   4.207   5.832
  131    HD2  PHE  22           HD1      PHE  22  -4.418   2.525   2.408
  132    HE1  PHE  22           HE2      PHE  22  -4.109   4.848   6.734
  133    HE2  PHE  22           HE1      PHE  22  -2.217   3.163   3.305
  134    HZ   PHE  22           HZ       PHE  22  -2.061   4.327   5.469
  135    H    HIS  23           H        HIS  23  -9.379   3.044   4.616
  136    HA   HIS  23           HA       HIS  23 -11.307   1.224   3.351
  137    HB2  HIS  23           1HB      HIS  23 -13.007   2.530   4.669
  138    HB3  HIS  23           2HB      HIS  23 -11.845   1.639   5.648
  139    HD1  HIS  23           HD1      HIS  23 -10.039   3.056   6.913
  140    HD2  HIS  23           HD2      HIS  23 -12.963   5.282   4.975
  141    HE1  HIS  23           HE1      HIS  23  -9.843   5.382   7.848
  142    H    ARG  24           H        ARG  24 -10.165   4.545   3.381
  143    HA   ARG  24           HA       ARG  24 -11.906   5.122   1.075
  144    HB2  ARG  24           1HB      ARG  24 -10.906   6.807   3.326
  145    HB3  ARG  24           2HB      ARG  24 -11.166   7.572   1.764
  146    HG2  ARG  24           1HG      ARG  24 -13.341   5.882   2.876
  147    HG3  ARG  24           2HG      ARG  24 -13.059   7.471   3.590
  148    HD2  ARG  24           1HD      ARG  24 -13.357   8.538   1.452
  149    HD3  ARG  24           2HD      ARG  24 -13.469   6.975   0.645
  150    HE   ARG  24           HE       ARG  24 -15.565   8.359   1.989
  151   HH11  ARG  24          1HH1      ARG  24 -14.340   5.187   1.242
  152   HH12  ARG  24          2HH1      ARG  24 -15.891   4.422   1.343
  153   HH21  ARG  24          1HH2      ARG  24 -17.612   7.363   2.125
  154   HH22  ARG  24          2HH2      ARG  24 -17.752   5.660   1.845
  155    H    HIS  25           H        HIS  25 -10.937   5.256  -0.830
  156    HA   HIS  25           HA       HIS  25  -8.336   4.798  -1.422
  157    HB2  HIS  25           1HB      HIS  25 -10.333   5.135  -3.011
  158    HB3  HIS  25           2HB      HIS  25  -9.890   6.840  -3.000
  159    HD1  HIS  25           HD1      HIS  25  -9.760   5.001  -5.544
  160    HD2  HIS  25           HD2      HIS  25  -6.544   5.972  -3.099
  161    HE1  HIS  25           HE1      HIS  25  -7.714   4.708  -6.976
  162    H    THR  26           H        THR  26  -9.709   8.090  -1.263
  163    HA   THR  26           HA       THR  26  -7.571   9.660  -1.629
  164    HB   THR  26           HB       THR  26  -9.448  10.078   0.703
  165    HG1  THR  26           HG1      THR  26  -9.818  11.086  -1.920
  166   HG21  THR  26          3HG2      THR  26  -8.654  12.175   0.855
  167   HG22  THR  26          1HG2      THR  26  -8.567  12.368  -0.895
  168   HG23  THR  26          2HG2      THR  26  -7.262  11.554  -0.032
  169    H    HIS  27           H        HIS  27  -8.359   8.215   1.535
  170    HA   HIS  27           HA       HIS  27  -6.216   9.139   2.996
  171    HB2  HIS  27           1HB      HIS  27  -7.728   6.536   3.144
  172    HB3  HIS  27           2HB      HIS  27  -6.467   6.949   4.302
  173    HD1  HIS  27           HD1      HIS  27  -7.680   7.518   6.387
  174    HD2  HIS  27           HD2      HIS  27  -9.432   9.257   3.045
  175    HE1  HIS  27           HE1      HIS  27  -9.520   8.981   7.278
  176    H    LEU  28           H        LEU  28  -6.366   6.265   0.925
  177    HA   LEU  28           HA       LEU  28  -3.779   5.309   1.480
  178    HB2  LEU  28           1HB      LEU  28  -5.326   3.847   0.446
  179    HB3  LEU  28           2HB      LEU  28  -5.611   4.972  -0.880
  180    HG   LEU  28           HG       LEU  28  -3.082   4.543  -1.398
  181   HD11  LEU  28          1HD1      LEU  28  -2.417   2.237  -0.851
  182   HD12  LEU  28          2HD1      LEU  28  -3.839   2.089   0.180
  183   HD13  LEU  28          3HD1      LEU  28  -2.577   3.252   0.582
  184   HD21  LEU  28          3HD2      LEU  28  -3.753   3.141  -3.078
  185   HD22  LEU  28          1HD2      LEU  28  -5.309   3.816  -2.594
  186   HD23  LEU  28          2HD2      LEU  28  -4.828   2.216  -2.030
  187    H    ASN  29           H        ASN  29  -4.920   7.064  -1.414
  188    HA   ASN  29           HA       ASN  29  -2.543   7.477  -2.688
  189    HB2  ASN  29           1HB      ASN  29  -4.698   8.178  -3.618
  190    HB3  ASN  29           2HB      ASN  29  -4.809   9.467  -2.422
  191   HD21  ASN  29          1HD2      ASN  29  -5.085  10.577  -4.606
  192   HD22  ASN  29          2HD2      ASN  29  -3.647  11.228  -5.308
  193    H    GLU  30           H        GLU  30  -3.828   9.276   0.060
  194    HA   GLU  30           HA       GLU  30  -1.687  11.189   0.073
  195    HB2  GLU  30           1HB      GLU  30  -3.688  12.007   0.980
  196    HB3  GLU  30           2HB      GLU  30  -3.956  10.555   1.935
  197    HG2  GLU  30           1HG      GLU  30  -2.495  11.198   3.583
  198    HG3  GLU  30           2HG      GLU  30  -1.575  12.249   2.507
  199    H    HIS  31           H        HIS  31  -2.363   8.129   1.618
  200    HA   HIS  31           HA       HIS  31  -0.442   8.255   3.672
  201    HB2  HIS  31           1HB      HIS  31  -2.024   6.545   3.905
  202    HB3  HIS  31           2HB      HIS  31  -1.815   5.996   2.245
  203    HD1  HIS  31           HD1      HIS  31  -0.036   5.932   5.581
  204    HD2  HIS  31           HD2      HIS  31   0.015   3.985   1.910
  205    HE1  HIS  31           HE1      HIS  31   1.525   3.983   5.875
  206    H    ARG  32           H        ARG  32  -0.247   7.194   0.311
  207    HA   ARG  32           HA       ARG  32   2.340   6.097   0.415
  208    HB2  ARG  32           1HB      ARG  32   0.857   7.369  -1.892
  209    HB3  ARG  32           2HB      ARG  32   2.347   6.449  -2.051
  210    HG2  ARG  32           1HG      ARG  32   1.300   4.440  -1.435
  211    HG3  ARG  32           2HG      ARG  32  -0.122   5.279  -0.812
  212    HD2  ARG  32           1HD      ARG  32  -0.861   4.471  -2.855
  213    HD3  ARG  32           2HD      ARG  32  -0.391   6.127  -3.239
  214    HE   ARG  32           HE       ARG  32   1.272   5.307  -4.582
  215   HH11  ARG  32          1HH1      ARG  32   0.100   2.756  -2.525
  216   HH12  ARG  32          2HH1      ARG  32   0.997   1.514  -3.334
  217   HH21  ARG  32          1HH2      ARG  32   2.458   3.681  -5.656
  218   HH22  ARG  32          2HH2      ARG  32   2.338   2.041  -5.114
  219    H    ARG  33           H        ARG  33   1.288   9.309   0.658
  220    HA   ARG  33           HA       ARG  33   3.135  10.868  -0.593
  221    HB2  ARG  33           1HB      ARG  33   1.871  11.135   2.124
  222    HB3  ARG  33           2HB      ARG  33   2.973  12.359   1.507
  223    HG2  ARG  33           1HG      ARG  33   0.433  11.472   0.155
  224    HG3  ARG  33           2HG      ARG  33   0.619  12.932   1.129
  225    HD2  ARG  33           1HD      ARG  33   2.012  12.276  -1.463
  226    HD3  ARG  33           2HD      ARG  33   0.788  13.516  -1.197
  227    HE   ARG  33           HE       ARG  33   3.597  13.662  -0.521
  228   HH11  ARG  33          1HH1      ARG  33   0.413  14.991  -0.058
  229   HH12  ARG  33          2HH1      ARG  33   0.993  16.533   0.477
  230   HH21  ARG  33          1HH2      ARG  33   4.373  15.688   0.182
  231   HH22  ARG  33          2HH2      ARG  33   3.245  16.929   0.612
  232    H    ILE  34           H        ILE  34   3.629   8.858   2.230
  233    HA   ILE  34           HA       ILE  34   6.219   9.917   2.855
  234    HB   ILE  34           HB       ILE  34   6.343   8.341   4.566
  235   HG12  ILE  34          1HG1      ILE  34   4.416   6.666   2.949
  236   HG13  ILE  34          2HG1      ILE  34   6.104   6.310   3.296
  237   HG21  ILE  34          1HG2      ILE  34   3.868   9.663   4.121
  238   HG22  ILE  34          2HG2      ILE  34   3.537   8.107   4.882
  239   HG23  ILE  34          3HG2      ILE  34   4.637   9.250   5.653
  240   HD11  ILE  34          3HD1      ILE  34   3.754   5.671   4.807
  241   HD12  ILE  34          1HD1      ILE  34   5.414   5.114   5.021
  242   HD13  ILE  34          2HD1      ILE  34   4.880   6.612   5.785
  243    H    HIS  35           H        HIS  35   4.973   7.327   0.871
  244    HA   HIS  35           HA       HIS  35   7.608   6.187   0.436
  245    HB2  HIS  35           1HB      HIS  35   4.997   5.480  -0.915
  246    HB3  HIS  35           2HB      HIS  35   6.477   4.525  -0.912
  247    HD1  HIS  35           HD1      HIS  35   7.066   4.753   2.160
  248    HD2  HIS  35           HD2      HIS  35   3.406   3.733   0.479
  249    HE1  HIS  35           HE1      HIS  35   5.845   3.462   3.939
  250    H    THR  36           H        THR  36   5.932   8.785  -0.745
  251    HA   THR  36           HA       THR  36   7.409   8.695  -3.294
  252    HB   THR  36           HB       THR  36   4.998   8.467  -3.711
  253    HG1  THR  36           HG1      THR  36   6.338   9.690  -5.176
  254   HG21  THR  36          3HG2      THR  36   3.808  10.843  -3.264
  255   HG22  THR  36          1HG2      THR  36   4.890  10.779  -1.874
  256   HG23  THR  36          2HG2      THR  36   3.720   9.486  -2.141
  257    H    GLY  37           H        GLY  37   8.020  10.798  -4.161
  258    HA2  GLY  37           1HA      GLY  37   8.873  12.927  -3.991
  259    HA3  GLY  37           2HA      GLY  37   7.800  13.175  -2.622
  260    H    TYR  38           H        TYR  38  10.673  11.176  -3.321
  261    HA   TYR  38           HA       TYR  38  11.613  11.352  -0.634
  262    HB2  TYR  38           1HB      TYR  38  13.674  10.274  -1.572
  263    HB3  TYR  38           2HB      TYR  38  12.183   9.404  -1.916
  264    HD1  TYR  38           HD1      TYR  38  14.497  11.909  -3.430
  265    HD2  TYR  38           HD2      TYR  38  11.724   8.752  -4.096
  266    HE1  TYR  38           HE1      TYR  38  15.036  11.950  -5.829
  267    HE2  TYR  38           HE2      TYR  38  12.256   8.784  -6.497
  268    HH   TYR  38           HH       TYR  38  13.893   9.503  -8.011
  269    H    ARG  39           H        ARG  39  13.787  12.193  -0.071
  270    HA   ARG  39           HA       ARG  39  14.056  14.905  -1.064
  271    HB2  ARG  39           1HB      ARG  39  15.500  13.442   1.153
  272    HB3  ARG  39           2HB      ARG  39  15.706  15.147   0.773
  273    HG2  ARG  39           1HG      ARG  39  13.022  14.001   1.457
  274    HG3  ARG  39           2HG      ARG  39  14.155  14.535   2.700
  275    HD2  ARG  39           1HD      ARG  39  14.075  16.760   1.978
  276    HD3  ARG  39           2HD      ARG  39  13.386  16.320   0.416
  277    HE   ARG  39           HE       ARG  39  11.699  15.679   2.656
  278   HH11  ARG  39          1HH1      ARG  39  12.621  18.133   0.365
  279   HH12  ARG  39          2HH1      ARG  39  11.127  19.001   0.497
  280   HH21  ARG  39          1HH2      ARG  39   9.729  16.813   2.838
  281   HH22  ARG  39          2HH2      ARG  39   9.483  18.250   1.905
  282    HA   PRO  40           HA       PRO  40  17.401  14.102  -3.808
  283    HB2  PRO  40           1HB      PRO  40  18.534  16.569  -3.845
  284    HB3  PRO  40           2HB      PRO  40  17.009  16.201  -4.659
  285    HG2  PRO  40           1HG      PRO  40  17.472  17.506  -2.005
  286    HG3  PRO  40           2HG      PRO  40  16.322  17.944  -3.282
  287    HD2  PRO  40           1HD      PRO  40  15.589  16.559  -1.074
  288    HD3  PRO  40           2HD      PRO  40  14.811  16.322  -2.652
  289    H    SER  41           H        SER  41  17.805  14.883  -0.534
  290    HA   SER  41           HA       SER  41  20.661  14.179  -0.686
  291    HB2  SER  41           1HB      SER  41  19.439  16.067   1.338
  292    HB3  SER  41           2HB      SER  41  21.150  15.684   1.140
  293    HG   SER  41           HG       SER  41  20.619  17.662   0.142
  294    H    GLY  42           H        GLY  42  21.035  12.286   0.244
  295    HA2  GLY  42           1HA      GLY  42  20.499  11.574   2.840
  296    HA3  GLY  42           2HA      GLY  42  19.100  11.019   1.932
  297    HA   PRO  43           HA       PRO  43  22.253   7.632   1.897
  298    HB2  PRO  43           1HB      PRO  43  20.471   5.656   2.437
  299    HB3  PRO  43           2HB      PRO  43  21.262   6.608   3.699
  300    HG2  PRO  43           1HG      PRO  43  18.522   6.914   2.533
  301    HG3  PRO  43           2HG      PRO  43  19.033   7.005   4.229
  302    HD2  PRO  43           1HD      PRO  43  18.562   9.209   2.727
  303    HD3  PRO  43           2HD      PRO  43  19.783   9.174   4.016
  304    H    SER  44           H        SER  44  22.784   6.751   0.004
  305    HA   SER  44           HA       SER  44  20.658   6.320  -1.987
  306    HB2  SER  44           1HB      SER  44  22.627   7.981  -2.398
  307    HB3  SER  44           2HB      SER  44  23.571   6.521  -2.694
  308    HG   SER  44           HG       SER  44  21.732   7.742  -4.277
  309    H    SER  45           H        SER  45  20.091   4.255  -2.116
  310    HA   SER  45           HA       SER  45  22.180   2.232  -2.390
  311    HB2  SER  45           1HB      SER  45  20.935   0.707  -0.834
  312    HB3  SER  45           2HB      SER  45  21.669   2.098  -0.037
  313    HG   SER  45           HG       SER  45  19.048   2.369  -0.945
  314    H    GLY  46           H        GLY  46  21.776   1.329  -4.295
  315    HA2  GLY  46           1HA      GLY  46  19.274   1.436  -5.610
  316    HA3  GLY  46           2HA      GLY  46  20.649   0.455  -6.095
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1  -3.217 -24.671  13.834
    2    HA2  GLY   1           1HA      GLY   1  -5.169 -23.533  11.935
    3    HA3  GLY   1           2HA      GLY   1  -5.589 -24.274  13.472
    4    H    SER   2           H        SER   2  -5.518 -21.422  11.981
    5    HA   SER   2           HA       SER   2  -5.650 -19.934  14.413
    6    HB2  SER   2           1HB      SER   2  -3.178 -20.098  14.096
    7    HB3  SER   2           2HB      SER   2  -3.358 -19.267  12.551
    8    HG   SER   2           HG       SER   2  -2.876 -17.731  14.076
    9    H    SER   3           H        SER   3  -7.076 -18.350  14.127
   10    HA   SER   3           HA       SER   3  -7.853 -17.655  11.396
   11    HB2  SER   3           1HB      SER   3  -9.221 -16.930  13.998
   12    HB3  SER   3           2HB      SER   3  -9.885 -16.759  12.373
   13    HG   SER   3           HG       SER   3 -10.364 -18.812  12.355
   14    H    GLY   4           H        GLY   4  -7.425 -15.742  10.488
   15    HA2  GLY   4           1HA      GLY   4  -7.121 -13.327  11.983
   16    HA3  GLY   4           2HA      GLY   4  -5.566 -13.957  11.461
   17    H    SER   5           H        SER   5  -8.738 -12.913  10.299
   18    HA   SER   5           HA       SER   5  -7.466 -12.214   7.733
   19    HB2  SER   5           1HB      SER   5  -9.695 -12.515   6.687
   20    HB3  SER   5           2HB      SER   5  -9.093 -14.003   7.417
   21    HG   SER   5           HG       SER   5 -10.536 -13.812   9.036
   22    H    SER   6           H        SER   6  -7.195 -10.097   7.571
   23    HA   SER   6           HA       SER   6  -9.233  -8.322   8.749
   24    HB2  SER   6           1HB      SER   6  -6.258  -8.151   8.638
   25    HB3  SER   6           2HB      SER   6  -7.172  -6.647   8.541
   26    HG   SER   6           HG       SER   6  -6.753  -8.307  10.674
   27    H    GLY   7           H        GLY   7 -10.522  -7.562   7.205
   28    HA2  GLY   7           1HA      GLY   7 -11.152  -6.368   5.334
   29    HA3  GLY   7           2HA      GLY   7  -9.452  -6.042   5.029
   30    H    SER   8           H        SER   8 -12.167  -7.653   3.942
   31    HA   SER   8           HA       SER   8 -10.520  -9.322   2.159
   32    HB2  SER   8           1HB      SER   8 -12.255 -11.038   2.181
   33    HB3  SER   8           2HB      SER   8 -11.706 -10.721   3.826
   34    HG   SER   8           HG       SER   8 -13.929  -9.349   2.779
   35    H    GLY   9           H        GLY   9 -12.702  -6.814   2.428
   36    HA2  GLY   9           1HA      GLY   9 -12.993  -6.593  -0.410
   37    HA3  GLY   9           2HA      GLY   9 -14.499  -7.064   0.363
   38    H    GLU  10           H        GLU  10 -13.919  -5.541   2.801
   39    HA   GLU  10           HA       GLU  10 -15.236  -3.176   2.220
   40    HB2  GLU  10           1HB      GLU  10 -13.611  -4.154   4.512
   41    HB3  GLU  10           2HB      GLU  10 -13.964  -2.433   4.446
   42    HG2  GLU  10           1HG      GLU  10 -16.373  -2.984   4.274
   43    HG3  GLU  10           2HG      GLU  10 -15.960  -4.683   4.493
   44    H    LYS  11           H        LYS  11 -11.751  -3.579   2.863
   45    HA   LYS  11           HA       LYS  11 -11.289  -1.033   1.456
   46    HB2  LYS  11           1HB      LYS  11  -8.990  -1.277   2.697
   47    HB3  LYS  11           2HB      LYS  11 -10.399  -0.662   3.551
   48    HG2  LYS  11           1HG      LYS  11 -10.782  -2.813   4.565
   49    HG3  LYS  11           2HG      LYS  11  -9.469  -3.525   3.624
   50    HD2  LYS  11           1HD      LYS  11  -8.088  -1.575   4.771
   51    HD3  LYS  11           2HD      LYS  11  -9.363  -1.716   5.983
   52    HE2  LYS  11           1HE      LYS  11  -7.478  -3.125   6.574
   53    HE3  LYS  11           2HE      LYS  11  -8.884  -4.115   6.188
   54    HZ1  LYS  11           3HZ      LYS  11  -6.333  -4.179   5.020
   55    HZ2  LYS  11           1HZ      LYS  11  -7.447  -3.725   3.830
   56    HZ3  LYS  11           2HZ      LYS  11  -7.666  -5.166   4.689
   57    HA   PRO  12           HA       PRO  12  -9.602  -4.280  -1.351
   58    HB2  PRO  12           1HB      PRO  12 -10.341  -2.998  -3.627
   59    HB3  PRO  12           2HB      PRO  12 -11.427  -4.067  -2.730
   60    HG2  PRO  12           1HG      PRO  12 -11.264  -1.078  -2.703
   61    HG3  PRO  12           2HG      PRO  12 -12.698  -2.120  -2.747
   62    HD2  PRO  12           1HD      PRO  12 -11.818  -0.946  -0.471
   63    HD3  PRO  12           2HD      PRO  12 -12.625  -2.528  -0.479
   64    H    TYR  13           H        TYR  13  -8.932  -1.072  -0.606
   65    HA   TYR  13           HA       TYR  13  -6.761  -0.838  -2.552
   66    HB2  TYR  13           1HB      TYR  13  -8.077   1.100  -0.665
   67    HB3  TYR  13           2HB      TYR  13  -6.527   1.471  -1.414
   68    HD1  TYR  13           HD2      TYR  13  -9.377  -0.339  -2.957
   69    HD2  TYR  13           HD1      TYR  13  -7.107   3.258  -2.830
   70    HE1  TYR  13           HE2      TYR  13 -10.545   0.463  -4.967
   71    HE2  TYR  13           HE1      TYR  13  -8.270   4.070  -4.839
   72    HH   TYR  13           HH       TYR  13 -10.869   2.184  -6.345
   73    H    LYS  14           H        LYS  14  -4.904  -1.753  -1.995
   74    HA   LYS  14           HA       LYS  14  -3.929  -1.378   0.755
   75    HB2  LYS  14           1HB      LYS  14  -4.619  -3.663   0.667
   76    HB3  LYS  14           2HB      LYS  14  -3.862  -3.898  -0.903
   77    HG2  LYS  14           1HG      LYS  14  -1.776  -4.124  -0.022
   78    HG3  LYS  14           2HG      LYS  14  -2.127  -3.088   1.363
   79    HD2  LYS  14           1HD      LYS  14  -3.212  -4.800   2.520
   80    HD3  LYS  14           2HD      LYS  14  -3.453  -5.760   1.059
   81    HE2  LYS  14           1HE      LYS  14  -1.027  -6.146   0.938
   82    HE3  LYS  14           2HE      LYS  14  -0.817  -5.222   2.424
   83    HZ1  LYS  14           3HZ      LYS  14  -1.928  -6.847   3.666
   84    HZ2  LYS  14           1HZ      LYS  14  -0.907  -7.723   2.640
   85    HZ3  LYS  14           2HZ      LYS  14  -2.558  -7.610   2.294
   86    H    CYS  15           H        CYS  15  -2.015  -0.409   0.835
   87    HA   CYS  15           HA       CYS  15  -0.607   0.378  -1.468
   88    HB2  CYS  15           1HB      CYS  15  -0.356   1.736   0.451
   89    HB3  CYS  15           2HB      CYS  15   0.097   0.366   1.461
   90    H    SER  16           H        SER  16   0.736  -0.721  -2.723
   91    HA   SER  16           HA       SER  16   1.776  -3.287  -1.798
   92    HB2  SER  16           1HB      SER  16   0.599  -2.861  -4.079
   93    HB3  SER  16           2HB      SER  16   2.155  -2.195  -4.573
   94    HG   SER  16           HG       SER  16   1.666  -4.578  -4.868
   95    H    GLU  17           H        GLU  17   2.929  -0.969  -0.651
   96    HA   GLU  17           HA       GLU  17   5.665  -1.174  -1.720
   97    HB2  GLU  17           1HB      GLU  17   4.448   1.308  -0.498
   98    HB3  GLU  17           2HB      GLU  17   6.062   1.154  -1.178
   99    HG2  GLU  17           1HG      GLU  17   4.951   2.187  -2.888
  100    HG3  GLU  17           2HG      GLU  17   4.786   0.493  -3.348
  101    H    CYS  18           H        CYS  18   3.564  -0.866   1.057
  102    HA   CYS  18           HA       CYS  18   5.778  -1.765   2.765
  103    HB2  CYS  18           1HB      CYS  18   5.048  -0.277   4.563
  104    HB3  CYS  18           2HB      CYS  18   5.480   0.650   3.131
  105    H    GLY  19           H        GLY  19   2.261  -1.302   2.515
  106    HA2  GLY  19           1HA      GLY  19   1.003  -3.472   2.698
  107    HA3  GLY  19           2HA      GLY  19   1.929  -3.727   4.170
  108    H    LYS  20           H        LYS  20   0.180  -0.912   2.863
  109    HA   LYS  20           HA       LYS  20  -1.475  -0.926   5.296
  110    HB2  LYS  20           1HB      LYS  20   0.462   0.852   5.076
  111    HB3  LYS  20           2HB      LYS  20  -0.694   1.667   4.031
  112    HG2  LYS  20           1HG      LYS  20  -1.076   2.618   6.108
  113    HG3  LYS  20           2HG      LYS  20  -2.341   1.393   5.984
  114    HD2  LYS  20           1HD      LYS  20  -1.081  -0.120   7.369
  115    HD3  LYS  20           2HD      LYS  20   0.300   0.980   7.383
  116    HE2  LYS  20           1HE      LYS  20  -2.402   1.787   8.422
  117    HE3  LYS  20           2HE      LYS  20  -1.216   0.968   9.437
  118    HZ1  LYS  20           3HZ      LYS  20  -1.144   3.407   9.629
  119    HZ2  LYS  20           1HZ      LYS  20  -0.717   3.515   7.996
  120    HZ3  LYS  20           2HZ      LYS  20   0.322   2.756   9.093
  121    H    ALA  21           H        ALA  21  -3.550  -1.112   4.804
  122    HA   ALA  21           HA       ALA  21  -4.477  -0.103   2.195
  123    HB1  ALA  21           3HB      ALA  21  -6.344  -1.758   2.472
  124    HB2  ALA  21           1HB      ALA  21  -4.741  -2.464   2.263
  125    HB3  ALA  21           2HB      ALA  21  -5.475  -2.400   3.866
  126    H    PHE  22           H        PHE  22  -6.427   1.029   2.077
  127    HA   PHE  22           HA       PHE  22  -7.664   1.810   4.619
  128    HB2  PHE  22           1HB      PHE  22  -6.869   3.762   2.449
  129    HB3  PHE  22           2HB      PHE  22  -7.699   4.159   3.950
  130    HD1  PHE  22           HD1      PHE  22  -4.534   2.753   2.618
  131    HD2  PHE  22           HD2      PHE  22  -6.491   4.689   5.865
  132    HE1  PHE  22           HE1      PHE  22  -2.362   3.085   3.725
  133    HE2  PHE  22           HE2      PHE  22  -4.322   5.025   6.976
  134    HZ   PHE  22           HZ       PHE  22  -2.253   4.223   5.906
  135    H    HIS  23           H        HIS  23  -9.814   1.724   4.559
  136    HA   HIS  23           HA       HIS  23 -11.244   0.733   2.393
  137    HB2  HIS  23           1HB      HIS  23 -12.333   0.480   4.429
  138    HB3  HIS  23           2HB      HIS  23 -12.026   2.144   4.917
  139    HD1  HIS  23           HD1      HIS  23 -14.074   3.509   4.925
  140    HD2  HIS  23           HD2      HIS  23 -14.229   0.532   2.031
  141    HE1  HIS  23           HE1      HIS  23 -16.323   3.755   3.827
  142    H    ARG  24           H        ARG  24 -10.222   3.950   3.074
  143    HA   ARG  24           HA       ARG  24 -11.875   4.953   0.849
  144    HB2  ARG  24           1HB      ARG  24 -10.824   6.380   3.292
  145    HB3  ARG  24           2HB      ARG  24 -11.499   7.221   1.904
  146    HG2  ARG  24           1HG      ARG  24 -13.641   6.255   2.256
  147    HG3  ARG  24           2HG      ARG  24 -13.005   5.143   3.468
  148    HD2  ARG  24           1HD      ARG  24 -14.211   7.019   4.489
  149    HD3  ARG  24           2HD      ARG  24 -12.508   7.002   4.947
  150    HE   ARG  24           HE       ARG  24 -12.595   8.658   2.790
  151   HH11  ARG  24          1HH1      ARG  24 -14.271   8.534   5.839
  152   HH12  ARG  24          2HH1      ARG  24 -14.485  10.250   5.940
  153   HH21  ARG  24          1HH2      ARG  24 -12.871  10.919   2.911
  154   HH22  ARG  24          2HH2      ARG  24 -13.689  11.606   4.274
  155    H    HIS  25           H        HIS  25 -10.766   5.316  -0.945
  156    HA   HIS  25           HA       HIS  25  -8.073   5.079  -1.330
  157    HB2  HIS  25           1HB      HIS  25  -9.574   7.122  -2.928
  158    HB3  HIS  25           2HB      HIS  25  -8.388   5.938  -3.470
  159    HD1  HIS  25           HD1      HIS  25 -11.437   6.455  -4.503
  160    HD2  HIS  25           HD2      HIS  25 -10.003   3.279  -2.241
  161    HE1  HIS  25           HE1      HIS  25 -13.052   4.568  -4.895
  162    H    THR  26           H        THR  26  -9.830   8.131  -0.803
  163    HA   THR  26           HA       THR  26  -7.913  10.006  -0.978
  164    HB   THR  26           HB       THR  26  -9.998  10.815  -0.310
  165    HG1  THR  26           HG1      THR  26  -8.776  11.038   2.210
  166   HG21  THR  26          3HG2      THR  26  -9.838   8.989   2.091
  167   HG22  THR  26          1HG2      THR  26 -10.876   8.773   0.682
  168   HG23  THR  26          2HG2      THR  26 -11.137  10.137   1.769
  169    H    HIS  27           H        HIS  27  -8.283   7.741   1.711
  170    HA   HIS  27           HA       HIS  27  -6.226   8.850   3.320
  171    HB2  HIS  27           1HB      HIS  27  -7.786   6.309   3.303
  172    HB3  HIS  27           2HB      HIS  27  -6.302   6.359   4.249
  173    HD1  HIS  27           HD1      HIS  27  -8.608   5.960   5.956
  174    HD2  HIS  27           HD2      HIS  27  -7.558   9.775   4.689
  175    HE1  HIS  27           HE1      HIS  27  -9.668   7.532   7.607
  176    H    LEU  28           H        LEU  28  -6.293   5.972   1.219
  177    HA   LEU  28           HA       LEU  28  -3.595   5.285   1.524
  178    HB2  LEU  28           1HB      LEU  28  -5.188   3.734   0.602
  179    HB3  LEU  28           2HB      LEU  28  -5.494   4.803  -0.765
  180    HG   LEU  28           HG       LEU  28  -2.887   4.406  -1.146
  181   HD11  LEU  28          1HD1      LEU  28  -3.152   1.657  -0.599
  182   HD12  LEU  28          2HD1      LEU  28  -3.567   2.516   0.884
  183   HD13  LEU  28          3HD1      LEU  28  -2.011   2.803   0.105
  184   HD21  LEU  28          3HD2      LEU  28  -4.171   3.905  -2.959
  185   HD22  LEU  28          1HD2      LEU  28  -5.309   2.932  -2.025
  186   HD23  LEU  28          2HD2      LEU  28  -3.735   2.268  -2.465
  187    H    ASN  29           H        ASN  29  -5.156   7.018  -1.178
  188    HA   ASN  29           HA       ASN  29  -3.009   7.612  -2.731
  189    HB2  ASN  29           1HB      ASN  29  -5.384   8.274  -3.176
  190    HB3  ASN  29           2HB      ASN  29  -5.172   9.613  -2.051
  191   HD21  ASN  29          1HD2      ASN  29  -5.851   9.794  -4.810
  192   HD22  ASN  29          2HD2      ASN  29  -4.587  10.672  -5.595
  193    H    GLU  30           H        GLU  30  -3.840   9.058   0.347
  194    HA   GLU  30           HA       GLU  30  -1.820  11.112   0.147
  195    HB2  GLU  30           1HB      GLU  30  -3.522  11.901   1.462
  196    HB3  GLU  30           2HB      GLU  30  -3.880  10.318   2.137
  197    HG2  GLU  30           1HG      GLU  30  -2.292  10.501   3.778
  198    HG3  GLU  30           2HG      GLU  30  -1.317  11.645   2.857
  199    H    HIS  31           H        HIS  31  -2.304   8.200   2.138
  200    HA   HIS  31           HA       HIS  31  -0.030   8.221   3.651
  201    HB2  HIS  31           1HB      HIS  31  -1.393   6.440   4.168
  202    HB3  HIS  31           2HB      HIS  31  -1.683   6.033   2.479
  203    HD1  HIS  31           HD1      HIS  31   0.405   5.163   5.366
  204    HD2  HIS  31           HD2      HIS  31   0.481   4.560   1.256
  205    HE1  HIS  31           HE1      HIS  31   2.069   3.316   4.988
  206    H    ARG  32           H        ARG  32  -0.331   6.798   0.398
  207    HA   ARG  32           HA       ARG  32   2.132   5.799  -0.049
  208    HB2  ARG  32           1HB      ARG  32   0.592   7.546  -1.979
  209    HB3  ARG  32           2HB      ARG  32   1.892   6.446  -2.419
  210    HG2  ARG  32           1HG      ARG  32   0.539   4.561  -1.580
  211    HG3  ARG  32           2HG      ARG  32  -0.776   5.691  -1.246
  212    HD2  ARG  32           1HD      ARG  32   0.439   5.067  -3.934
  213    HD3  ARG  32           2HD      ARG  32  -1.162   4.597  -3.364
  214    HE   ARG  32           HE       ARG  32  -0.701   7.439  -3.365
  215   HH11  ARG  32          1HH1      ARG  32  -1.763   4.695  -5.228
  216   HH12  ARG  32          2HH1      ARG  32  -2.715   5.642  -6.322
  217   HH21  ARG  32          1HH2      ARG  32  -1.952   8.696  -4.800
  218   HH22  ARG  32          2HH2      ARG  32  -2.821   7.917  -6.079
  219    H    ARG  33           H        ARG  33   1.355   9.136   0.430
  220    HA   ARG  33           HA       ARG  33   3.460  10.459  -0.756
  221    HB2  ARG  33           1HB      ARG  33   2.014  10.987   1.835
  222    HB3  ARG  33           2HB      ARG  33   3.239  12.080   1.206
  223    HG2  ARG  33           1HG      ARG  33   1.940  12.532  -0.743
  224    HG3  ARG  33           2HG      ARG  33   0.780  11.270  -0.323
  225    HD2  ARG  33           1HD      ARG  33  -0.265  13.264   0.319
  226    HD3  ARG  33           2HD      ARG  33   0.378  12.599   1.820
  227    HE   ARG  33           HE       ARG  33   1.236  15.010   0.470
  228   HH11  ARG  33          1HH1      ARG  33   1.969  12.587   2.860
  229   HH12  ARG  33          2HH1      ARG  33   3.090  13.588   3.720
  230   HH21  ARG  33          1HH2      ARG  33   2.711  16.338   1.594
  231   HH22  ARG  33          2HH2      ARG  33   3.511  15.722   3.000
  232    H    ILE  34           H        ILE  34   3.392   8.858   2.407
  233    HA   ILE  34           HA       ILE  34   5.857   9.573   3.396
  234    HB   ILE  34           HB       ILE  34   5.847   7.550   4.706
  235   HG12  ILE  34          1HG1      ILE  34   3.466   6.457   3.276
  236   HG13  ILE  34          2HG1      ILE  34   5.052   6.217   2.551
  237   HG21  ILE  34          1HG2      ILE  34   4.305   8.672   5.858
  238   HG22  ILE  34          2HG2      ILE  34   3.500   9.222   4.389
  239   HG23  ILE  34          3HG2      ILE  34   3.109   7.643   5.070
  240   HD11  ILE  34          3HD1      ILE  34   4.230   5.367   5.318
  241   HD12  ILE  34          1HD1      ILE  34   4.400   4.316   3.912
  242   HD13  ILE  34          2HD1      ILE  34   5.816   5.120   4.589
  243    H    HIS  35           H        HIS  35   5.148   7.564   0.692
  244    HA   HIS  35           HA       HIS  35   7.784   6.346   0.635
  245    HB2  HIS  35           1HB      HIS  35   5.458   6.191  -1.291
  246    HB3  HIS  35           2HB      HIS  35   6.967   5.303  -1.479
  247    HD1  HIS  35           HD1      HIS  35   7.360   4.278   1.378
  248    HD2  HIS  35           HD2      HIS  35   3.721   4.210  -0.625
  249    HE1  HIS  35           HE1      HIS  35   6.011   2.475   2.497
  250    H    THR  36           H        THR  36   6.001   8.904  -0.972
  251    HA   THR  36           HA       THR  36   7.967   9.359  -3.004
  252    HB   THR  36           HB       THR  36   6.674  11.222  -3.681
  253    HG1  THR  36           HG1      THR  36   5.372  11.112  -1.145
  254   HG21  THR  36          3HG2      THR  36   4.248  10.017  -2.837
  255   HG22  THR  36          1HG2      THR  36   5.424   8.730  -3.097
  256   HG23  THR  36          2HG2      THR  36   5.059   9.866  -4.395
  257    H    GLY  37           H        GLY  37   9.516  10.969  -3.130
  258    HA2  GLY  37           1HA      GLY  37  10.455  11.958  -0.556
  259    HA3  GLY  37           2HA      GLY  37  11.336  12.005  -2.076
  260    H    TYR  38           H        TYR  38  11.753  14.223  -1.083
  261    HA   TYR  38           HA       TYR  38   9.766  16.189  -0.964
  262    HB2  TYR  38           1HB      TYR  38  11.516  17.771  -0.844
  263    HB3  TYR  38           2HB      TYR  38  12.172  16.311  -0.111
  264    HD1  TYR  38           HD2      TYR  38  13.535  14.756  -1.707
  265    HD2  TYR  38           HD1      TYR  38  12.726  18.857  -2.498
  266    HE1  TYR  38           HE2      TYR  38  15.438  14.825  -3.263
  267    HE2  TYR  38           HE1      TYR  38  14.627  18.937  -4.058
  268    HH   TYR  38           HH       TYR  38  16.048  17.593  -5.298
  269    H    ARG  39           H        ARG  39   9.910  18.207  -2.463
  270    HA   ARG  39           HA       ARG  39   9.551  17.231  -5.209
  271    HB2  ARG  39           1HB      ARG  39   8.195  19.257  -5.555
  272    HB3  ARG  39           2HB      ARG  39   7.582  18.276  -4.231
  273    HG2  ARG  39           1HG      ARG  39   7.458  20.324  -3.263
  274    HG3  ARG  39           2HG      ARG  39   9.106  19.895  -2.802
  275    HD2  ARG  39           1HD      ARG  39   9.845  21.069  -4.929
  276    HD3  ARG  39           2HD      ARG  39   8.204  21.705  -5.028
  277    HE   ARG  39           HE       ARG  39  10.284  22.597  -3.293
  278   HH11  ARG  39          1HH1      ARG  39   6.835  22.215  -3.567
  279   HH12  ARG  39          2HH1      ARG  39   6.474  23.490  -2.452
  280   HH21  ARG  39          1HH2      ARG  39   9.822  24.278  -1.823
  281   HH22  ARG  39          2HH2      ARG  39   8.174  24.664  -1.461
  282    HA   PRO  40           HA       PRO  40  13.108  19.422  -6.593
  283    HB2  PRO  40           1HB      PRO  40  12.438  19.730  -9.206
  284    HB3  PRO  40           2HB      PRO  40  12.938  18.181  -8.519
  285    HG2  PRO  40           1HG      PRO  40  10.181  19.199  -9.089
  286    HG3  PRO  40           2HG      PRO  40  10.863  17.589  -9.386
  287    HD2  PRO  40           1HD      PRO  40   9.276  18.130  -7.260
  288    HD3  PRO  40           2HD      PRO  40  10.581  16.928  -7.196
  289    H    SER  41           H        SER  41   9.993  20.695  -7.773
  290    HA   SER  41           HA       SER  41  10.789  23.371  -6.952
  291    HB2  SER  41           1HB      SER  41  10.398  22.527  -9.793
  292    HB3  SER  41           2HB      SER  41   9.856  24.134  -9.309
  293    HG   SER  41           HG       SER  41  12.420  23.120  -9.554
  294    H    GLY  42           H        GLY  42   8.903  24.949  -7.437
  295    HA2  GLY  42           1HA      GLY  42   6.374  24.674  -7.946
  296    HA3  GLY  42           2HA      GLY  42   6.447  23.587  -6.567
  297    HA   PRO  43           HA       PRO  43   7.339  28.068  -4.930
  298    HB2  PRO  43           1HB      PRO  43   6.695  30.086  -6.628
  299    HB3  PRO  43           2HB      PRO  43   8.306  29.360  -6.565
  300    HG2  PRO  43           1HG      PRO  43   6.067  28.840  -8.483
  301    HG3  PRO  43           2HG      PRO  43   7.799  29.030  -8.810
  302    HD2  PRO  43           1HD      PRO  43   6.597  26.607  -8.686
  303    HD3  PRO  43           2HD      PRO  43   8.283  26.863  -8.190
  304    H    SER  44           H        SER  44   5.762  28.414  -3.509
  305    HA   SER  44           HA       SER  44   3.091  29.128  -4.492
  306    HB2  SER  44           1HB      SER  44   2.879  26.797  -3.943
  307    HB3  SER  44           2HB      SER  44   3.715  27.027  -2.408
  308    HG   SER  44           HG       SER  44   1.534  26.978  -1.988
  309    H    SER  45           H        SER  45   2.854  31.155  -3.808
  310    HA   SER  45           HA       SER  45   4.118  32.160  -1.447
  311    HB2  SER  45           1HB      SER  45   3.396  33.397  -3.662
  312    HB3  SER  45           2HB      SER  45   1.879  33.622  -2.792
  313    HG   SER  45           HG       SER  45   4.251  34.214  -1.447
  314    H    GLY  46           H        GLY  46   3.122  32.920   0.456
  315    HA2  GLY  46           1HA      GLY  46   0.983  33.274   1.659
  316    HA3  GLY  46           2HA      GLY  46   0.457  31.746   0.969
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1 -17.632 -22.192   6.953
    2    HA2  GLY   1           1HA      GLY   1 -18.145 -24.214   5.066
    3    HA3  GLY   1           2HA      GLY   1 -18.357 -22.655   4.283
    4    H    SER   2           H        SER   2 -16.596 -23.036   2.903
    5    HA   SER   2           HA       SER   2 -13.966 -22.922   4.230
    6    HB2  SER   2           1HB      SER   2 -14.761 -24.221   1.619
    7    HB3  SER   2           2HB      SER   2 -13.084 -23.951   2.093
    8    HG   SER   2           HG       SER   2 -13.781 -25.134   4.100
    9    H    SER   3           H        SER   3 -15.718 -21.972   1.282
   10    HA   SER   3           HA       SER   3 -13.771 -20.062   0.472
   11    HB2  SER   3           1HB      SER   3 -15.463 -19.342  -1.164
   12    HB3  SER   3           2HB      SER   3 -15.320 -21.100  -1.131
   13    HG   SER   3           HG       SER   3 -17.151 -20.920   0.454
   14    H    GLY   4           H        GLY   4 -16.861 -19.836   2.192
   15    HA2  GLY   4           1HA      GLY   4 -17.601 -18.230   3.674
   16    HA3  GLY   4           2HA      GLY   4 -16.019 -17.472   3.568
   17    H    SER   5           H        SER   5 -18.955 -16.547   3.400
   18    HA   SER   5           HA       SER   5 -18.755 -15.094   0.851
   19    HB2  SER   5           1HB      SER   5 -20.806 -16.452   1.177
   20    HB3  SER   5           2HB      SER   5 -21.187 -15.497   2.610
   21    HG   SER   5           HG       SER   5 -22.248 -14.394   1.124
   22    H    SER   6           H        SER   6 -19.588 -14.656   4.276
   23    HA   SER   6           HA       SER   6 -20.029 -11.957   4.372
   24    HB2  SER   6           1HB      SER   6 -19.095 -12.052   6.709
   25    HB3  SER   6           2HB      SER   6 -20.302 -13.288   6.354
   26    HG   SER   6           HG       SER   6 -18.169 -14.481   5.717
   27    H    GLY   7           H        GLY   7 -18.865 -10.144   4.136
   28    HA2  GLY   7           1HA      GLY   7 -16.040 -10.441   3.423
   29    HA3  GLY   7           2HA      GLY   7 -17.048  -9.038   3.098
   30    H    SER   8           H        SER   8 -17.818  -7.871   5.127
   31    HA   SER   8           HA       SER   8 -17.213  -6.528   6.866
   32    HB2  SER   8           1HB      SER   8 -17.639  -8.660   8.070
   33    HB3  SER   8           2HB      SER   8 -15.931  -9.068   7.905
   34    HG   SER   8           HG       SER   8 -16.950  -6.771   9.229
   35    H    GLY   9           H        GLY   9 -15.524  -6.263   4.709
   36    HA2  GLY   9           1HA      GLY   9 -13.369  -4.875   5.694
   37    HA3  GLY   9           2HA      GLY   9 -12.772  -6.512   5.462
   38    H    GLU  10           H        GLU  10 -14.745  -4.137   3.670
   39    HA   GLU  10           HA       GLU  10 -13.590  -5.078   1.171
   40    HB2  GLU  10           1HB      GLU  10 -16.061  -4.521   1.508
   41    HB3  GLU  10           2HB      GLU  10 -15.571  -2.833   1.502
   42    HG2  GLU  10           1HG      GLU  10 -14.879  -2.923  -0.731
   43    HG3  GLU  10           2HG      GLU  10 -14.863  -4.685  -0.744
   44    H    LYS  11           H        LYS  11 -11.431  -4.292   1.896
   45    HA   LYS  11           HA       LYS  11 -11.097  -1.457   1.171
   46    HB2  LYS  11           1HB      LYS  11  -9.518  -3.007   3.233
   47    HB3  LYS  11           2HB      LYS  11  -9.188  -1.354   2.733
   48    HG2  LYS  11           1HG      LYS  11 -11.054  -0.515   3.806
   49    HG3  LYS  11           2HG      LYS  11 -11.873  -2.079   3.822
   50    HD2  LYS  11           1HD      LYS  11 -10.504  -2.890   5.564
   51    HD3  LYS  11           2HD      LYS  11  -9.346  -1.571   5.372
   52    HE2  LYS  11           1HE      LYS  11 -11.013   0.020   6.166
   53    HE3  LYS  11           2HE      LYS  11 -12.198  -1.277   6.315
   54    HZ1  LYS  11           3HZ      LYS  11 -10.350  -0.432   8.213
   55    HZ2  LYS  11           1HZ      LYS  11  -9.868  -1.979   7.728
   56    HZ3  LYS  11           2HZ      LYS  11 -11.430  -1.729   8.326
   57    HA   PRO  12           HA       PRO  12  -8.662  -4.202  -1.692
   58    HB2  PRO  12           1HB      PRO  12  -9.486  -2.967  -3.965
   59    HB3  PRO  12           2HB      PRO  12 -10.381  -4.292  -3.214
   60    HG2  PRO  12           1HG      PRO  12 -10.864  -1.343  -3.041
   61    HG3  PRO  12           2HG      PRO  12 -12.035  -2.658  -3.254
   62    HD2  PRO  12           1HD      PRO  12 -11.600  -1.468  -0.861
   63    HD3  PRO  12           2HD      PRO  12 -12.047  -3.179  -1.009
   64    H    TYR  13           H        TYR  13  -8.695  -1.023  -0.679
   65    HA   TYR  13           HA       TYR  13  -6.675  -0.043  -2.512
   66    HB2  TYR  13           1HB      TYR  13  -8.026   1.163  -0.098
   67    HB3  TYR  13           2HB      TYR  13  -6.734   1.977  -0.973
   68    HD1  TYR  13           HD2      TYR  13  -9.752   0.054  -2.065
   69    HD2  TYR  13           HD1      TYR  13  -7.589   3.715  -2.223
   70    HE1  TYR  13           HE2      TYR  13 -11.401   0.953  -3.652
   71    HE2  TYR  13           HE1      TYR  13  -9.233   4.624  -3.811
   72    HH   TYR  13           HH       TYR  13 -10.975   3.323  -5.603
   73    H    LYS  14           H        LYS  14  -5.365  -2.029  -1.754
   74    HA   LYS  14           HA       LYS  14  -3.993  -1.661   0.775
   75    HB2  LYS  14           1HB      LYS  14  -4.620  -3.921  -0.101
   76    HB3  LYS  14           2HB      LYS  14  -3.452  -3.693  -1.396
   77    HG2  LYS  14           1HG      LYS  14  -1.632  -3.727   0.103
   78    HG3  LYS  14           2HG      LYS  14  -2.690  -3.561   1.506
   79    HD2  LYS  14           1HD      LYS  14  -3.705  -5.812   0.534
   80    HD3  LYS  14           2HD      LYS  14  -2.084  -5.952  -0.153
   81    HE2  LYS  14           1HE      LYS  14  -1.101  -5.748   2.051
   82    HE3  LYS  14           2HE      LYS  14  -2.692  -5.489   2.766
   83    HZ1  LYS  14           3HZ      LYS  14  -2.576  -7.689   3.122
   84    HZ2  LYS  14           1HZ      LYS  14  -1.427  -7.951   1.907
   85    HZ3  LYS  14           2HZ      LYS  14  -3.065  -7.810   1.507
   86    H    CYS  15           H        CYS  15  -1.902  -1.012   1.051
   87    HA   CYS  15           HA       CYS  15  -0.713   0.449  -1.154
   88    HB2  CYS  15           1HB      CYS  15  -0.677   1.626   0.900
   89    HB3  CYS  15           2HB      CYS  15  -0.079   0.226   1.783
   90    H    SER  16           H        SER  16   0.685  -0.450  -2.499
   91    HA   SER  16           HA       SER  16   2.028  -2.926  -1.760
   92    HB2  SER  16           1HB      SER  16   0.844  -2.372  -4.038
   93    HB3  SER  16           2HB      SER  16   2.376  -1.589  -4.421
   94    HG   SER  16           HG       SER  16   2.553  -3.685  -5.091
   95    H    GLU  17           H        GLU  17   2.890  -0.595  -0.395
   96    HA   GLU  17           HA       GLU  17   5.651  -0.412  -1.400
   97    HB2  GLU  17           1HB      GLU  17   4.148   1.821  -0.027
   98    HB3  GLU  17           2HB      GLU  17   5.778   1.896  -0.683
   99    HG2  GLU  17           1HG      GLU  17   4.567   2.937  -2.326
  100    HG3  GLU  17           2HG      GLU  17   4.623   1.280  -2.925
  101    H    CYS  18           H        CYS  18   3.474  -0.503   1.343
  102    HA   CYS  18           HA       CYS  18   5.762  -1.209   3.057
  103    HB2  CYS  18           1HB      CYS  18   4.717  -0.060   4.931
  104    HB3  CYS  18           2HB      CYS  18   4.952   1.064   3.596
  105    H    GLY  19           H        GLY  19   2.236  -1.421   2.655
  106    HA2  GLY  19           1HA      GLY  19   1.393  -3.775   2.581
  107    HA3  GLY  19           2HA      GLY  19   2.347  -4.034   4.034
  108    H    LYS  20           H        LYS  20   0.223  -1.335   3.128
  109    HA   LYS  20           HA       LYS  20  -1.359  -1.906   5.549
  110    HB2  LYS  20           1HB      LYS  20  -0.662   0.723   4.242
  111    HB3  LYS  20           2HB      LYS  20  -1.912   0.568   5.469
  112    HG2  LYS  20           1HG      LYS  20  -0.279  -0.211   7.078
  113    HG3  LYS  20           2HG      LYS  20   0.987  -0.157   5.849
  114    HD2  LYS  20           1HD      LYS  20   1.352   1.862   6.847
  115    HD3  LYS  20           2HD      LYS  20   0.161   2.353   5.640
  116    HE2  LYS  20           1HE      LYS  20  -0.823   1.415   8.284
  117    HE3  LYS  20           2HE      LYS  20  -0.077   3.009   8.197
  118    HZ1  LYS  20           3HZ      LYS  20  -2.341   2.102   6.503
  119    HZ2  LYS  20           1HZ      LYS  20  -1.659   3.651   6.518
  120    HZ3  LYS  20           2HZ      LYS  20  -2.490   3.079   7.876
  121    H    ALA  21           H        ALA  21  -3.617  -0.852   5.388
  122    HA   ALA  21           HA       ALA  21  -4.718  -1.013   2.682
  123    HB1  ALA  21           3HB      ALA  21  -6.448  -2.556   3.298
  124    HB2  ALA  21           1HB      ALA  21  -4.888  -3.272   3.708
  125    HB3  ALA  21           2HB      ALA  21  -5.899  -2.573   4.974
  126    H    PHE  22           H        PHE  22  -6.306   0.427   2.311
  127    HA   PHE  22           HA       PHE  22  -7.490   1.801   4.630
  128    HB2  PHE  22           1HB      PHE  22  -6.895   3.211   2.038
  129    HB3  PHE  22           2HB      PHE  22  -7.248   3.914   3.613
  130    HD1  PHE  22           HD1      PHE  22  -4.703   1.992   1.728
  131    HD2  PHE  22           HD2      PHE  22  -5.526   4.467   5.092
  132    HE1  PHE  22           HE1      PHE  22  -2.291   2.175   2.180
  133    HE2  PHE  22           HE2      PHE  22  -3.116   4.655   5.548
  134    HZ   PHE  22           HZ       PHE  22  -1.495   3.509   4.091
  135    H    HIS  23           H        HIS  23  -9.576   2.800   4.219
  136    HA   HIS  23           HA       HIS  23 -11.163   1.175   2.383
  137    HB2  HIS  23           1HB      HIS  23 -11.816   1.438   4.799
  138    HB3  HIS  23           2HB      HIS  23 -12.144   3.135   4.464
  139    HD1  HIS  23           HD1      HIS  23 -14.012   0.334   5.036
  140    HD2  HIS  23           HD2      HIS  23 -13.957   2.998   1.848
  141    HE1  HIS  23           HE1      HIS  23 -16.253   0.095   3.920
  142    H    ARG  24           H        ARG  24 -10.560   4.583   3.163
  143    HA   ARG  24           HA       ARG  24 -11.992   5.382   0.736
  144    HB2  ARG  24           1HB      ARG  24 -11.175   6.777   3.246
  145    HB3  ARG  24           2HB      ARG  24 -11.369   7.733   1.782
  146    HG2  ARG  24           1HG      ARG  24 -13.666   6.955   1.562
  147    HG3  ARG  24           2HG      ARG  24 -13.474   5.964   3.010
  148    HD2  ARG  24           1HD      ARG  24 -14.437   7.804   3.948
  149    HD3  ARG  24           2HD      ARG  24 -12.744   8.284   4.053
  150    HE   ARG  24           HE       ARG  24 -13.458   9.294   1.678
  151   HH11  ARG  24          1HH1      ARG  24 -14.971   9.440   4.810
  152   HH12  ARG  24          2HH1      ARG  24 -15.697  10.989   4.531
  153   HH21  ARG  24          1HH2      ARG  24 -14.409  11.333   1.299
  154   HH22  ARG  24          2HH2      ARG  24 -15.377  12.064   2.533
  155    H    HIS  25           H        HIS  25 -10.938   5.900  -1.061
  156    HA   HIS  25           HA       HIS  25  -8.338   5.504  -1.631
  157    HB2  HIS  25           1HB      HIS  25 -10.223   6.250  -3.198
  158    HB3  HIS  25           2HB      HIS  25  -9.765   7.898  -2.780
  159    HD1  HIS  25           HD1      HIS  25  -6.786   7.869  -2.943
  160    HD2  HIS  25           HD2      HIS  25  -9.176   5.810  -5.646
  161    HE1  HIS  25           HE1      HIS  25  -5.367   7.561  -4.996
  162    H    THR  26           H        THR  26  -9.613   8.721  -0.754
  163    HA   THR  26           HA       THR  26  -7.461  10.289  -0.711
  164    HB   THR  26           HB       THR  26  -9.412  10.079   1.591
  165    HG1  THR  26           HG1      THR  26  -9.533  12.051  -0.402
  166   HG21  THR  26          3HG2      THR  26  -7.188  11.930   1.010
  167   HG22  THR  26          1HG2      THR  26  -7.935  11.504   2.549
  168   HG23  THR  26          2HG2      THR  26  -8.708  12.683   1.489
  169    H    HIS  27           H        HIS  27  -8.178   7.931   1.850
  170    HA   HIS  27           HA       HIS  27  -5.946   8.482   3.460
  171    HB2  HIS  27           1HB      HIS  27  -7.594   5.974   3.124
  172    HB3  HIS  27           2HB      HIS  27  -6.327   6.138   4.336
  173    HD1  HIS  27           HD1      HIS  27  -7.752   6.133   6.408
  174    HD2  HIS  27           HD2      HIS  27  -9.004   8.932   3.605
  175    HE1  HIS  27           HE1      HIS  27  -9.500   7.516   7.573
  176    H    LEU  28           H        LEU  28  -6.418   5.926   1.021
  177    HA   LEU  28           HA       LEU  28  -3.870   4.806   1.172
  178    HB2  LEU  28           1HB      LEU  28  -5.572   3.637   0.013
  179    HB3  LEU  28           2HB      LEU  28  -5.849   4.989  -1.083
  180    HG   LEU  28           HG       LEU  28  -3.487   4.551  -1.949
  181   HD11  LEU  28          1HD1      LEU  28  -3.361   1.811  -1.505
  182   HD12  LEU  28          2HD1      LEU  28  -3.694   2.508   0.080
  183   HD13  LEU  28          3HD1      LEU  28  -2.289   3.044  -0.842
  184   HD21  LEU  28          3HD2      LEU  28  -5.751   3.901  -2.987
  185   HD22  LEU  28          1HD2      LEU  28  -5.358   2.266  -2.457
  186   HD23  LEU  28          2HD2      LEU  28  -4.294   3.105  -3.585
  187    H    ASN  29           H        ASN  29  -5.083   7.304  -1.058
  188    HA   ASN  29           HA       ASN  29  -2.678   7.737  -2.422
  189    HB2  ASN  29           1HB      ASN  29  -4.853   8.567  -3.220
  190    HB3  ASN  29           2HB      ASN  29  -4.910   9.708  -1.879
  191   HD21  ASN  29          1HD2      ASN  29  -5.195  11.084  -3.897
  192   HD22  ASN  29          2HD2      ASN  29  -3.754  11.777  -4.552
  193    H    GLU  30           H        GLU  30  -4.113   9.803   0.112
  194    HA   GLU  30           HA       GLU  30  -2.013  11.517   0.516
  195    HB2  GLU  30           1HB      GLU  30  -4.069  10.413   2.408
  196    HB3  GLU  30           2HB      GLU  30  -2.849  11.548   2.966
  197    HG2  GLU  30           1HG      GLU  30  -4.483  12.224   0.569
  198    HG3  GLU  30           2HG      GLU  30  -5.186  12.389   2.177
  199    H    HIS  31           H        HIS  31  -2.327   8.206   1.568
  200    HA   HIS  31           HA       HIS  31  -0.161   8.256   3.425
  201    HB2  HIS  31           1HB      HIS  31  -1.690   6.520   3.794
  202    HB3  HIS  31           2HB      HIS  31  -1.736   6.073   2.091
  203    HD1  HIS  31           HD1      HIS  31   0.253   5.590   5.216
  204    HD2  HIS  31           HD2      HIS  31   0.304   4.347   1.252
  205    HE1  HIS  31           HE1      HIS  31   1.914   3.705   5.124
  206    H    ARG  32           H        ARG  32  -0.479   6.865   0.155
  207    HA   ARG  32           HA       ARG  32   1.980   5.888  -0.322
  208    HB2  ARG  32           1HB      ARG  32   0.169   7.493  -2.101
  209    HB3  ARG  32           2HB      ARG  32   1.713   6.902  -2.699
  210    HG2  ARG  32           1HG      ARG  32   1.071   4.650  -2.426
  211    HG3  ARG  32           2HG      ARG  32  -0.335   5.092  -1.456
  212    HD2  ARG  32           1HD      ARG  32  -1.261   4.618  -3.531
  213    HD3  ARG  32           2HD      ARG  32  -1.098   6.374  -3.561
  214    HE   ARG  32           HE       ARG  32   1.214   5.507  -4.675
  215   HH11  ARG  32          1HH1      ARG  32  -2.150   4.869  -5.306
  216   HH12  ARG  32          2HH1      ARG  32  -1.914   4.594  -7.001
  217   HH21  ARG  32          1HH2      ARG  32   1.537   5.147  -6.905
  218   HH22  ARG  32          2HH2      ARG  32   0.183   4.752  -7.909
  219    H    ARG  33           H        ARG  33   1.202   9.226   0.180
  220    HA   ARG  33           HA       ARG  33   3.294  10.568  -0.990
  221    HB2  ARG  33           1HB      ARG  33   1.984  11.066   1.686
  222    HB3  ARG  33           2HB      ARG  33   3.083  12.198   0.909
  223    HG2  ARG  33           1HG      ARG  33   1.456  12.063  -1.086
  224    HG3  ARG  33           2HG      ARG  33   0.327  11.385   0.088
  225    HD2  ARG  33           1HD      ARG  33   1.746  14.032   0.364
  226    HD3  ARG  33           2HD      ARG  33   0.081  13.826  -0.178
  227    HE   ARG  33           HE       ARG  33   0.019  12.597   2.189
  228   HH11  ARG  33          1HH1      ARG  33   1.350  15.671   1.241
  229   HH12  ARG  33          2HH1      ARG  33   1.090  16.408   2.787
  230   HH21  ARG  33          1HH2      ARG  33  -0.329  13.555   4.229
  231   HH22  ARG  33          2HH2      ARG  33   0.136  15.203   4.486
  232    H    ILE  34           H        ILE  34   3.269   9.139   2.275
  233    HA   ILE  34           HA       ILE  34   5.835   9.771   3.059
  234    HB   ILE  34           HB       ILE  34   5.749   7.912   4.590
  235   HG12  ILE  34          1HG1      ILE  34   3.210   6.869   3.416
  236   HG13  ILE  34          2HG1      ILE  34   4.728   6.420   2.645
  237   HG21  ILE  34          1HG2      ILE  34   3.359   9.586   4.146
  238   HG22  ILE  34          2HG2      ILE  34   3.173   8.233   5.260
  239   HG23  ILE  34          3HG2      ILE  34   4.410   9.455   5.556
  240   HD11  ILE  34          3HD1      ILE  34   4.845   4.766   4.110
  241   HD12  ILE  34          1HD1      ILE  34   5.180   5.985   5.340
  242   HD13  ILE  34          2HD1      ILE  34   3.527   5.432   5.073
  243    H    HIS  35           H        HIS  35   4.859   7.677   0.551
  244    HA   HIS  35           HA       HIS  35   7.447   6.304   0.498
  245    HB2  HIS  35           1HB      HIS  35   4.877   5.820  -1.014
  246    HB3  HIS  35           2HB      HIS  35   6.370   4.940  -1.327
  247    HD1  HIS  35           HD1      HIS  35   7.351   4.082   1.308
  248    HD2  HIS  35           HD2      HIS  35   3.288   4.214   0.451
  249    HE1  HIS  35           HE1      HIS  35   6.267   2.515   2.949
  250    H    THR  36           H        THR  36   5.552   8.688  -1.173
  251    HA   THR  36           HA       THR  36   7.682   8.937  -3.197
  252    HB   THR  36           HB       THR  36   5.578   8.348  -4.253
  253    HG1  THR  36           HG1      THR  36   6.786   9.799  -5.449
  254   HG21  THR  36          3HG2      THR  36   4.412  10.860  -3.057
  255   HG22  THR  36          1HG2      THR  36   4.123   9.242  -2.420
  256   HG23  THR  36          2HG2      THR  36   3.582   9.659  -4.045
  257    H    GLY  37           H        GLY  37   8.947  10.643  -2.894
  258    HA2  GLY  37           1HA      GLY  37   7.788  13.230  -2.282
  259    HA3  GLY  37           2HA      GLY  37   8.845  12.582  -1.036
  260    H    TYR  38           H        TYR  38   9.405  14.977  -2.295
  261    HA   TYR  38           HA       TYR  38  11.407  14.435  -4.338
  262    HB2  TYR  38           1HB      TYR  38  11.382  16.705  -4.814
  263    HB3  TYR  38           2HB      TYR  38   9.731  16.438  -4.265
  264    HD1  TYR  38           HD2      TYR  38   9.203  16.969  -1.812
  265    HD2  TYR  38           HD1      TYR  38  12.729  18.311  -3.779
  266    HE1  TYR  38           HE2      TYR  38   9.485  18.715  -0.103
  267    HE2  TYR  38           HE1      TYR  38  13.021  20.060  -2.075
  268    HH   TYR  38           HH       TYR  38  10.921  20.241   0.750
  269    H    ARG  39           H        ARG  39  13.601  15.054  -4.141
  270    HA   ARG  39           HA       ARG  39  14.547  15.178  -1.353
  271    HB2  ARG  39           1HB      ARG  39  16.487  13.945  -1.989
  272    HB3  ARG  39           2HB      ARG  39  15.097  13.089  -2.644
  273    HG2  ARG  39           1HG      ARG  39  15.528  14.136  -4.837
  274    HG3  ARG  39           2HG      ARG  39  16.973  14.889  -4.160
  275    HD2  ARG  39           1HD      ARG  39  17.965  12.742  -3.744
  276    HD3  ARG  39           2HD      ARG  39  16.479  11.917  -4.212
  277    HE   ARG  39           HE       ARG  39  17.589  13.575  -6.282
  278   HH11  ARG  39          1HH1      ARG  39  17.633  10.427  -4.797
  279   HH12  ARG  39          2HH1      ARG  39  18.232   9.624  -6.211
  280   HH21  ARG  39          1HH2      ARG  39  18.377  12.530  -8.150
  281   HH22  ARG  39          2HH2      ARG  39  18.655  10.822  -8.118
  282    HA   PRO  40           HA       PRO  40  16.413  19.063  -2.222
  283    HB2  PRO  40           1HB      PRO  40  18.426  19.024  -0.401
  284    HB3  PRO  40           2HB      PRO  40  16.731  19.256   0.045
  285    HG2  PRO  40           1HG      PRO  40  18.396  16.770   0.155
  286    HG3  PRO  40           2HG      PRO  40  17.242  17.398   1.346
  287    HD2  PRO  40           1HD      PRO  40  16.615  15.408  -0.379
  288    HD3  PRO  40           2HD      PRO  40  15.418  16.586   0.195
  289    H    SER  41           H        SER  41  17.287  18.904  -4.272
  290    HA   SER  41           HA       SER  41  19.414  17.341  -5.101
  291    HB2  SER  41           1HB      SER  41  18.287  19.949  -6.060
  292    HB3  SER  41           2HB      SER  41  19.761  19.314  -6.792
  293    HG   SER  41           HG       SER  41  18.507  18.075  -7.916
  294    H    GLY  42           H        GLY  42  21.545  17.363  -4.767
  295    HA2  GLY  42           1HA      GLY  42  23.018  19.769  -4.278
  296    HA3  GLY  42           2HA      GLY  42  22.809  18.820  -2.814
  297    HA   PRO  43           HA       PRO  43  26.252  17.197  -5.775
  298    HB2  PRO  43           1HB      PRO  43  28.388  18.675  -4.985
  299    HB3  PRO  43           2HB      PRO  43  27.342  19.142  -6.331
  300    HG2  PRO  43           1HG      PRO  43  27.331  20.112  -3.498
  301    HG3  PRO  43           2HG      PRO  43  27.162  21.040  -5.000
  302    HD2  PRO  43           1HD      PRO  43  25.040  20.357  -3.463
  303    HD3  PRO  43           2HD      PRO  43  24.932  20.503  -5.229
  304    H    SER  44           H        SER  44  25.779  17.875  -2.458
  305    HA   SER  44           HA       SER  44  27.944  16.780  -1.174
  306    HB2  SER  44           1HB      SER  44  25.672  17.763  -0.264
  307    HB3  SER  44           2HB      SER  44  25.208  16.063  -0.193
  308    HG   SER  44           HG       SER  44  26.149  16.343   1.719
  309    H    SER  45           H        SER  45  28.794  14.806  -0.903
  310    HA   SER  45           HA       SER  45  27.921  12.659  -2.554
  311    HB2  SER  45           1HB      SER  45  30.315  13.191  -1.758
  312    HB3  SER  45           2HB      SER  45  29.861  12.369  -0.266
  313    HG   SER  45           HG       SER  45  29.431  11.134  -2.758
  314    H    GLY  46           H        GLY  46  27.238  10.554  -1.883
  315    HA2  GLY  46           1HA      GLY  46  26.627   9.662   0.634
  316    HA3  GLY  46           2HA      GLY  46  25.248  10.653   0.181
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1   1.326 -30.452   5.511
    2    HA2  GLY   1           1HA      GLY   1  -0.359 -28.854   6.421
    3    HA3  GLY   1           2HA      GLY   1   0.113 -29.440   8.010
    4    H    SER   2           H        SER   2   0.184 -26.724   6.799
    5    HA   SER   2           HA       SER   2   3.000 -26.155   7.414
    6    HB2  SER   2           1HB      SER   2   2.674 -26.089   4.949
    7    HB3  SER   2           2HB      SER   2   1.447 -24.843   5.170
    8    HG   SER   2           HG       SER   2   3.052 -23.510   6.070
    9    H    SER   3           H        SER   3   2.980 -24.987   9.210
   10    HA   SER   3           HA       SER   3   0.711 -23.435  10.015
   11    HB2  SER   3           1HB      SER   3   2.006 -24.516  11.732
   12    HB3  SER   3           2HB      SER   3   3.486 -23.730  11.183
   13    HG   SER   3           HG       SER   3   2.352 -22.786  13.067
   14    H    GLY   4           H        GLY   4   0.545 -21.961   8.232
   15    HA2  GLY   4           1HA      GLY   4   2.523 -19.770   8.383
   16    HA3  GLY   4           2HA      GLY   4   1.775 -20.270   6.873
   17    H    SER   5           H        SER   5   1.493 -17.743   7.207
   18    HA   SER   5           HA       SER   5  -1.307 -17.405   7.957
   19    HB2  SER   5           1HB      SER   5  -0.131 -16.731   9.975
   20    HB3  SER   5           2HB      SER   5   0.928 -15.674   9.042
   21    HG   SER   5           HG       SER   5  -1.877 -15.401   9.384
   22    H    SER   6           H        SER   6  -2.376 -15.812   6.812
   23    HA   SER   6           HA       SER   6  -0.837 -14.622   4.601
   24    HB2  SER   6           1HB      SER   6  -2.817 -16.314   4.229
   25    HB3  SER   6           2HB      SER   6  -3.820 -14.893   4.521
   26    HG   SER   6           HG       SER   6  -3.080 -13.974   2.717
   27    H    GLY   7           H        GLY   7  -1.228 -12.471   3.996
   28    HA2  GLY   7           1HA      GLY   7  -2.596 -10.869   6.070
   29    HA3  GLY   7           2HA      GLY   7  -1.140 -10.341   5.241
   30    H    SER   8           H        SER   8  -4.539 -11.189   4.703
   31    HA   SER   8           HA       SER   8  -4.544  -9.331   2.415
   32    HB2  SER   8           1HB      SER   8  -6.343 -11.720   2.895
   33    HB3  SER   8           2HB      SER   8  -6.429 -10.632   1.510
   34    HG   SER   8           HG       SER   8  -4.165 -11.276   1.140
   35    H    GLY   9           H        GLY   9  -5.665  -7.524   2.690
   36    HA2  GLY   9           1HA      GLY   9  -7.523  -7.347   4.949
   37    HA3  GLY   9           2HA      GLY   9  -6.826  -5.991   4.074
   38    H    GLU  10           H        GLU  10  -9.661  -7.207   4.739
   39    HA   GLU  10           HA       GLU  10 -11.017  -7.796   2.411
   40    HB2  GLU  10           1HB      GLU  10 -11.835  -6.454   4.963
   41    HB3  GLU  10           2HB      GLU  10 -12.980  -6.568   3.634
   42    HG2  GLU  10           1HG      GLU  10 -13.023  -8.902   3.715
   43    HG3  GLU  10           2HG      GLU  10 -11.548  -8.983   4.676
   44    H    LYS  11           H        LYS  11  -9.801  -4.738   3.519
   45    HA   LYS  11           HA       LYS  11 -11.360  -2.988   1.992
   46    HB2  LYS  11           1HB      LYS  11  -8.664  -2.869   3.250
   47    HB3  LYS  11           2HB      LYS  11  -9.060  -1.639   2.058
   48    HG2  LYS  11           1HG      LYS  11  -9.583  -0.784   4.219
   49    HG3  LYS  11           2HG      LYS  11 -11.100  -1.105   3.375
   50    HD2  LYS  11           1HD      LYS  11 -11.580  -2.049   5.400
   51    HD3  LYS  11           2HD      LYS  11 -10.865  -3.443   4.588
   52    HE2  LYS  11           1HE      LYS  11  -8.639  -2.553   5.592
   53    HE3  LYS  11           2HE      LYS  11  -9.694  -1.667   6.692
   54    HZ1  LYS  11           3HZ      LYS  11 -10.245  -3.525   7.786
   55    HZ2  LYS  11           1HZ      LYS  11  -8.838  -4.171   7.103
   56    HZ3  LYS  11           2HZ      LYS  11 -10.340  -4.468   6.385
   57    HA   PRO  12           HA       PRO  12 -10.097  -3.723  -2.158
   58    HB2  PRO  12           1HB      PRO  12 -10.636  -1.287  -3.228
   59    HB3  PRO  12           2HB      PRO  12 -11.898  -2.439  -2.779
   60    HG2  PRO  12           1HG      PRO  12 -10.887  -0.057  -1.274
   61    HG3  PRO  12           2HG      PRO  12 -12.557  -0.604  -1.513
   62    HD2  PRO  12           1HD      PRO  12 -11.184  -1.072   0.773
   63    HD3  PRO  12           2HD      PRO  12 -12.406  -2.196   0.146
   64    H    TYR  13           H        TYR  13  -9.069  -0.537  -0.915
   65    HA   TYR  13           HA       TYR  13  -6.737  -0.514  -2.604
   66    HB2  TYR  13           1HB      TYR  13  -7.348   1.343  -0.303
   67    HB3  TYR  13           2HB      TYR  13  -6.279   1.643  -1.669
   68    HD1  TYR  13           HD1      TYR  13  -7.412   1.617  -4.023
   69    HD2  TYR  13           HD2      TYR  13  -9.527   2.137  -0.368
   70    HE1  TYR  13           HE1      TYR  13  -9.269   2.658  -5.253
   71    HE2  TYR  13           HE2      TYR  13 -11.391   3.178  -1.588
   72    HH   TYR  13           HH       TYR  13 -11.691   3.038  -4.956
   73    H    LYS  14           H        LYS  14  -4.833  -1.383  -2.150
   74    HA   LYS  14           HA       LYS  14  -4.033  -1.708   0.654
   75    HB2  LYS  14           1HB      LYS  14  -4.918  -3.867  -0.041
   76    HB3  LYS  14           2HB      LYS  14  -3.890  -3.857  -1.468
   77    HG2  LYS  14           1HG      LYS  14  -2.738  -5.248  -0.042
   78    HG3  LYS  14           2HG      LYS  14  -1.947  -3.695   0.237
   79    HD2  LYS  14           1HD      LYS  14  -3.161  -3.354   2.262
   80    HD3  LYS  14           2HD      LYS  14  -4.212  -4.734   1.931
   81    HE2  LYS  14           1HE      LYS  14  -2.441  -6.274   2.282
   82    HE3  LYS  14           2HE      LYS  14  -1.234  -4.989   2.286
   83    HZ1  LYS  14           3HZ      LYS  14  -2.459  -4.124   4.312
   84    HZ2  LYS  14           1HZ      LYS  14  -1.555  -5.539   4.519
   85    HZ3  LYS  14           2HZ      LYS  14  -3.237  -5.625   4.367
   86    H    CYS  15           H        CYS  15  -2.342  -0.364   0.764
   87    HA   CYS  15           HA       CYS  15  -0.691   0.514  -1.241
   88    HB2  CYS  15           1HB      CYS  15  -0.593   1.570   0.899
   89    HB3  CYS  15           2HB      CYS  15  -0.102   0.074   1.687
   90    H    SER  16           H        SER  16   0.858  -0.342  -2.463
   91    HA   SER  16           HA       SER  16   1.824  -3.034  -1.787
   92    HB2  SER  16           1HB      SER  16   0.675  -2.787  -3.966
   93    HB3  SER  16           2HB      SER  16   1.884  -1.599  -4.454
   94    HG   SER  16           HG       SER  16   3.436  -3.180  -4.429
   95    H    GLU  17           H        GLU  17   2.973  -0.927  -0.400
   96    HA   GLU  17           HA       GLU  17   5.691  -0.929  -1.525
   97    HB2  GLU  17           1HB      GLU  17   4.194   1.373  -0.284
   98    HB3  GLU  17           2HB      GLU  17   5.948   1.350  -0.394
   99    HG2  GLU  17           1HG      GLU  17   4.312   0.895  -2.844
  100    HG3  GLU  17           2HG      GLU  17   4.531   2.531  -2.225
  101    H    CYS  18           H        CYS  18   3.652  -0.758   1.344
  102    HA   CYS  18           HA       CYS  18   5.883  -1.875   2.905
  103    HB2  CYS  18           1HB      CYS  18   5.113  -0.584   4.861
  104    HB3  CYS  18           2HB      CYS  18   5.617   0.465   3.539
  105    H    GLY  19           H        GLY  19   2.378  -1.514   2.578
  106    HA2  GLY  19           1HA      GLY  19   1.226  -3.761   2.631
  107    HA3  GLY  19           2HA      GLY  19   2.058  -3.987   4.162
  108    H    LYS  20           H        LYS  20   0.658  -0.946   3.106
  109    HA   LYS  20           HA       LYS  20  -1.104  -1.012   5.439
  110    HB2  LYS  20           1HB      LYS  20   0.490   0.942   4.799
  111    HB3  LYS  20           2HB      LYS  20  -0.754   1.357   3.627
  112    HG2  LYS  20           1HG      LYS  20  -1.417   2.648   5.377
  113    HG3  LYS  20           2HG      LYS  20  -2.323   1.176   5.736
  114    HD2  LYS  20           1HD      LYS  20  -0.312   0.493   7.154
  115    HD3  LYS  20           2HD      LYS  20   0.216   2.170   7.003
  116    HE2  LYS  20           1HE      LYS  20  -2.539   1.460   7.962
  117    HE3  LYS  20           2HE      LYS  20  -1.165   1.524   9.064
  118    HZ1  LYS  20           3HZ      LYS  20  -2.421   3.615   8.979
  119    HZ2  LYS  20           1HZ      LYS  20  -2.048   3.771   7.336
  120    HZ3  LYS  20           2HZ      LYS  20  -0.814   3.817   8.492
  121    H    ALA  21           H        ALA  21  -3.327  -0.376   5.271
  122    HA   ALA  21           HA       ALA  21  -4.509  -0.558   2.595
  123    HB1  ALA  21           3HB      ALA  21  -4.829  -2.499   4.778
  124    HB2  ALA  21           1HB      ALA  21  -6.328  -1.977   4.009
  125    HB3  ALA  21           2HB      ALA  21  -5.042  -2.697   3.039
  126    H    PHE  22           H        PHE  22  -6.348   0.636   2.307
  127    HA   PHE  22           HA       PHE  22  -7.516   1.961   4.648
  128    HB2  PHE  22           1HB      PHE  22  -6.673   3.394   2.119
  129    HB3  PHE  22           2HB      PHE  22  -7.526   4.121   3.477
  130    HD1  PHE  22           HD1      PHE  22  -4.330   2.733   2.328
  131    HD2  PHE  22           HD2      PHE  22  -6.379   4.712   5.490
  132    HE1  PHE  22           HE1      PHE  22  -2.174   3.263   3.387
  133    HE2  PHE  22           HE2      PHE  22  -4.226   5.247   6.554
  134    HZ   PHE  22           HZ       PHE  22  -2.120   4.523   5.503
  135    H    HIS  23           H        HIS  23  -9.688   2.269   4.548
  136    HA   HIS  23           HA       HIS  23 -11.180   0.786   2.658
  137    HB2  HIS  23           1HB      HIS  23 -12.277   0.944   4.684
  138    HB3  HIS  23           2HB      HIS  23 -11.846   2.637   4.906
  139    HD1  HIS  23           HD1      HIS  23 -14.160   0.534   2.749
  140    HD2  HIS  23           HD2      HIS  23 -13.843   4.374   4.305
  141    HE1  HIS  23           HE1      HIS  23 -16.315   1.683   2.148
  142    H    ARG  24           H        ARG  24 -10.434   4.213   2.983
  143    HA   ARG  24           HA       ARG  24 -11.921   4.756   0.507
  144    HB2  ARG  24           1HB      ARG  24 -11.149   6.417   2.862
  145    HB3  ARG  24           2HB      ARG  24 -11.311   7.210   1.301
  146    HG2  ARG  24           1HG      ARG  24 -13.606   6.355   1.122
  147    HG3  ARG  24           2HG      ARG  24 -13.437   5.614   2.715
  148    HD2  ARG  24           1HD      ARG  24 -13.387   7.665   3.802
  149    HD3  ARG  24           2HD      ARG  24 -12.918   8.537   2.343
  150    HE   ARG  24           HE       ARG  24 -15.493   7.375   2.058
  151   HH11  ARG  24          1HH1      ARG  24 -13.803  10.026   3.554
  152   HH12  ARG  24          2HH1      ARG  24 -15.190  11.064   3.581
  153   HH21  ARG  24          1HH2      ARG  24 -17.325   8.733   2.088
  154   HH22  ARG  24          2HH2      ARG  24 -17.193  10.328   2.748
  155    H    HIS  25           H        HIS  25 -10.938   5.708  -1.253
  156    HA   HIS  25           HA       HIS  25  -8.249   5.088  -1.738
  157    HB2  HIS  25           1HB      HIS  25 -10.127   5.500  -3.432
  158    HB3  HIS  25           2HB      HIS  25  -9.777   7.214  -3.231
  159    HD1  HIS  25           HD1      HIS  25  -8.480   7.954  -5.194
  160    HD2  HIS  25           HD2      HIS  25  -7.293   4.190  -3.896
  161    HE1  HIS  25           HE1      HIS  25  -6.558   7.306  -6.680
  162    H    THR  26           H        THR  26  -9.790   8.211  -1.026
  163    HA   THR  26           HA       THR  26  -7.700   9.939  -1.238
  164    HB   THR  26           HB       THR  26  -8.701  11.196   0.720
  165    HG1  THR  26           HG1      THR  26  -9.972  10.089   1.985
  166   HG21  THR  26          3HG2      THR  26 -10.961  10.463  -1.057
  167   HG22  THR  26          1HG2      THR  26  -9.499  11.078  -1.825
  168   HG23  THR  26          2HG2      THR  26 -10.337  12.052  -0.617
  169    H    HIS  27           H        HIS  27  -8.422   7.902   1.586
  170    HA   HIS  27           HA       HIS  27  -6.336   8.768   3.225
  171    HB2  HIS  27           1HB      HIS  27  -7.922   6.230   3.055
  172    HB3  HIS  27           2HB      HIS  27  -6.554   6.333   4.159
  173    HD1  HIS  27           HD1      HIS  27  -8.172   6.140   6.186
  174    HD2  HIS  27           HD2      HIS  27  -8.787   9.490   3.806
  175    HE1  HIS  27           HE1      HIS  27  -9.663   7.655   7.530
  176    H    LEU  28           H        LEU  28  -6.431   5.955   1.039
  177    HA   LEU  28           HA       LEU  28  -3.870   5.008   1.433
  178    HB2  LEU  28           1HB      LEU  28  -5.357   3.722   0.134
  179    HB3  LEU  28           2HB      LEU  28  -5.624   5.040  -1.005
  180    HG   LEU  28           HG       LEU  28  -3.060   4.697  -1.495
  181   HD11  LEU  28          1HD1      LEU  28  -3.518   2.638   0.340
  182   HD12  LEU  28          2HD1      LEU  28  -2.091   2.883  -0.667
  183   HD13  LEU  28          3HD1      LEU  28  -3.407   1.857  -1.238
  184   HD21  LEU  28          3HD2      LEU  28  -5.506   3.492  -2.557
  185   HD22  LEU  28          1HD2      LEU  28  -4.029   2.630  -2.987
  186   HD23  LEU  28          2HD2      LEU  28  -4.200   4.338  -3.389
  187    H    ASN  29           H        ASN  29  -4.928   7.365  -1.023
  188    HA   ASN  29           HA       ASN  29  -2.433   7.877  -2.147
  189    HB2  ASN  29           1HB      ASN  29  -4.865   8.687  -2.787
  190    HB3  ASN  29           2HB      ASN  29  -4.403  10.108  -1.855
  191   HD21  ASN  29          1HD2      ASN  29  -4.788   9.330  -4.828
  192   HD22  ASN  29          2HD2      ASN  29  -3.428  10.070  -5.595
  193    H    GLU  30           H        GLU  30  -4.067   9.506   0.553
  194    HA   GLU  30           HA       GLU  30  -2.123  11.461   1.033
  195    HB2  GLU  30           1HB      GLU  30  -4.287  10.203   2.657
  196    HB3  GLU  30           2HB      GLU  30  -3.089  11.188   3.485
  197    HG2  GLU  30           1HG      GLU  30  -3.636  13.086   2.088
  198    HG3  GLU  30           2HG      GLU  30  -4.779  12.107   1.171
  199    H    HIS  31           H        HIS  31  -2.038   8.094   1.541
  200    HA   HIS  31           HA       HIS  31   0.021   8.229   3.595
  201    HB2  HIS  31           1HB      HIS  31  -1.437   6.446   4.002
  202    HB3  HIS  31           2HB      HIS  31  -1.516   5.997   2.301
  203    HD1  HIS  31           HD1      HIS  31   0.714   5.707   5.318
  204    HD2  HIS  31           HD2      HIS  31   0.404   4.192   1.462
  205    HE1  HIS  31           HE1      HIS  31   2.388   3.835   5.195
  206    H    ARG  32           H        ARG  32  -0.326   6.986   0.277
  207    HA   ARG  32           HA       ARG  32   2.157   6.018  -0.231
  208    HB2  ARG  32           1HB      ARG  32   0.400   7.699  -2.020
  209    HB3  ARG  32           2HB      ARG  32   1.851   6.886  -2.590
  210    HG2  ARG  32           1HG      ARG  32   0.768   4.752  -1.642
  211    HG3  ARG  32           2HG      ARG  32  -0.723   5.695  -1.643
  212    HD2  ARG  32           1HD      ARG  32  -0.718   4.576  -3.704
  213    HD3  ARG  32           2HD      ARG  32  -0.196   6.218  -4.079
  214    HE   ARG  32           HE       ARG  32   1.789   5.359  -4.795
  215   HH11  ARG  32          1HH1      ARG  32   0.273   3.039  -2.689
  216   HH12  ARG  32          2HH1      ARG  32   1.469   1.816  -2.960
  217   HH21  ARG  32          1HH2      ARG  32   3.371   3.757  -5.160
  218   HH22  ARG  32          2HH2      ARG  32   3.232   2.226  -4.365
  219    H    ARG  33           H        ARG  33   1.329   9.299   0.422
  220    HA   ARG  33           HA       ARG  33   3.318  10.754  -0.791
  221    HB2  ARG  33           1HB      ARG  33   1.896  11.044   1.827
  222    HB3  ARG  33           2HB      ARG  33   3.215  12.138   1.435
  223    HG2  ARG  33           1HG      ARG  33   1.860  12.411  -0.811
  224    HG3  ARG  33           2HG      ARG  33   0.520  11.897   0.217
  225    HD2  ARG  33           1HD      ARG  33   0.711  13.751   1.605
  226    HD3  ARG  33           2HD      ARG  33   2.372  14.071   1.110
  227    HE   ARG  33           HE       ARG  33   1.550  15.382  -0.560
  228   HH11  ARG  33          1HH1      ARG  33  -0.941  13.158   0.423
  229   HH12  ARG  33          2HH1      ARG  33  -2.147  13.847  -0.612
  230   HH21  ARG  33          1HH2      ARG  33  -0.029  16.298  -1.928
  231   HH22  ARG  33          2HH2      ARG  33  -1.627  15.633  -1.950
  232    H    ILE  34           H        ILE  34   3.508   9.017   2.302
  233    HA   ILE  34           HA       ILE  34   6.159   9.731   2.918
  234    HB   ILE  34           HB       ILE  34   6.148   7.921   4.513
  235   HG12  ILE  34          1HG1      ILE  34   3.474   6.950   3.613
  236   HG13  ILE  34          2HG1      ILE  34   4.894   6.415   2.721
  237   HG21  ILE  34          1HG2      ILE  34   4.907   9.316   5.718
  238   HG22  ILE  34          2HG2      ILE  34   4.027   9.856   4.289
  239   HG23  ILE  34          3HG2      ILE  34   3.485   8.428   5.171
  240   HD11  ILE  34          3HD1      ILE  34   5.633   5.116   4.414
  241   HD12  ILE  34          1HD1      ILE  34   5.003   6.189   5.664
  242   HD13  ILE  34          2HD1      ILE  34   3.914   5.096   4.808
  243    H    HIS  35           H        HIS  35   4.885   7.563   0.604
  244    HA   HIS  35           HA       HIS  35   7.359   6.031   0.398
  245    HB2  HIS  35           1HB      HIS  35   4.654   5.801  -0.903
  246    HB3  HIS  35           2HB      HIS  35   6.041   4.897  -1.504
  247    HD1  HIS  35           HD1      HIS  35   7.321   3.882   1.018
  248    HD2  HIS  35           HD2      HIS  35   3.203   3.982   0.472
  249    HE1  HIS  35           HE1      HIS  35   6.390   2.169   2.607
  250    H    THR  36           H        THR  36   5.709   8.662  -1.118
  251    HA   THR  36           HA       THR  36   7.709   8.679  -3.284
  252    HB   THR  36           HB       THR  36   5.226   8.528  -3.901
  253    HG1  THR  36           HG1      THR  36   5.851   9.398  -5.737
  254   HG21  THR  36          3HG2      THR  36   3.824  10.325  -3.633
  255   HG22  THR  36          1HG2      THR  36   5.148  11.487  -3.555
  256   HG23  THR  36          2HG2      THR  36   4.786  10.466  -2.163
  257    H    GLY  37           H        GLY  37   9.194  10.231  -3.216
  258    HA2  GLY  37           1HA      GLY  37  10.110  12.341  -2.920
  259    HA3  GLY  37           2HA      GLY  37   8.552  12.898  -2.327
  260    H    TYR  38           H        TYR  38  10.415  10.180  -1.070
  261    HA   TYR  38           HA       TYR  38  10.166  11.116   1.605
  262    HB2  TYR  38           1HB      TYR  38  11.130   9.108   2.247
  263    HB3  TYR  38           2HB      TYR  38  10.439   8.683   0.686
  264    HD1  TYR  38           HD2      TYR  38  11.910   8.441  -1.293
  265    HD2  TYR  38           HD1      TYR  38  13.494   9.100   2.601
  266    HE1  TYR  38           HE2      TYR  38  14.119   7.690  -2.071
  267    HE2  TYR  38           HE1      TYR  38  15.708   8.352   1.833
  268    HH   TYR  38           HH       TYR  38  16.960   8.144  -0.251
  269    H    ARG  39           H        ARG  39  11.931  11.583   3.069
  270    HA   ARG  39           HA       ARG  39  14.322  12.685   1.761
  271    HB2  ARG  39           1HB      ARG  39  14.149  14.526   3.585
  272    HB3  ARG  39           2HB      ARG  39  13.158  14.658   2.138
  273    HG2  ARG  39           1HG      ARG  39  12.056  13.323   4.568
  274    HG3  ARG  39           2HG      ARG  39  12.114  15.084   4.476
  275    HD2  ARG  39           1HD      ARG  39  11.000  13.590   2.160
  276    HD3  ARG  39           2HD      ARG  39  10.021  13.707   3.622
  277    HE   ARG  39           HE       ARG  39  11.015  16.253   2.892
  278   HH11  ARG  39          1HH1      ARG  39   8.653  13.867   1.971
  279   HH12  ARG  39          2HH1      ARG  39   7.571  15.021   1.265
  280   HH21  ARG  39          1HH2      ARG  39   9.599  17.782   1.965
  281   HH22  ARG  39          2HH2      ARG  39   8.111  17.248   1.260
  282    HA   PRO  40           HA       PRO  40  16.563  10.525   4.865
  283    HB2  PRO  40           1HB      PRO  40  18.822  12.028   4.943
  284    HB3  PRO  40           2HB      PRO  40  18.437  10.941   3.603
  285    HG2  PRO  40           1HG      PRO  40  18.073  13.906   3.802
  286    HG3  PRO  40           2HG      PRO  40  18.683  12.942   2.444
  287    HD2  PRO  40           1HD      PRO  40  16.143  13.876   2.543
  288    HD3  PRO  40           2HD      PRO  40  16.566  12.342   1.756
  289    H    SER  41           H        SER  41  16.021  13.974   5.191
  290    HA   SER  41           HA       SER  41  15.435  13.761   7.960
  291    HB2  SER  41           1HB      SER  41  18.156  14.696   7.155
  292    HB3  SER  41           2HB      SER  41  17.360  15.500   8.507
  293    HG   SER  41           HG       SER  41  17.655  13.784   9.693
  294    H    GLY  42           H        GLY  42  13.935  15.248   8.344
  295    HA2  GLY  42           1HA      GLY  42  12.948  17.068   6.569
  296    HA3  GLY  42           2HA      GLY  42  12.809  17.260   8.311
  297    HA   PRO  43           HA       PRO  43  15.856  20.347   6.184
  298    HB2  PRO  43           1HB      PRO  43  14.176  22.288   5.302
  299    HB3  PRO  43           2HB      PRO  43  14.704  20.941   4.287
  300    HG2  PRO  43           1HG      PRO  43  12.140  21.286   5.794
  301    HG3  PRO  43           2HG      PRO  43  12.398  20.672   4.150
  302    HD2  PRO  43           1HD      PRO  43  11.974  19.036   6.266
  303    HD3  PRO  43           2HD      PRO  43  12.999  18.574   4.893
  304    H    SER  44           H        SER  44  13.283  20.331   8.400
  305    HA   SER  44           HA       SER  44  14.290  22.786   9.681
  306    HB2  SER  44           1HB      SER  44  11.946  22.987   8.973
  307    HB3  SER  44           2HB      SER  44  11.537  21.544   9.901
  308    HG   SER  44           HG       SER  44  12.822  23.628  11.238
  309    H    SER  45           H        SER  45  15.945  21.565  10.732
  310    HA   SER  45           HA       SER  45  16.843  20.156  12.311
  311    HB2  SER  45           1HB      SER  45  15.923  22.197  13.539
  312    HB3  SER  45           2HB      SER  45  14.571  21.172  14.019
  313    HG   SER  45           HG       SER  45  15.844  20.592  15.583
  314    H    GLY  46           H        GLY  46  15.205  18.691  10.632
  315    HA2  GLY  46           1HA      GLY  46  13.249  17.163  12.015
  316    HA3  GLY  46           2HA      GLY  46  14.001  16.737  10.485
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1   3.328 -25.384   9.982
    2    HA2  GLY   1           1HA      GLY   1   4.146 -22.663  10.389
    3    HA3  GLY   1           2HA      GLY   1   3.569 -22.953   8.754
    4    H    SER   2           H        SER   2   2.697 -22.321  11.976
    5    HA   SER   2           HA       SER   2   0.040 -23.324  11.939
    6    HB2  SER   2           1HB      SER   2   1.496 -21.322  13.649
    7    HB3  SER   2           2HB      SER   2  -0.237 -21.585  13.842
    8    HG   SER   2           HG       SER   2   1.528 -22.937  15.035
    9    H    SER   3           H        SER   3  -1.852 -21.745  12.282
   10    HA   SER   3           HA       SER   3  -1.693 -19.282  10.777
   11    HB2  SER   3           1HB      SER   3  -3.134 -19.851   9.002
   12    HB3  SER   3           2HB      SER   3  -2.029 -21.221   9.111
   13    HG   SER   3           HG       SER   3  -4.707 -21.165   9.414
   14    H    GLY   4           H        GLY   4  -3.848 -18.164  10.719
   15    HA2  GLY   4           1HA      GLY   4  -5.511 -18.964  13.025
   16    HA3  GLY   4           2HA      GLY   4  -4.986 -17.301  12.807
   17    H    SER   5           H        SER   5  -7.697 -18.413  12.957
   18    HA   SER   5           HA       SER   5  -8.697 -17.891  10.249
   19    HB2  SER   5           1HB      SER   5  -9.984 -19.149  12.676
   20    HB3  SER   5           2HB      SER   5 -10.881 -18.747  11.212
   21    HG   SER   5           HG       SER   5  -8.881 -20.679  11.605
   22    H    SER   6           H        SER   6  -7.730 -15.668  11.549
   23    HA   SER   6           HA       SER   6 -10.184 -14.230  12.321
   24    HB2  SER   6           1HB      SER   6  -8.689 -14.248  14.195
   25    HB3  SER   6           2HB      SER   6  -7.319 -13.792  13.182
   26    HG   SER   6           HG       SER   6  -9.550 -12.215  13.923
   27    H    GLY   7           H        GLY   7 -10.865 -12.734  10.941
   28    HA2  GLY   7           1HA      GLY   7  -9.163 -10.887   9.636
   29    HA3  GLY   7           2HA      GLY   7  -9.627 -12.157   8.513
   30    H    SER   8           H        SER   8 -10.466  -9.182   9.780
   31    HA   SER   8           HA       SER   8 -13.311  -9.386   9.627
   32    HB2  SER   8           1HB      SER   8 -12.066  -7.678  10.990
   33    HB3  SER   8           2HB      SER   8 -11.636  -6.871   9.482
   34    HG   SER   8           HG       SER   8 -13.511  -5.954   9.564
   35    H    GLY   9           H        GLY   9 -10.840  -7.933   7.510
   36    HA2  GLY   9           1HA      GLY   9 -11.796  -8.757   5.092
   37    HA3  GLY   9           2HA      GLY   9 -12.758  -7.331   5.452
   38    H    GLU  10           H        GLU  10 -10.946  -7.640   3.260
   39    HA   GLU  10           HA       GLU  10  -8.920  -5.622   3.973
   40    HB2  GLU  10           1HB      GLU  10  -7.781  -7.643   3.390
   41    HB3  GLU  10           2HB      GLU  10  -8.787  -7.871   1.966
   42    HG2  GLU  10           1HG      GLU  10  -7.802  -5.748   1.057
   43    HG3  GLU  10           2HG      GLU  10  -6.662  -5.793   2.401
   44    H    LYS  11           H        LYS  11  -9.156  -3.709   3.037
   45    HA   LYS  11           HA       LYS  11 -11.218  -3.231   1.124
   46    HB2  LYS  11           1HB      LYS  11  -8.999  -1.396   2.051
   47    HB3  LYS  11           2HB      LYS  11 -10.446  -0.905   1.181
   48    HG2  LYS  11           1HG      LYS  11 -10.795  -2.371   3.737
   49    HG3  LYS  11           2HG      LYS  11 -10.247  -0.694   3.805
   50    HD2  LYS  11           1HD      LYS  11 -12.493  -0.326   3.827
   51    HD3  LYS  11           2HD      LYS  11 -12.250  -0.384   2.080
   52    HE2  LYS  11           1HE      LYS  11 -13.985  -1.848   2.252
   53    HE3  LYS  11           2HE      LYS  11 -12.648  -2.973   2.488
   54    HZ1  LYS  11           3HZ      LYS  11 -14.292  -1.717   4.618
   55    HZ2  LYS  11           1HZ      LYS  11 -12.944  -2.699   4.899
   56    HZ3  LYS  11           2HZ      LYS  11 -14.318  -3.343   4.152
   57    HA   PRO  12           HA       PRO  12  -9.074  -3.717  -2.677
   58    HB2  PRO  12           1HB      PRO  12 -10.293  -1.828  -4.200
   59    HB3  PRO  12           2HB      PRO  12 -11.086  -3.332  -3.718
   60    HG2  PRO  12           1HG      PRO  12 -11.329  -0.597  -2.526
   61    HG3  PRO  12           2HG      PRO  12 -12.600  -1.785  -2.868
   62    HD2  PRO  12           1HD      PRO  12 -11.578  -1.418  -0.388
   63    HD3  PRO  12           2HD      PRO  12 -12.156  -2.997  -0.958
   64    H    TYR  13           H        TYR  13  -8.708  -1.002  -0.756
   65    HA   TYR  13           HA       TYR  13  -6.740   0.195  -2.590
   66    HB2  TYR  13           1HB      TYR  13  -8.065   1.466  -0.187
   67    HB3  TYR  13           2HB      TYR  13  -6.984   2.261  -1.326
   68    HD1  TYR  13           HD1      TYR  13  -7.788   2.072  -3.866
   69    HD2  TYR  13           HD2      TYR  13 -10.331   1.782  -0.467
   70    HE1  TYR  13           HE1      TYR  13  -9.714   2.702  -5.261
   71    HE2  TYR  13           HE2      TYR  13 -12.264   2.410  -1.853
   72    HH   TYR  13           HH       TYR  13 -12.110   3.870  -4.669
   73    H    LYS  14           H        LYS  14  -5.327  -1.609  -1.880
   74    HA   LYS  14           HA       LYS  14  -4.150  -1.139   0.775
   75    HB2  LYS  14           1HB      LYS  14  -4.944  -3.422   0.408
   76    HB3  LYS  14           2HB      LYS  14  -3.955  -3.550  -1.041
   77    HG2  LYS  14           1HG      LYS  14  -1.938  -3.267   0.358
   78    HG3  LYS  14           2HG      LYS  14  -2.970  -3.261   1.790
   79    HD2  LYS  14           1HD      LYS  14  -3.514  -5.499   1.566
   80    HD3  LYS  14           2HD      LYS  14  -3.146  -5.521  -0.160
   81    HE2  LYS  14           1HE      LYS  14  -0.848  -5.631   0.210
   82    HE3  LYS  14           2HE      LYS  14  -0.991  -5.041   1.865
   83    HZ1  LYS  14           3HZ      LYS  14  -2.453  -7.366   1.792
   84    HZ2  LYS  14           1HZ      LYS  14  -0.926  -7.153   2.491
   85    HZ3  LYS  14           2HZ      LYS  14  -1.058  -7.714   0.900
   86    H    CYS  15           H        CYS  15  -2.016  -0.645   1.004
   87    HA   CYS  15           HA       CYS  15  -0.664   0.401  -1.308
   88    HB2  CYS  15           1HB      CYS  15  -0.472   1.634   0.745
   89    HB3  CYS  15           2HB      CYS  15   0.120   0.215   1.603
   90    H    SER  16           H        SER  16   1.467  -0.197  -1.988
   91    HA   SER  16           HA       SER  16   2.019  -3.058  -1.562
   92    HB2  SER  16           1HB      SER  16   2.640  -1.276  -3.927
   93    HB3  SER  16           2HB      SER  16   3.197  -2.942  -3.770
   94    HG   SER  16           HG       SER  16   1.275  -3.623  -4.288
   95    H    GLU  17           H        GLU  17   3.350   0.156  -1.477
   96    HA   GLU  17           HA       GLU  17   6.080  -0.429  -1.405
   97    HB2  GLU  17           1HB      GLU  17   4.449   1.805  -0.221
   98    HB3  GLU  17           2HB      GLU  17   6.192   1.729  -0.008
   99    HG2  GLU  17           1HG      GLU  17   5.105   1.503  -2.761
  100    HG3  GLU  17           2HG      GLU  17   5.088   3.082  -1.979
  101    H    CYS  18           H        CYS  18   3.769  -0.091   1.279
  102    HA   CYS  18           HA       CYS  18   5.720  -1.447   3.021
  103    HB2  CYS  18           1HB      CYS  18   4.541  -0.386   4.914
  104    HB3  CYS  18           2HB      CYS  18   5.197   0.803   3.794
  105    H    GLY  19           H        GLY  19   2.242  -1.161   2.326
  106    HA2  GLY  19           1HA      GLY  19   1.077  -3.310   1.925
  107    HA3  GLY  19           2HA      GLY  19   1.934  -3.925   3.330
  108    H    LYS  20           H        LYS  20   0.616  -0.697   3.257
  109    HA   LYS  20           HA       LYS  20  -1.208  -1.447   5.419
  110    HB2  LYS  20           1HB      LYS  20   0.496   0.535   5.465
  111    HB3  LYS  20           2HB      LYS  20  -0.730   1.374   4.523
  112    HG2  LYS  20           1HG      LYS  20  -2.339   1.119   6.285
  113    HG3  LYS  20           2HG      LYS  20  -1.224   0.109   7.209
  114    HD2  LYS  20           1HD      LYS  20   0.312   1.996   7.428
  115    HD3  LYS  20           2HD      LYS  20  -0.783   3.005   6.480
  116    HE2  LYS  20           1HE      LYS  20  -2.424   2.988   8.168
  117    HE3  LYS  20           2HE      LYS  20  -1.655   1.645   9.013
  118    HZ1  LYS  20           3HZ      LYS  20  -1.164   3.597  10.221
  119    HZ2  LYS  20           1HZ      LYS  20  -0.705   4.446   8.831
  120    HZ3  LYS  20           2HZ      LYS  20   0.261   3.183   9.408
  121    H    ALA  21           H        ALA  21  -3.373  -1.380   5.238
  122    HA   ALA  21           HA       ALA  21  -4.480  -0.514   2.650
  123    HB1  ALA  21           3HB      ALA  21  -5.396  -2.614   4.597
  124    HB2  ALA  21           1HB      ALA  21  -6.414  -2.017   3.286
  125    HB3  ALA  21           2HB      ALA  21  -4.888  -2.823   2.922
  126    H    PHE  22           H        PHE  22  -6.331   0.756   2.583
  127    HA   PHE  22           HA       PHE  22  -7.172   1.930   5.151
  128    HB2  PHE  22           1HB      PHE  22  -6.805   3.368   2.514
  129    HB3  PHE  22           2HB      PHE  22  -7.453   4.091   3.982
  130    HD1  PHE  22           HD1      PHE  22  -4.432   2.491   2.552
  131    HD2  PHE  22           HD2      PHE  22  -6.032   4.997   5.598
  132    HE1  PHE  22           HE1      PHE  22  -2.151   3.080   3.261
  133    HE2  PHE  22           HE2      PHE  22  -3.754   5.591   6.311
  134    HZ   PHE  22           HZ       PHE  22  -1.809   4.633   5.143
  135    H    HIS  23           H        HIS  23  -9.306   3.213   4.804
  136    HA   HIS  23           HA       HIS  23 -11.218   1.326   3.739
  137    HB2  HIS  23           1HB      HIS  23 -11.881   4.014   4.922
  138    HB3  HIS  23           2HB      HIS  23 -12.872   2.558   4.889
  139    HD1  HIS  23           HD1      HIS  23 -11.835   0.516   6.410
  140    HD2  HIS  23           HD2      HIS  23 -10.552   4.377   7.253
  141    HE1  HIS  23           HE1      HIS  23 -10.868   0.412   8.729
  142    H    ARG  24           H        ARG  24 -10.577   4.803   3.261
  143    HA   ARG  24           HA       ARG  24 -11.950   4.624   0.669
  144    HB2  ARG  24           1HB      ARG  24 -11.247   7.051   2.329
  145    HB3  ARG  24           2HB      ARG  24 -12.088   7.086   0.785
  146    HG2  ARG  24           1HG      ARG  24 -13.920   5.777   1.779
  147    HG3  ARG  24           2HG      ARG  24 -13.083   5.827   3.332
  148    HD2  ARG  24           1HD      ARG  24 -14.780   7.539   3.282
  149    HD3  ARG  24           2HD      ARG  24 -13.187   8.294   3.269
  150    HE   ARG  24           HE       ARG  24 -13.690   9.193   1.234
  151   HH11  ARG  24          1HH1      ARG  24 -15.819   6.502   1.821
  152   HH12  ARG  24          2HH1      ARG  24 -16.774   6.781   0.402
  153   HH21  ARG  24          1HH2      ARG  24 -14.940   9.571  -0.636
  154   HH22  ARG  24          2HH2      ARG  24 -16.273   8.526  -0.995
  155    H    HIS  25           H        HIS  25 -10.924   5.101  -1.212
  156    HA   HIS  25           HA       HIS  25  -8.256   4.697  -1.569
  157    HB2  HIS  25           1HB      HIS  25  -9.801   4.767  -3.440
  158    HB3  HIS  25           2HB      HIS  25 -10.066   6.491  -3.198
  159    HD1  HIS  25           HD1      HIS  25  -8.318   8.098  -4.137
  160    HD2  HIS  25           HD2      HIS  25  -7.324   4.094  -4.633
  161    HE1  HIS  25           HE1      HIS  25  -6.363   8.082  -5.719
  162    H    THR  26           H        THR  26  -9.774   7.925  -1.467
  163    HA   THR  26           HA       THR  26  -7.686   9.592  -1.672
  164    HB   THR  26           HB       THR  26  -9.728   9.891   0.536
  165    HG1  THR  26           HG1      THR  26 -10.820   9.547  -1.398
  166   HG21  THR  26          3HG2      THR  26  -8.878  12.251  -0.958
  167   HG22  THR  26          1HG2      THR  26  -7.564  11.478  -0.072
  168   HG23  THR  26          2HG2      THR  26  -9.015  12.003   0.783
  169    H    HIS  27           H        HIS  27  -8.608   8.027   1.395
  170    HA   HIS  27           HA       HIS  27  -6.593   9.028   3.003
  171    HB2  HIS  27           1HB      HIS  27  -8.079   6.412   3.043
  172    HB3  HIS  27           2HB      HIS  27  -6.862   6.791   4.257
  173    HD1  HIS  27           HD1      HIS  27  -8.773   6.729   6.055
  174    HD2  HIS  27           HD2      HIS  27  -9.143   9.728   3.204
  175    HE1  HIS  27           HE1      HIS  27 -10.482   8.327   6.977
  176    H    LEU  28           H        LEU  28  -6.552   6.068   1.033
  177    HA   LEU  28           HA       LEU  28  -3.989   5.200   1.708
  178    HB2  LEU  28           1HB      LEU  28  -5.417   3.713   0.556
  179    HB3  LEU  28           2HB      LEU  28  -5.650   4.849  -0.771
  180    HG   LEU  28           HG       LEU  28  -3.174   4.509  -1.279
  181   HD11  LEU  28          1HD1      LEU  28  -3.640   2.313   0.713
  182   HD12  LEU  28          2HD1      LEU  28  -2.339   3.502   0.666
  183   HD13  LEU  28          3HD1      LEU  28  -2.392   2.206  -0.528
  184   HD21  LEU  28          3HD2      LEU  28  -3.624   2.641  -2.662
  185   HD22  LEU  28          1HD2      LEU  28  -5.139   3.533  -2.523
  186   HD23  LEU  28          2HD2      LEU  28  -4.895   2.059  -1.586
  187    H    ASN  29           H        ASN  29  -5.018   7.172  -1.076
  188    HA   ASN  29           HA       ASN  29  -2.605   7.576  -2.309
  189    HB2  ASN  29           1HB      ASN  29  -4.971   8.454  -2.917
  190    HB3  ASN  29           2HB      ASN  29  -4.523   9.866  -1.965
  191   HD21  ASN  29          1HD2      ASN  29  -4.977   9.283  -4.915
  192   HD22  ASN  29          2HD2      ASN  29  -3.605   9.993  -5.689
  193    H    GLU  30           H        GLU  30  -4.001   9.678   0.214
  194    HA   GLU  30           HA       GLU  30  -1.878  11.429   0.498
  195    HB2  GLU  30           1HB      GLU  30  -3.874  10.420   2.521
  196    HB3  GLU  30           2HB      GLU  30  -2.712  11.688   2.886
  197    HG2  GLU  30           1HG      GLU  30  -3.652  13.111   1.196
  198    HG3  GLU  30           2HG      GLU  30  -4.731  11.824   0.660
  199    H    HIS  31           H        HIS  31  -2.310   8.211   1.834
  200    HA   HIS  31           HA       HIS  31  -0.117   8.307   3.635
  201    HB2  HIS  31           1HB      HIS  31  -1.559   6.599   4.187
  202    HB3  HIS  31           2HB      HIS  31  -1.860   6.165   2.507
  203    HD1  HIS  31           HD1      HIS  31   0.283   5.366   5.405
  204    HD2  HIS  31           HD2      HIS  31   0.144   4.489   1.347
  205    HE1  HIS  31           HE1      HIS  31   1.846   3.422   5.083
  206    H    ARG  32           H        ARG  32  -0.491   6.975   0.360
  207    HA   ARG  32           HA       ARG  32   1.919   5.805  -0.071
  208    HB2  ARG  32           1HB      ARG  32   0.397   7.599  -1.969
  209    HB3  ARG  32           2HB      ARG  32   1.722   6.547  -2.450
  210    HG2  ARG  32           1HG      ARG  32   0.367   4.628  -1.522
  211    HG3  ARG  32           2HG      ARG  32  -0.981   5.760  -1.408
  212    HD2  ARG  32           1HD      ARG  32  -0.303   6.237  -3.926
  213    HD3  ARG  32           2HD      ARG  32   0.337   4.598  -3.804
  214    HE   ARG  32           HE       ARG  32  -2.132   4.273  -2.846
  215   HH11  ARG  32          1HH1      ARG  32  -0.975   5.935  -5.678
  216   HH12  ARG  32          2HH1      ARG  32  -2.415   5.644  -6.597
  217   HH21  ARG  32          1HH2      ARG  32  -4.033   3.883  -4.046
  218   HH22  ARG  32          2HH2      ARG  32  -4.154   4.477  -5.667
  219    H    ARG  33           H        ARG  33   1.335   9.155   0.483
  220    HA   ARG  33           HA       ARG  33   3.466  10.408  -0.728
  221    HB2  ARG  33           1HB      ARG  33   2.124  10.921   1.920
  222    HB3  ARG  33           2HB      ARG  33   3.393  11.968   1.300
  223    HG2  ARG  33           1HG      ARG  33   1.860  12.025  -0.831
  224    HG3  ARG  33           2HG      ARG  33   0.610  11.580   0.333
  225    HD2  ARG  33           1HD      ARG  33   1.096  13.529   1.666
  226    HD3  ARG  33           2HD      ARG  33   2.466  13.937   0.634
  227    HE   ARG  33           HE       ARG  33  -0.066  13.794  -0.739
  228   HH11  ARG  33          1HH1      ARG  33   2.160  15.814   1.017
  229   HH12  ARG  33          2HH1      ARG  33   1.562  17.290   0.335
  230   HH21  ARG  33          1HH2      ARG  33  -0.861  15.731  -1.645
  231   HH22  ARG  33          2HH2      ARG  33  -0.157  17.242  -1.179
  232    H    ILE  34           H        ILE  34   3.421   8.837   2.463
  233    HA   ILE  34           HA       ILE  34   5.937   9.356   3.371
  234    HB   ILE  34           HB       ILE  34   5.871   7.316   4.629
  235   HG12  ILE  34          1HG1      ILE  34   3.529   6.359   2.997
  236   HG13  ILE  34          2HG1      ILE  34   5.183   5.946   2.560
  237   HG21  ILE  34          1HG2      ILE  34   2.967   7.947   4.422
  238   HG22  ILE  34          2HG2      ILE  34   3.975   7.728   5.852
  239   HG23  ILE  34          3HG2      ILE  34   4.088   9.217   4.914
  240   HD11  ILE  34          3HD1      ILE  34   5.219   4.315   4.049
  241   HD12  ILE  34          1HD1      ILE  34   4.735   5.414   5.340
  242   HD13  ILE  34          2HD1      ILE  34   3.509   4.619   4.353
  243    H    HIS  35           H        HIS  35   5.072   7.450   0.630
  244    HA   HIS  35           HA       HIS  35   7.763   6.314   0.430
  245    HB2  HIS  35           1HB      HIS  35   5.378   5.812  -1.358
  246    HB3  HIS  35           2HB      HIS  35   6.878   4.891  -1.312
  247    HD1  HIS  35           HD1      HIS  35   7.284   4.010   1.412
  248    HD2  HIS  35           HD2      HIS  35   3.441   4.422  -0.113
  249    HE1  HIS  35           HE1      HIS  35   5.825   2.567   2.866
  250    H    THR  36           H        THR  36   5.708   8.735  -0.948
  251    HA   THR  36           HA       THR  36   7.785   9.339  -2.952
  252    HB   THR  36           HB       THR  36   5.791   8.719  -4.127
  253    HG1  THR  36           HG1      THR  36   6.069  11.556  -4.020
  254   HG21  THR  36          3HG2      THR  36   3.632   9.584  -3.712
  255   HG22  THR  36          1HG2      THR  36   4.256  10.851  -2.657
  256   HG23  THR  36          2HG2      THR  36   4.282   9.169  -2.127
  257    H    GLY  37           H        GLY  37   8.782  10.542  -1.131
  258    HA2  GLY  37           1HA      GLY  37   7.416  13.079  -0.537
  259    HA3  GLY  37           2HA      GLY  37   8.748  12.398   0.385
  260    H    TYR  38           H        TYR  38  10.593  11.844  -1.553
  261    HA   TYR  38           HA       TYR  38  10.990  14.270  -3.116
  262    HB2  TYR  38           1HB      TYR  38  12.008  14.842  -0.983
  263    HB3  TYR  38           2HB      TYR  38  12.934  13.345  -0.991
  264    HD1  TYR  38           HD2      TYR  38  14.812  13.058  -2.567
  265    HD2  TYR  38           HD1      TYR  38  12.711  16.745  -2.258
  266    HE1  TYR  38           HE2      TYR  38  16.652  14.198  -3.735
  267    HE2  TYR  38           HE1      TYR  38  14.544  17.895  -3.427
  268    HH   TYR  38           HH       TYR  38  17.437  16.126  -4.494
  269    H    ARG  39           H        ARG  39  11.925  13.849  -5.018
  270    HA   ARG  39           HA       ARG  39  13.460  11.359  -5.315
  271    HB2  ARG  39           1HB      ARG  39  11.318  12.369  -7.196
  272    HB3  ARG  39           2HB      ARG  39  12.390  11.015  -7.528
  273    HG2  ARG  39           1HG      ARG  39  11.468   9.903  -5.481
  274    HG3  ARG  39           2HG      ARG  39  10.273  11.199  -5.402
  275    HD2  ARG  39           1HD      ARG  39   9.621  10.600  -7.753
  276    HD3  ARG  39           2HD      ARG  39  10.662   9.185  -7.607
  277    HE   ARG  39           HE       ARG  39   9.022   9.004  -5.452
  278   HH11  ARG  39          1HH1      ARG  39   8.495   9.360  -8.875
  279   HH12  ARG  39          2HH1      ARG  39   6.985   8.512  -8.863
  280   HH21  ARG  39          1HH2      ARG  39   7.034   7.885  -5.423
  281   HH22  ARG  39          2HH2      ARG  39   6.154   7.674  -6.899
  282    HA   PRO  40           HA       PRO  40  16.446  13.844  -7.366
  283    HB2  PRO  40           1HB      PRO  40  17.581  11.994  -8.999
  284    HB3  PRO  40           2HB      PRO  40  17.843  12.023  -7.251
  285    HG2  PRO  40           1HG      PRO  40  15.975  10.323  -8.858
  286    HG3  PRO  40           2HG      PRO  40  17.021   9.862  -7.502
  287    HD2  PRO  40           1HD      PRO  40  14.367  10.315  -7.208
  288    HD3  PRO  40           2HD      PRO  40  15.544  10.668  -5.926
  289    H    SER  41           H        SER  41  17.045  14.736  -9.423
  290    HA   SER  41           HA       SER  41  14.812  15.047 -11.189
  291    HB2  SER  41           1HB      SER  41  16.283  16.939 -10.713
  292    HB3  SER  41           2HB      SER  41  17.655  16.071 -11.403
  293    HG   SER  41           HG       SER  41  15.391  17.133 -12.709
  294    H    GLY  42           H        GLY  42  18.182  14.077 -11.877
  295    HA2  GLY  42           1HA      GLY  42  18.181  11.736 -12.982
  296    HA3  GLY  42           2HA      GLY  42  17.176  12.544 -14.175
  297    HA   PRO  43           HA       PRO  43  21.912  13.237 -14.754
  298    HB2  PRO  43           1HB      PRO  43  22.598  11.070 -16.238
  299    HB3  PRO  43           2HB      PRO  43  22.729  11.108 -14.475
  300    HG2  PRO  43           1HG      PRO  43  20.582   9.919 -16.190
  301    HG3  PRO  43           2HG      PRO  43  21.354   9.251 -14.740
  302    HD2  PRO  43           1HD      PRO  43  18.920  10.437 -14.681
  303    HD3  PRO  43           2HD      PRO  43  20.051  10.510 -13.314
  304    H    SER  44           H        SER  44  19.190  12.315 -16.650
  305    HA   SER  44           HA       SER  44  20.394  13.274 -19.132
  306    HB2  SER  44           1HB      SER  44  19.036  11.196 -19.167
  307    HB3  SER  44           2HB      SER  44  17.631  12.129 -18.651
  308    HG   SER  44           HG       SER  44  19.110  12.515 -21.045
  309    H    SER  45           H        SER  45  20.113  15.272 -19.862
  310    HA   SER  45           HA       SER  45  19.265  17.362 -20.193
  311    HB2  SER  45           1HB      SER  45  17.061  15.942 -20.304
  312    HB3  SER  45           2HB      SER  45  16.740  16.669 -18.730
  313    HG   SER  45           HG       SER  45  17.054  18.728 -19.762
  314    H    GLY  46           H        GLY  46  20.940  16.991 -18.069
  315    HA2  GLY  46           1HA      GLY  46  21.695  18.188 -16.252
  316    HA3  GLY  46           2HA      GLY  46  20.291  19.230 -16.427
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1  -0.827 -31.443  -2.400
    2    HA2  GLY   1           1HA      GLY   1  -3.233 -31.986  -1.029
    3    HA3  GLY   1           2HA      GLY   1  -2.073 -31.299   0.099
    4    H    SER   2           H        SER   2  -4.407 -29.980  -0.381
    5    HA   SER   2           HA       SER   2  -3.504 -27.424  -1.168
    6    HB2  SER   2           1HB      SER   2  -5.045 -27.151  -3.151
    7    HB3  SER   2           2HB      SER   2  -3.647 -28.189  -3.436
    8    HG   SER   2           HG       SER   2  -6.267 -28.786  -3.604
    9    H    SER   3           H        SER   3  -4.577 -26.158   0.179
   10    HA   SER   3           HA       SER   3  -7.424 -26.724   0.685
   11    HB2  SER   3           1HB      SER   3  -6.083 -27.340   2.649
   12    HB3  SER   3           2HB      SER   3  -5.382 -25.722   2.686
   13    HG   SER   3           HG       SER   3  -7.787 -25.117   2.767
   14    H    GLY   4           H        GLY   4  -8.764 -24.907   1.114
   15    HA2  GLY   4           1HA      GLY   4  -7.991 -22.571  -0.387
   16    HA3  GLY   4           2HA      GLY   4  -9.545 -22.851   0.384
   17    H    SER   5           H        SER   5  -9.641 -20.762   1.226
   18    HA   SER   5           HA       SER   5  -8.131 -20.416   3.685
   19    HB2  SER   5           1HB      SER   5  -6.786 -19.292   1.893
   20    HB3  SER   5           2HB      SER   5  -8.160 -18.229   1.593
   21    HG   SER   5           HG       SER   5  -7.080 -18.491   4.181
   22    H    SER   6           H        SER   6  -8.957 -18.519   4.948
   23    HA   SER   6           HA       SER   6 -11.840 -18.165   4.449
   24    HB2  SER   6           1HB      SER   6 -12.222 -18.143   6.802
   25    HB3  SER   6           2HB      SER   6 -11.160 -19.516   6.492
   26    HG   SER   6           HG       SER   6  -9.421 -17.880   6.972
   27    H    GLY   7           H        GLY   7 -12.723 -16.154   5.590
   28    HA2  GLY   7           1HA      GLY   7 -12.300 -13.905   6.345
   29    HA3  GLY   7           2HA      GLY   7 -10.782 -13.940   5.459
   30    H    SER   8           H        SER   8 -12.695 -11.879   5.253
   31    HA   SER   8           HA       SER   8 -14.007 -12.317   2.678
   32    HB2  SER   8           1HB      SER   8 -14.224 -10.177   4.785
   33    HB3  SER   8           2HB      SER   8 -14.889  -9.939   3.169
   34    HG   SER   8           HG       SER   8 -16.453 -11.280   3.617
   35    H    GLY   9           H        GLY   9 -13.778 -10.744   0.955
   36    HA2  GLY   9           1HA      GLY   9 -11.026  -9.701   0.845
   37    HA3  GLY   9           2HA      GLY   9 -12.005 -10.133  -0.549
   38    H    GLU  10           H        GLU  10 -12.806  -8.119   2.264
   39    HA   GLU  10           HA       GLU  10 -13.831  -6.067   0.499
   40    HB2  GLU  10           1HB      GLU  10 -14.939  -6.794   2.661
   41    HB3  GLU  10           2HB      GLU  10 -13.641  -5.965   3.508
   42    HG2  GLU  10           1HG      GLU  10 -15.634  -4.583   3.363
   43    HG3  GLU  10           2HG      GLU  10 -14.287  -3.861   2.485
   44    H    LYS  11           H        LYS  11 -11.136  -6.350   0.092
   45    HA   LYS  11           HA       LYS  11 -10.093  -3.828   1.196
   46    HB2  LYS  11           1HB      LYS  11  -8.541  -6.382   0.736
   47    HB3  LYS  11           2HB      LYS  11  -7.826  -4.838   1.183
   48    HG2  LYS  11           1HG      LYS  11  -8.810  -4.882   3.319
   49    HG3  LYS  11           2HG      LYS  11  -9.911  -6.187   2.870
   50    HD2  LYS  11           1HD      LYS  11  -8.016  -7.717   2.659
   51    HD3  LYS  11           2HD      LYS  11  -6.908  -6.412   3.089
   52    HE2  LYS  11           1HE      LYS  11  -9.155  -7.041   4.937
   53    HE3  LYS  11           2HE      LYS  11  -7.775  -8.137   4.889
   54    HZ1  LYS  11           3HZ      LYS  11  -6.317  -6.351   5.457
   55    HZ2  LYS  11           1HZ      LYS  11  -7.584  -6.364   6.578
   56    HZ3  LYS  11           2HZ      LYS  11  -7.561  -5.212   5.340
   57    HA   PRO  12           HA       PRO  12 -10.099  -3.616  -3.411
   58    HB2  PRO  12           1HB      PRO  12 -10.831  -1.004  -3.502
   59    HB3  PRO  12           2HB      PRO  12 -11.999  -2.324  -3.371
   60    HG2  PRO  12           1HG      PRO  12 -10.902  -0.545  -1.228
   61    HG3  PRO  12           2HG      PRO  12 -12.570  -1.089  -1.486
   62    HD2  PRO  12           1HD      PRO  12 -10.936  -2.223   0.352
   63    HD3  PRO  12           2HD      PRO  12 -12.184  -3.143  -0.513
   64    H    TYR  13           H        TYR  13  -8.894  -1.236  -1.062
   65    HA   TYR  13           HA       TYR  13  -6.599  -0.746  -2.842
   66    HB2  TYR  13           1HB      TYR  13  -7.272   1.098  -0.588
   67    HB3  TYR  13           2HB      TYR  13  -6.500   1.452  -2.129
   68    HD1  TYR  13           HD1      TYR  13  -7.899   1.582  -4.199
   69    HD2  TYR  13           HD2      TYR  13  -9.621   1.284  -0.320
   70    HE1  TYR  13           HE1      TYR  13 -10.047   2.372  -5.099
   71    HE2  TYR  13           HE2      TYR  13 -11.775   2.072  -1.209
   72    HH   TYR  13           HH       TYR  13 -12.237   2.645  -4.665
   73    H    LYS  14           H        LYS  14  -4.608  -1.232  -2.153
   74    HA   LYS  14           HA       LYS  14  -4.011  -1.474   0.671
   75    HB2  LYS  14           1HB      LYS  14  -4.923  -3.694   0.103
   76    HB3  LYS  14           2HB      LYS  14  -3.727  -3.852  -1.177
   77    HG2  LYS  14           1HG      LYS  14  -2.758  -3.321   1.578
   78    HG3  LYS  14           2HG      LYS  14  -3.376  -4.932   1.203
   79    HD2  LYS  14           1HD      LYS  14  -1.812  -5.045  -0.710
   80    HD3  LYS  14           2HD      LYS  14  -1.159  -3.474  -0.237
   81    HE2  LYS  14           1HE      LYS  14   0.322  -5.047   0.679
   82    HE3  LYS  14           2HE      LYS  14  -0.689  -4.536   2.030
   83    HZ1  LYS  14           3HZ      LYS  14  -2.078  -6.618   1.142
   84    HZ2  LYS  14           1HZ      LYS  14  -0.876  -6.744   2.327
   85    HZ3  LYS  14           2HZ      LYS  14  -0.519  -7.120   0.717
   86    H    CYS  15           H        CYS  15  -2.118  -0.516   0.951
   87    HA   CYS  15           HA       CYS  15  -0.385   0.085  -1.235
   88    HB2  CYS  15           1HB      CYS  15  -0.656   1.602   0.689
   89    HB3  CYS  15           2HB      CYS  15   0.079   0.395   1.739
   90    H    SER  16           H        SER  16   0.768  -1.482  -2.165
   91    HA   SER  16           HA       SER  16   1.659  -3.812  -0.790
   92    HB2  SER  16           1HB      SER  16   2.641  -4.471  -2.869
   93    HB3  SER  16           2HB      SER  16   1.129  -3.654  -3.262
   94    HG   SER  16           HG       SER  16   3.610  -3.038  -4.038
   95    H    GLU  17           H        GLU  17   3.162  -0.775  -1.736
   96    HA   GLU  17           HA       GLU  17   5.817  -1.218  -1.470
   97    HB2  GLU  17           1HB      GLU  17   4.221   1.105  -0.385
   98    HB3  GLU  17           2HB      GLU  17   5.977   1.089  -0.465
   99    HG2  GLU  17           1HG      GLU  17   6.010   1.201  -2.768
  100    HG3  GLU  17           2HG      GLU  17   4.374   0.563  -2.925
  101    H    CYS  18           H        CYS  18   3.752  -0.308   1.296
  102    HA   CYS  18           HA       CYS  18   5.745  -1.519   3.084
  103    HB2  CYS  18           1HB      CYS  18   4.680  -0.196   4.871
  104    HB3  CYS  18           2HB      CYS  18   5.248   0.824   3.553
  105    H    GLY  19           H        GLY  19   2.309  -1.491   2.284
  106    HA2  GLY  19           1HA      GLY  19   1.129  -3.621   2.338
  107    HA3  GLY  19           2HA      GLY  19   2.042  -4.019   3.786
  108    H    LYS  20           H        LYS  20   0.476  -0.937   3.088
  109    HA   LYS  20           HA       LYS  20  -1.306  -1.424   5.384
  110    HB2  LYS  20           1HB      LYS  20   0.540   0.477   5.340
  111    HB3  LYS  20           2HB      LYS  20  -0.698   1.341   4.438
  112    HG2  LYS  20           1HG      LYS  20  -2.169   1.366   6.239
  113    HG3  LYS  20           2HG      LYS  20  -1.325   0.055   7.067
  114    HD2  LYS  20           1HD      LYS  20   0.666   1.759   7.081
  115    HD3  LYS  20           2HD      LYS  20  -0.620   2.950   6.873
  116    HE2  LYS  20           1HE      LYS  20  -0.317   2.798   9.192
  117    HE3  LYS  20           2HE      LYS  20  -1.750   1.825   8.864
  118    HZ1  LYS  20           3HZ      LYS  20  -0.490   0.513  10.281
  119    HZ2  LYS  20           1HZ      LYS  20   0.976   0.919   9.541
  120    HZ3  LYS  20           2HZ      LYS  20  -0.109  -0.113   8.756
  121    H    ALA  21           H        ALA  21  -3.408  -1.520   4.967
  122    HA   ALA  21           HA       ALA  21  -4.374  -0.497   2.385
  123    HB1  ALA  21           3HB      ALA  21  -4.626  -2.988   3.283
  124    HB2  ALA  21           1HB      ALA  21  -6.070  -2.293   4.020
  125    HB3  ALA  21           2HB      ALA  21  -5.849  -2.219   2.272
  126    H    PHE  22           H        PHE  22  -6.560   0.423   2.343
  127    HA   PHE  22           HA       PHE  22  -7.558   1.499   4.854
  128    HB2  PHE  22           1HB      PHE  22  -6.865   3.355   2.571
  129    HB3  PHE  22           2HB      PHE  22  -7.482   3.803   4.158
  130    HD1  PHE  22           HD1      PHE  22  -4.582   2.167   2.505
  131    HD2  PHE  22           HD2      PHE  22  -6.011   4.374   5.852
  132    HE1  PHE  22           HE1      PHE  22  -2.275   2.411   3.326
  133    HE2  PHE  22           HE2      PHE  22  -3.707   4.623   6.677
  134    HZ   PHE  22           HZ       PHE  22  -1.835   3.641   5.413
  135    H    HIS  23           H        HIS  23  -9.697   2.346   4.706
  136    HA   HIS  23           HA       HIS  23 -11.263   1.044   2.659
  137    HB2  HIS  23           1HB      HIS  23 -12.030   1.024   4.986
  138    HB3  HIS  23           2HB      HIS  23 -12.112   2.783   4.986
  139    HD1  HIS  23           HD1      HIS  23 -14.065  -0.206   4.218
  140    HD2  HIS  23           HD2      HIS  23 -14.178   3.826   3.222
  141    HE1  HIS  23           HE1      HIS  23 -16.373   0.196   3.304
  142    H    ARG  24           H        ARG  24 -10.238   4.286   3.463
  143    HA   ARG  24           HA       ARG  24 -11.916   5.406   1.341
  144    HB2  ARG  24           1HB      ARG  24 -10.714   7.575   2.317
  145    HB3  ARG  24           2HB      ARG  24 -12.139   6.874   3.073
  146    HG2  ARG  24           1HG      ARG  24  -9.449   5.947   3.945
  147    HG3  ARG  24           2HG      ARG  24 -10.036   7.519   4.490
  148    HD2  ARG  24           1HD      ARG  24 -11.526   4.916   4.803
  149    HD3  ARG  24           2HD      ARG  24 -10.554   5.676   6.062
  150    HE   ARG  24           HE       ARG  24 -12.651   7.330   4.951
  151   HH11  ARG  24          1HH1      ARG  24 -11.722   5.081   7.440
  152   HH12  ARG  24          2HH1      ARG  24 -12.966   5.580   8.538
  153   HH21  ARG  24          1HH2      ARG  24 -14.293   7.996   6.387
  154   HH22  ARG  24          2HH2      ARG  24 -14.429   7.238   7.937
  155    H    HIS  25           H        HIS  25 -10.929   4.914  -0.562
  156    HA   HIS  25           HA       HIS  25  -8.301   4.650  -1.193
  157    HB2  HIS  25           1HB      HIS  25 -10.480   4.555  -2.674
  158    HB3  HIS  25           2HB      HIS  25 -10.010   6.198  -3.099
  159    HD1  HIS  25           HD1      HIS  25  -9.927   4.606  -5.463
  160    HD2  HIS  25           HD2      HIS  25  -6.778   4.428  -2.759
  161    HE1  HIS  25           HE1      HIS  25  -7.972   3.710  -6.766
  162    H    THR  26           H        THR  26 -10.022   7.629  -0.593
  163    HA   THR  26           HA       THR  26  -8.157   9.438  -1.668
  164    HB   THR  26           HB       THR  26  -9.161  11.077  -0.013
  165    HG1  THR  26           HG1      THR  26 -10.917  10.343   1.194
  166   HG21  THR  26          3HG2      THR  26 -10.261   9.869  -2.319
  167   HG22  THR  26          1HG2      THR  26 -10.592  11.475  -1.672
  168   HG23  THR  26          2HG2      THR  26 -11.584  10.103  -1.177
  169    H    HIS  27           H        HIS  27  -8.566   8.265   1.672
  170    HA   HIS  27           HA       HIS  27  -6.434   9.652   2.814
  171    HB2  HIS  27           1HB      HIS  27  -7.905   7.143   3.517
  172    HB3  HIS  27           2HB      HIS  27  -6.445   7.557   4.412
  173    HD1  HIS  27           HD1      HIS  27  -7.975   7.855   6.532
  174    HD2  HIS  27           HD2      HIS  27  -8.691  10.548   3.450
  175    HE1  HIS  27           HE1      HIS  27  -9.357   9.693   7.551
  176    H    LEU  28           H        LEU  28  -6.507   6.370   1.443
  177    HA   LEU  28           HA       LEU  28  -3.943   5.550   1.937
  178    HB2  LEU  28           1HB      LEU  28  -5.361   4.000   0.925
  179    HB3  LEU  28           2HB      LEU  28  -5.770   5.098  -0.392
  180    HG   LEU  28           HG       LEU  28  -3.287   4.812  -1.077
  181   HD11  LEU  28          1HD1      LEU  28  -2.752   3.605   1.078
  182   HD12  LEU  28          2HD1      LEU  28  -2.200   2.828  -0.406
  183   HD13  LEU  28          3HD1      LEU  28  -3.639   2.229   0.420
  184   HD21  LEU  28          3HD2      LEU  28  -5.659   3.181  -1.555
  185   HD22  LEU  28          1HD2      LEU  28  -4.146   2.348  -1.913
  186   HD23  LEU  28          2HD2      LEU  28  -4.514   3.884  -2.699
  187    H    ASN  29           H        ASN  29  -5.002   7.289  -0.995
  188    HA   ASN  29           HA       ASN  29  -2.592   7.604  -2.254
  189    HB2  ASN  29           1HB      ASN  29  -4.773   8.336  -3.175
  190    HB3  ASN  29           2HB      ASN  29  -4.762   9.705  -2.067
  191   HD21  ASN  29          1HD2      ASN  29  -4.793  11.203  -3.721
  192   HD22  ASN  29          2HD2      ASN  29  -3.420  11.504  -4.726
  193    H    GLU  30           H        GLU  30  -3.922   9.587   0.360
  194    HA   GLU  30           HA       GLU  30  -1.838  11.496   0.396
  195    HB2  GLU  30           1HB      GLU  30  -3.906  10.649   2.408
  196    HB3  GLU  30           2HB      GLU  30  -2.683  11.847   2.810
  197    HG2  GLU  30           1HG      GLU  30  -4.301  12.217   0.341
  198    HG3  GLU  30           2HG      GLU  30  -5.033  12.561   1.908
  199    H    HIS  31           H        HIS  31  -2.133   8.296   1.683
  200    HA   HIS  31           HA       HIS  31   0.013   8.546   3.578
  201    HB2  HIS  31           1HB      HIS  31  -1.413   6.867   4.244
  202    HB3  HIS  31           2HB      HIS  31  -1.731   6.335   2.595
  203    HD1  HIS  31           HD1      HIS  31   0.614   5.848   5.453
  204    HD2  HIS  31           HD2      HIS  31   0.096   4.461   1.570
  205    HE1  HIS  31           HE1      HIS  31   2.136   3.857   5.241
  206    H    ARG  32           H        ARG  32  -0.363   6.816   0.482
  207    HA   ARG  32           HA       ARG  32   2.071   5.724   0.113
  208    HB2  ARG  32           1HB      ARG  32   0.462   7.267  -1.927
  209    HB3  ARG  32           2HB      ARG  32   1.824   6.229  -2.330
  210    HG2  ARG  32           1HG      ARG  32   0.681   4.289  -1.726
  211    HG3  ARG  32           2HG      ARG  32  -0.526   5.182  -0.798
  212    HD2  ARG  32           1HD      ARG  32  -1.639   5.905  -2.705
  213    HD3  ARG  32           2HD      ARG  32  -0.241   5.627  -3.743
  214    HE   ARG  32           HE       ARG  32  -1.220   3.203  -2.609
  215   HH11  ARG  32          1HH1      ARG  32  -1.780   5.540  -5.128
  216   HH12  ARG  32          2HH1      ARG  32  -2.579   4.414  -6.174
  217   HH21  ARG  32          1HH2      ARG  32  -2.272   1.712  -3.977
  218   HH22  ARG  32          2HH2      ARG  32  -2.860   2.237  -5.518
  219    H    ARG  33           H        ARG  33   1.373   9.111   0.247
  220    HA   ARG  33           HA       ARG  33   3.480  10.266  -1.087
  221    HB2  ARG  33           1HB      ARG  33   2.215  11.094   1.529
  222    HB3  ARG  33           2HB      ARG  33   3.322  12.106   0.611
  223    HG2  ARG  33           1HG      ARG  33   1.745  12.007  -1.301
  224    HG3  ARG  33           2HG      ARG  33   0.618  11.125  -0.270
  225    HD2  ARG  33           1HD      ARG  33   1.726  13.843   0.405
  226    HD3  ARG  33           2HD      ARG  33   0.202  13.595  -0.445
  227    HE   ARG  33           HE       ARG  33  -0.762  12.869   1.528
  228   HH11  ARG  33          1HH1      ARG  33   2.670  13.293   1.933
  229   HH12  ARG  33          2HH1      ARG  33   2.613  13.171   3.660
  230   HH21  ARG  33          1HH2      ARG  33  -0.850  12.706   3.801
  231   HH22  ARG  33          2HH2      ARG  33   0.611  12.836   4.722
  232    H    ILE  34           H        ILE  34   3.457   8.958   2.208
  233    HA   ILE  34           HA       ILE  34   5.956   9.703   3.078
  234    HB   ILE  34           HB       ILE  34   5.937   7.813   4.565
  235   HG12  ILE  34          1HG1      ILE  34   3.572   6.651   3.114
  236   HG13  ILE  34          2HG1      ILE  34   5.216   6.225   2.649
  237   HG21  ILE  34          1HG2      ILE  34   3.145   8.844   4.077
  238   HG22  ILE  34          2HG2      ILE  34   3.690   8.037   5.546
  239   HG23  ILE  34          3HG2      ILE  34   4.380   9.593   5.088
  240   HD11  ILE  34          3HD1      ILE  34   5.645   5.205   4.717
  241   HD12  ILE  34          1HD1      ILE  34   4.221   5.931   5.462
  242   HD13  ILE  34          2HD1      ILE  34   4.033   4.665   4.248
  243    H    HIS  35           H        HIS  35   5.145   7.458   0.590
  244    HA   HIS  35           HA       HIS  35   7.780   6.229   0.571
  245    HB2  HIS  35           1HB      HIS  35   5.434   5.862  -1.304
  246    HB3  HIS  35           2HB      HIS  35   6.909   4.899  -1.307
  247    HD1  HIS  35           HD1      HIS  35   7.242   4.196   1.599
  248    HD2  HIS  35           HD2      HIS  35   3.549   4.203  -0.303
  249    HE1  HIS  35           HE1      HIS  35   5.779   2.674   2.966
  250    H    THR  36           H        THR  36   5.941   8.628  -1.190
  251    HA   THR  36           HA       THR  36   8.112   8.946  -3.131
  252    HB   THR  36           HB       THR  36   6.565  10.469  -4.322
  253    HG1  THR  36           HG1      THR  36   5.368  10.833  -2.176
  254   HG21  THR  36          3HG2      THR  36   6.468   8.285  -5.138
  255   HG22  THR  36          1HG2      THR  36   4.780   8.663  -4.796
  256   HG23  THR  36          2HG2      THR  36   5.706   7.668  -3.672
  257    H    GLY  37           H        GLY  37   9.594   9.887  -1.609
  258    HA2  GLY  37           1HA      GLY  37  10.468  12.232  -1.558
  259    HA3  GLY  37           2HA      GLY  37   8.903  12.669  -0.888
  260    H    TYR  38           H        TYR  38  11.633  10.470  -0.260
  261    HA   TYR  38           HA       TYR  38  11.892  11.425   2.427
  262    HB2  TYR  38           1HB      TYR  38  11.194   9.550   3.645
  263    HB3  TYR  38           2HB      TYR  38   9.929   9.748   2.438
  264    HD1  TYR  38           HD2      TYR  38  10.138   8.324   0.291
  265    HD2  TYR  38           HD1      TYR  38  12.272   7.498   3.878
  266    HE1  TYR  38           HE2      TYR  38  10.478   6.004  -0.452
  267    HE2  TYR  38           HE1      TYR  38  12.618   5.176   3.145
  268    HH   TYR  38           HH       TYR  38  11.009   3.617   1.153
  269    H    ARG  39           H        ARG  39  13.752  10.578   3.502
  270    HA   ARG  39           HA       ARG  39  15.826   9.794   1.656
  271    HB2  ARG  39           1HB      ARG  39  15.843  10.408   4.612
  272    HB3  ARG  39           2HB      ARG  39  17.281   9.941   3.714
  273    HG2  ARG  39           1HG      ARG  39  15.677  12.217   2.687
  274    HG3  ARG  39           2HG      ARG  39  16.657  12.468   4.134
  275    HD2  ARG  39           1HD      ARG  39  18.629  12.201   3.012
  276    HD3  ARG  39           2HD      ARG  39  17.925  11.116   1.814
  277    HE   ARG  39           HE       ARG  39  16.748  13.430   1.192
  278   HH11  ARG  39          1HH1      ARG  39  20.076  12.654   1.858
  279   HH12  ARG  39          2HH1      ARG  39  20.708  13.892   0.824
  280   HH21  ARG  39          1HH2      ARG  39  17.568  15.064  -0.173
  281   HH22  ARG  39          2HH2      ARG  39  19.281  15.262  -0.331
  282    HA   PRO  40           HA       PRO  40  15.681   5.457   2.387
  283    HB2  PRO  40           1HB      PRO  40  18.239   4.822   1.738
  284    HB3  PRO  40           2HB      PRO  40  17.021   5.251   0.532
  285    HG2  PRO  40           1HG      PRO  40  19.173   6.947   1.738
  286    HG3  PRO  40           2HG      PRO  40  18.650   6.839   0.047
  287    HD2  PRO  40           1HD      PRO  40  17.873   8.848   1.687
  288    HD3  PRO  40           2HD      PRO  40  16.837   8.221   0.389
  289    H    SER  41           H        SER  41  15.925   4.157   4.110
  290    HA   SER  41           HA       SER  41  17.943   4.906   6.123
  291    HB2  SER  41           1HB      SER  41  15.081   4.100   6.388
  292    HB3  SER  41           2HB      SER  41  16.203   3.613   7.658
  293    HG   SER  41           HG       SER  41  15.029   5.869   7.550
  294    H    GLY  42           H        GLY  42  18.605   3.183   4.045
  295    HA2  GLY  42           1HA      GLY  42  20.084   1.274   4.446
  296    HA3  GLY  42           2HA      GLY  42  18.836   0.621   5.497
  297    HA   PRO  43           HA       PRO  43  17.436   0.118   0.861
  298    HB2  PRO  43           1HB      PRO  43  19.485   0.089  -0.920
  299    HB3  PRO  43           2HB      PRO  43  18.602   1.560  -0.495
  300    HG2  PRO  43           1HG      PRO  43  21.244   0.579   0.513
  301    HG3  PRO  43           2HG      PRO  43  20.768   2.219   0.037
  302    HD2  PRO  43           1HD      PRO  43  20.894   1.432   2.625
  303    HD3  PRO  43           2HD      PRO  43  19.722   2.635   2.048
  304    H    SER  44           H        SER  44  18.178  -1.626  -0.916
  305    HA   SER  44           HA       SER  44  18.479  -3.853  -1.283
  306    HB2  SER  44           1HB      SER  44  20.842  -3.329   0.534
  307    HB3  SER  44           2HB      SER  44  20.609  -4.820  -0.378
  308    HG   SER  44           HG       SER  44  21.233  -3.834  -2.129
  309    H    SER  45           H        SER  45  16.566  -3.298   0.631
  310    HA   SER  45           HA       SER  45  17.015  -5.267   2.760
  311    HB2  SER  45           1HB      SER  45  14.951  -3.081   2.440
  312    HB3  SER  45           2HB      SER  45  14.905  -4.276   3.736
  313    HG   SER  45           HG       SER  45  17.299  -2.908   3.352
  314    H    GLY  46           H        GLY  46  16.631  -7.219   1.798
  315    HA2  GLY  46           1HA      GLY  46  14.607  -7.764  -0.072
  316    HA3  GLY  46           2HA      GLY  46  15.419  -8.961   0.926
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -11.419 -28.933  -0.708
    2    HA2  GLY   1           1HA      GLY   1 -10.702 -26.108  -0.281
    3    HA3  GLY   1           2HA      GLY   1 -10.097 -27.462   0.661
    4    H    SER   2           H        SER   2  -9.544 -25.403  -1.983
    5    HA   SER   2           HA       SER   2  -7.223 -27.029  -2.794
    6    HB2  SER   2           1HB      SER   2  -9.181 -26.569  -4.479
    7    HB3  SER   2           2HB      SER   2  -8.431 -24.979  -4.618
    8    HG   SER   2           HG       SER   2  -7.000 -27.403  -4.937
    9    H    SER   3           H        SER   3  -7.063 -25.298  -0.632
   10    HA   SER   3           HA       SER   3  -6.057 -23.395   0.178
   11    HB2  SER   3           1HB      SER   3  -4.065 -24.223  -1.948
   12    HB3  SER   3           2HB      SER   3  -3.718 -23.200  -0.554
   13    HG   SER   3           HG       SER   3  -3.385 -24.973   0.501
   14    H    GLY   4           H        GLY   4  -8.020 -22.681  -1.654
   15    HA2  GLY   4           1HA      GLY   4  -6.977 -20.858  -3.613
   16    HA3  GLY   4           2HA      GLY   4  -8.662 -21.040  -3.149
   17    H    SER   5           H        SER   5  -9.531 -19.726  -1.570
   18    HA   SER   5           HA       SER   5  -7.950 -17.996   0.051
   19    HB2  SER   5           1HB      SER   5  -8.560 -15.864  -0.963
   20    HB3  SER   5           2HB      SER   5  -7.700 -16.856  -2.140
   21    HG   SER   5           HG       SER   5  -9.389 -16.342  -3.315
   22    H    SER   6           H        SER   6  -9.097 -17.402   1.789
   23    HA   SER   6           HA       SER   6 -11.629 -18.415   2.309
   24    HB2  SER   6           1HB      SER   6 -10.216 -16.069   3.600
   25    HB3  SER   6           2HB      SER   6 -11.650 -16.859   4.258
   26    HG   SER   6           HG       SER   6 -10.172 -18.843   3.962
   27    H    GLY   7           H        GLY   7 -13.509 -16.926   3.063
   28    HA2  GLY   7           1HA      GLY   7 -14.195 -15.266   0.748
   29    HA3  GLY   7           2HA      GLY   7 -15.327 -15.924   1.921
   30    H    SER   8           H        SER   8 -15.920 -14.715   3.648
   31    HA   SER   8           HA       SER   8 -15.891 -12.020   3.655
   32    HB2  SER   8           1HB      SER   8 -16.253 -12.100   6.113
   33    HB3  SER   8           2HB      SER   8 -17.223 -13.290   5.246
   34    HG   SER   8           HG       SER   8 -15.507 -13.718   7.206
   35    H    GLY   9           H        GLY   9 -14.258 -10.639   3.458
   36    HA2  GLY   9           1HA      GLY   9 -12.487  -9.662   5.030
   37    HA3  GLY   9           2HA      GLY   9 -11.732 -11.239   4.854
   38    H    GLU  10           H        GLU  10 -12.998  -8.579   2.849
   39    HA   GLU  10           HA       GLU  10 -10.572  -8.775   1.212
   40    HB2  GLU  10           1HB      GLU  10 -12.711  -9.928   0.228
   41    HB3  GLU  10           2HB      GLU  10 -13.205  -8.279  -0.126
   42    HG2  GLU  10           1HG      GLU  10 -12.178  -8.928  -2.081
   43    HG3  GLU  10           2HG      GLU  10 -10.889  -8.068  -1.242
   44    H    LYS  11           H        LYS  11  -9.736  -6.855   0.586
   45    HA   LYS  11           HA       LYS  11 -11.281  -4.437   1.263
   46    HB2  LYS  11           1HB      LYS  11  -8.277  -4.771   1.333
   47    HB3  LYS  11           2HB      LYS  11  -9.176  -3.332   1.796
   48    HG2  LYS  11           1HG      LYS  11 -10.162  -4.498   3.663
   49    HG3  LYS  11           2HG      LYS  11  -9.390  -6.005   3.167
   50    HD2  LYS  11           1HD      LYS  11  -7.750  -3.562   3.732
   51    HD3  LYS  11           2HD      LYS  11  -8.306  -4.596   5.050
   52    HE2  LYS  11           1HE      LYS  11  -6.799  -5.636   2.660
   53    HE3  LYS  11           2HE      LYS  11  -6.005  -5.101   4.140
   54    HZ1  LYS  11           3HZ      LYS  11  -6.294  -7.446   4.254
   55    HZ2  LYS  11           1HZ      LYS  11  -7.935  -7.336   3.856
   56    HZ3  LYS  11           2HZ      LYS  11  -7.385  -6.753   5.345
   57    HA   PRO  12           HA       PRO  12 -10.932  -3.281  -2.975
   58    HB2  PRO  12           1HB      PRO  12 -11.376  -0.616  -2.709
   59    HB3  PRO  12           2HB      PRO  12 -12.658  -1.823  -2.558
   60    HG2  PRO  12           1HG      PRO  12 -11.122  -0.412  -0.410
   61    HG3  PRO  12           2HG      PRO  12 -12.859  -0.758  -0.500
   62    HD2  PRO  12           1HD      PRO  12 -11.152  -2.246   0.985
   63    HD3  PRO  12           2HD      PRO  12 -12.589  -2.936   0.204
   64    H    TYR  13           H        TYR  13  -9.341  -1.026  -0.708
   65    HA   TYR  13           HA       TYR  13  -7.163  -0.718  -2.659
   66    HB2  TYR  13           1HB      TYR  13  -7.561   1.057  -0.268
   67    HB3  TYR  13           2HB      TYR  13  -6.729   1.411  -1.778
   68    HD1  TYR  13           HD1      TYR  13  -7.978   2.050  -3.768
   69    HD2  TYR  13           HD2      TYR  13  -9.974   1.234  -0.100
   70    HE1  TYR  13           HE1      TYR  13 -10.014   3.117  -4.645
   71    HE2  TYR  13           HE2      TYR  13 -12.015   2.297  -0.967
   72    HH   TYR  13           HH       TYR  13 -12.834   3.640  -2.613
   73    H    LYS  14           H        LYS  14  -5.011  -0.909  -2.015
   74    HA   LYS  14           HA       LYS  14  -4.240  -1.505   0.661
   75    HB2  LYS  14           1HB      LYS  14  -5.381  -3.648  -0.206
   76    HB3  LYS  14           2HB      LYS  14  -3.961  -3.832  -1.227
   77    HG2  LYS  14           1HG      LYS  14  -2.697  -3.509   1.063
   78    HG3  LYS  14           2HG      LYS  14  -4.230  -4.088   1.718
   79    HD2  LYS  14           1HD      LYS  14  -4.083  -6.068   0.269
   80    HD3  LYS  14           2HD      LYS  14  -2.533  -5.491  -0.347
   81    HE2  LYS  14           1HE      LYS  14  -2.047  -7.101   1.325
   82    HE3  LYS  14           2HE      LYS  14  -1.702  -5.522   2.027
   83    HZ1  LYS  14           3HZ      LYS  14  -4.309  -5.958   2.663
   84    HZ2  LYS  14           1HZ      LYS  14  -2.990  -6.181   3.698
   85    HZ3  LYS  14           2HZ      LYS  14  -3.617  -7.492   2.834
   86    H    CYS  15           H        CYS  15  -2.197  -0.869   0.880
   87    HA   CYS  15           HA       CYS  15  -0.651  -0.172  -1.444
   88    HB2  CYS  15           1HB      CYS  15  -0.547   1.324   0.425
   89    HB3  CYS  15           2HB      CYS  15  -0.098   0.020   1.519
   90    H    SER  16           H        SER  16   1.498  -0.914  -1.881
   91    HA   SER  16           HA       SER  16   1.917  -3.704  -1.038
   92    HB2  SER  16           1HB      SER  16   1.504  -3.175  -3.507
   93    HB3  SER  16           2HB      SER  16   3.099  -2.423  -3.502
   94    HG   SER  16           HG       SER  16   2.880  -4.997  -2.452
   95    H    GLU  17           H        GLU  17   3.482  -0.593  -1.555
   96    HA   GLU  17           HA       GLU  17   6.126  -1.204  -1.146
   97    HB2  GLU  17           1HB      GLU  17   4.552   1.197  -0.211
   98    HB3  GLU  17           2HB      GLU  17   6.304   1.092  -0.105
   99    HG2  GLU  17           1HG      GLU  17   4.726   0.881  -2.658
  100    HG3  GLU  17           2HG      GLU  17   5.506   2.349  -2.071
  101    H    CYS  18           H        CYS  18   3.931  -0.107   1.447
  102    HA   CYS  18           HA       CYS  18   5.693  -1.383   3.406
  103    HB2  CYS  18           1HB      CYS  18   4.507  -0.065   5.079
  104    HB3  CYS  18           2HB      CYS  18   5.073   0.976   3.777
  105    H    GLY  19           H        GLY  19   2.336  -1.368   2.301
  106    HA2  GLY  19           1HA      GLY  19   1.109  -3.442   2.214
  107    HA3  GLY  19           2HA      GLY  19   1.985  -3.967   3.644
  108    H    LYS  20           H        LYS  20   0.444  -0.831   3.144
  109    HA   LYS  20           HA       LYS  20  -1.276  -1.407   5.458
  110    HB2  LYS  20           1HB      LYS  20   0.411   0.597   5.333
  111    HB3  LYS  20           2HB      LYS  20  -0.850   1.350   4.366
  112    HG2  LYS  20           1HG      LYS  20  -2.371   1.355   6.146
  113    HG3  LYS  20           2HG      LYS  20  -1.419   0.194   7.074
  114    HD2  LYS  20           1HD      LYS  20  -0.272   2.863   6.345
  115    HD3  LYS  20           2HD      LYS  20  -1.353   2.703   7.731
  116    HE2  LYS  20           1HE      LYS  20   0.750   2.433   8.676
  117    HE3  LYS  20           2HE      LYS  20   0.210   0.772   8.435
  118    HZ1  LYS  20           3HZ      LYS  20   2.570   1.755   7.600
  119    HZ2  LYS  20           1HZ      LYS  20   1.640   1.891   6.194
  120    HZ3  LYS  20           2HZ      LYS  20   1.816   0.388   6.949
  121    H    ALA  21           H        ALA  21  -3.423  -1.486   5.235
  122    HA   ALA  21           HA       ALA  21  -4.550  -0.838   2.601
  123    HB1  ALA  21           3HB      ALA  21  -5.713  -2.720   2.772
  124    HB2  ALA  21           1HB      ALA  21  -4.843  -3.072   4.266
  125    HB3  ALA  21           2HB      ALA  21  -6.386  -2.219   4.324
  126    H    PHE  22           H        PHE  22  -6.467   0.361   2.413
  127    HA   PHE  22           HA       PHE  22  -7.325   1.811   4.821
  128    HB2  PHE  22           1HB      PHE  22  -6.769   3.054   2.119
  129    HB3  PHE  22           2HB      PHE  22  -7.465   3.894   3.501
  130    HD1  PHE  22           HD2      PHE  22  -6.094   4.324   5.504
  131    HD2  PHE  22           HD1      PHE  22  -4.436   2.645   1.962
  132    HE1  PHE  22           HE2      PHE  22  -3.835   4.891   6.297
  133    HE2  PHE  22           HE1      PHE  22  -2.174   3.208   2.750
  134    HZ   PHE  22           HZ       PHE  22  -1.871   4.334   4.919
  135    H    HIS  23           H        HIS  23  -9.484   2.506   4.834
  136    HA   HIS  23           HA       HIS  23 -11.265   0.849   3.319
  137    HB2  HIS  23           1HB      HIS  23 -12.029   3.170   5.092
  138    HB3  HIS  23           2HB      HIS  23 -13.014   1.776   4.657
  139    HD1  HIS  23           HD1      HIS  23 -11.341  -0.566   5.384
  140    HD2  HIS  23           HD2      HIS  23 -11.427   2.879   7.703
  141    HE1  HIS  23           HE1      HIS  23 -10.599  -1.281   7.677
  142    H    ARG  24           H        ARG  24  -9.996   4.036   3.001
  143    HA   ARG  24           HA       ARG  24 -11.747   4.474   0.677
  144    HB2  ARG  24           1HB      ARG  24 -10.810   6.635   2.571
  145    HB3  ARG  24           2HB      ARG  24 -11.864   6.843   1.178
  146    HG2  ARG  24           1HG      ARG  24 -13.527   5.369   2.302
  147    HG3  ARG  24           2HG      ARG  24 -12.489   5.376   3.728
  148    HD2  ARG  24           1HD      ARG  24 -13.616   7.852   2.430
  149    HD3  ARG  24           2HD      ARG  24 -14.348   7.033   3.809
  150    HE   ARG  24           HE       ARG  24 -11.617   7.691   4.289
  151   HH11  ARG  24          1HH1      ARG  24 -14.841   9.001   4.222
  152   HH12  ARG  24          2HH1      ARG  24 -14.493  10.261   5.360
  153   HH21  ARG  24          1HH2      ARG  24 -11.146   9.345   5.787
  154   HH22  ARG  24          2HH2      ARG  24 -12.391  10.456   6.248
  155    H    HIS  25           H        HIS  25 -10.825   5.679  -1.046
  156    HA   HIS  25           HA       HIS  25  -8.104   5.104  -1.537
  157    HB2  HIS  25           1HB      HIS  25  -9.799   5.320  -3.323
  158    HB3  HIS  25           2HB      HIS  25  -9.913   7.045  -2.991
  159    HD1  HIS  25           HD1      HIS  25  -7.641   8.432  -3.451
  160    HD2  HIS  25           HD2      HIS  25  -7.858   4.627  -5.105
  161    HE1  HIS  25           HE1      HIS  25  -5.857   8.366  -5.222
  162    H    THR  26           H        THR  26  -9.776   8.175  -0.879
  163    HA   THR  26           HA       THR  26  -7.848  10.029  -1.077
  164    HB   THR  26           HB       THR  26  -9.927  10.783  -0.270
  165    HG1  THR  26           HG1      THR  26  -8.487  11.062   2.126
  166   HG21  THR  26          3HG2      THR  26 -10.517   8.626   0.861
  167   HG22  THR  26          1HG2      THR  26 -10.980  10.070   1.760
  168   HG23  THR  26          2HG2      THR  26  -9.553   9.151   2.240
  169    H    HIS  27           H        HIS  27  -8.131   7.718   1.591
  170    HA   HIS  27           HA       HIS  27  -5.981   8.730   3.120
  171    HB2  HIS  27           1HB      HIS  27  -7.478   6.136   3.049
  172    HB3  HIS  27           2HB      HIS  27  -6.008   6.262   4.010
  173    HD1  HIS  27           HD1      HIS  27  -8.267   5.717   5.716
  174    HD2  HIS  27           HD2      HIS  27  -7.497   9.596   4.441
  175    HE1  HIS  27           HE1      HIS  27  -9.440   7.211   7.363
  176    H    LEU  28           H        LEU  28  -6.125   5.819   1.059
  177    HA   LEU  28           HA       LEU  28  -3.467   5.107   1.159
  178    HB2  LEU  28           1HB      LEU  28  -5.115   3.693   0.129
  179    HB3  LEU  28           2HB      LEU  28  -5.412   4.888  -1.131
  180    HG   LEU  28           HG       LEU  28  -3.056   4.512  -1.911
  181   HD11  LEU  28          1HD1      LEU  28  -3.110   2.720   0.408
  182   HD12  LEU  28          2HD1      LEU  28  -1.748   3.486  -0.407
  183   HD13  LEU  28          3HD1      LEU  28  -2.447   2.006  -1.062
  184   HD21  LEU  28          3HD2      LEU  28  -5.385   3.066  -2.393
  185   HD22  LEU  28          1HD2      LEU  28  -4.124   1.847  -2.208
  186   HD23  LEU  28          2HD2      LEU  28  -3.943   3.127  -3.407
  187    H    ASN  29           H        ASN  29  -5.028   7.326  -1.137
  188    HA   ASN  29           HA       ASN  29  -2.841   7.921  -2.728
  189    HB2  ASN  29           1HB      ASN  29  -5.121   8.669  -3.242
  190    HB3  ASN  29           2HB      ASN  29  -5.072   9.781  -1.878
  191   HD21  ASN  29          1HD2      ASN  29  -5.616  11.314  -3.618
  192   HD22  ASN  29          2HD2      ASN  29  -4.318  12.037  -4.500
  193    H    GLU  30           H        GLU  30  -3.973   9.748   0.121
  194    HA   GLU  30           HA       GLU  30  -1.723  11.469   0.188
  195    HB2  GLU  30           1HB      GLU  30  -3.620  10.764   2.434
  196    HB3  GLU  30           2HB      GLU  30  -2.548  12.156   2.381
  197    HG2  GLU  30           1HG      GLU  30  -4.637  11.727   0.281
  198    HG3  GLU  30           2HG      GLU  30  -5.022  12.496   1.820
  199    H    HIS  31           H        HIS  31  -2.311   8.282   1.384
  200    HA   HIS  31           HA       HIS  31  -0.368   8.198   3.430
  201    HB2  HIS  31           1HB      HIS  31  -1.826   6.413   3.560
  202    HB3  HIS  31           2HB      HIS  31  -1.841   6.161   1.817
  203    HD1  HIS  31           HD1      HIS  31   0.447   5.608   4.792
  204    HD2  HIS  31           HD2      HIS  31  -0.210   4.158   0.954
  205    HE1  HIS  31           HE1      HIS  31   1.968   3.620   4.555
  206    H    ARG  32           H        ARG  32  -0.230   7.350  -0.012
  207    HA   ARG  32           HA       ARG  32   2.315   6.299  -0.153
  208    HB2  ARG  32           1HB      ARG  32   0.763   7.973  -2.120
  209    HB3  ARG  32           2HB      ARG  32   2.335   7.288  -2.509
  210    HG2  ARG  32           1HG      ARG  32   1.524   5.076  -2.324
  211    HG3  ARG  32           2HG      ARG  32   0.021   5.617  -1.574
  212    HD2  ARG  32           1HD      ARG  32  -0.287   4.996  -3.931
  213    HD3  ARG  32           2HD      ARG  32  -0.655   6.695  -3.635
  214    HE   ARG  32           HE       ARG  32   2.043   6.336  -4.468
  215   HH11  ARG  32          1HH1      ARG  32  -1.238   6.466  -5.627
  216   HH12  ARG  32          2HH1      ARG  32  -0.793   6.990  -7.218
  217   HH21  ARG  32          1HH2      ARG  32   2.641   7.026  -6.559
  218   HH22  ARG  32          2HH2      ARG  32   1.414   7.307  -7.747
  219    H    ARG  33           H        ARG  33   1.395   9.486   0.631
  220    HA   ARG  33           HA       ARG  33   3.397  11.101  -0.296
  221    HB2  ARG  33           1HB      ARG  33   1.958  11.067   2.346
  222    HB3  ARG  33           2HB      ARG  33   3.158  12.298   1.975
  223    HG2  ARG  33           1HG      ARG  33   0.730  11.752   0.284
  224    HG3  ARG  33           2HG      ARG  33   0.808  12.984   1.546
  225    HD2  ARG  33           1HD      ARG  33   2.595  12.836  -0.880
  226    HD3  ARG  33           2HD      ARG  33   1.217  13.918  -0.688
  227    HE   ARG  33           HE       ARG  33   3.165  14.174   1.403
  228   HH11  ARG  33          1HH1      ARG  33   2.284  15.176  -1.812
  229   HH12  ARG  33          2HH1      ARG  33   3.173  16.661  -1.733
  230   HH21  ARG  33          1HH2      ARG  33   4.339  16.126   1.519
  231   HH22  ARG  33          2HH2      ARG  33   4.342  17.200   0.162
  232    H    ILE  34           H        ILE  34   3.545   8.824   2.392
  233    HA   ILE  34           HA       ILE  34   6.139   9.588   3.275
  234    HB   ILE  34           HB       ILE  34   6.120   7.575   4.614
  235   HG12  ILE  34          1HG1      ILE  34   3.495   6.721   3.455
  236   HG13  ILE  34          2HG1      ILE  34   4.983   6.275   2.627
  237   HG21  ILE  34          1HG2      ILE  34   3.283   8.219   4.909
  238   HG22  ILE  34          2HG2      ILE  34   4.613   8.394   6.053
  239   HG23  ILE  34          3HG2      ILE  34   4.336   9.631   4.827
  240   HD11  ILE  34          3HD1      ILE  34   3.891   4.691   4.396
  241   HD12  ILE  34          1HD1      ILE  34   5.643   4.859   4.292
  242   HD13  ILE  34          2HD1      ILE  34   4.747   5.727   5.539
  243    H    HIS  35           H        HIS  35   4.955   7.505   0.775
  244    HA   HIS  35           HA       HIS  35   7.487   6.134   0.434
  245    HB2  HIS  35           1HB      HIS  35   4.879   6.043  -1.084
  246    HB3  HIS  35           2HB      HIS  35   6.308   5.142  -1.581
  247    HD1  HIS  35           HD1      HIS  35   7.264   4.018   1.073
  248    HD2  HIS  35           HD2      HIS  35   3.267   4.122  -0.057
  249    HE1  HIS  35           HE1      HIS  35   6.135   2.225   2.428
  250    H    THR  36           H        THR  36   5.683   8.753  -1.037
  251    HA   THR  36           HA       THR  36   7.200   9.009  -3.399
  252    HB   THR  36           HB       THR  36   6.124  11.056  -3.757
  253    HG1  THR  36           HG1      THR  36   6.142  11.242  -0.943
  254   HG21  THR  36          3HG2      THR  36   4.637   8.917  -3.098
  255   HG22  THR  36          1HG2      THR  36   3.940  10.452  -3.615
  256   HG23  THR  36          2HG2      THR  36   4.047  10.066  -1.897
  257    H    GLY  37           H        GLY  37   9.178   9.791  -3.762
  258    HA2  GLY  37           1HA      GLY  37  10.813  10.644  -1.565
  259    HA3  GLY  37           2HA      GLY  37  11.303  10.535  -3.249
  260    H    TYR  38           H        TYR  38  11.918  12.629  -1.349
  261    HA   TYR  38           HA       TYR  38  10.517  14.916  -1.331
  262    HB2  TYR  38           1HB      TYR  38  12.708  14.860  -0.361
  263    HB3  TYR  38           2HB      TYR  38  13.460  14.593  -1.930
  264    HD1  TYR  38           HD1      TYR  38  11.663  17.085   0.135
  265    HD2  TYR  38           HD2      TYR  38  14.031  16.412  -3.336
  266    HE1  TYR  38           HE1      TYR  38  11.952  19.513  -0.131
  267    HE2  TYR  38           HE2      TYR  38  14.328  18.838  -3.611
  268    HH   TYR  38           HH       TYR  38  13.945  20.849  -2.749
  269    H    ARG  39           H        ARG  39   9.965  16.580  -2.678
  270    HA   ARG  39           HA       ARG  39  10.769  16.396  -5.494
  271    HB2  ARG  39           1HB      ARG  39   7.969  16.474  -4.405
  272    HB3  ARG  39           2HB      ARG  39   8.330  17.087  -6.012
  273    HG2  ARG  39           1HG      ARG  39   9.036  14.305  -5.124
  274    HG3  ARG  39           2HG      ARG  39   7.505  14.718  -5.899
  275    HD2  ARG  39           1HD      ARG  39  10.176  15.364  -7.121
  276    HD3  ARG  39           2HD      ARG  39   9.343  13.837  -7.409
  277    HE   ARG  39           HE       ARG  39   7.489  15.751  -8.000
  278   HH11  ARG  39          1HH1      ARG  39  10.722  15.035  -9.075
  279   HH12  ARG  39          2HH1      ARG  39  10.474  15.672 -10.667
  280   HH21  ARG  39          1HH2      ARG  39   7.150  16.592 -10.093
  281   HH22  ARG  39          2HH2      ARG  39   8.442  16.558 -11.245
  282    HA   PRO  40           HA       PRO  40  11.417  20.730  -5.143
  283    HB2  PRO  40           1HB      PRO  40  11.136  21.456  -7.744
  284    HB3  PRO  40           2HB      PRO  40  12.547  20.580  -7.138
  285    HG2  PRO  40           1HG      PRO  40  10.138  19.531  -8.574
  286    HG3  PRO  40           2HG      PRO  40  11.847  19.118  -8.806
  287    HD2  PRO  40           1HD      PRO  40  10.148  17.551  -7.396
  288    HD3  PRO  40           2HD      PRO  40  11.874  17.681  -7.005
  289    H    SER  41           H        SER  41   8.448  19.378  -5.803
  290    HA   SER  41           HA       SER  41   6.942  21.608  -6.663
  291    HB2  SER  41           1HB      SER  41   6.224  19.173  -6.715
  292    HB3  SER  41           2HB      SER  41   5.898  19.319  -4.988
  293    HG   SER  41           HG       SER  41   4.004  19.763  -6.041
  294    H    GLY  42           H        GLY  42   7.426  23.425  -5.457
  295    HA2  GLY  42           1HA      GLY  42   6.297  24.741  -3.726
  296    HA3  GLY  42           2HA      GLY  42   6.464  23.350  -2.664
  297    HA   PRO  43           HA       PRO  43  10.228  26.365  -2.621
  298    HB2  PRO  43           1HB      PRO  43   9.444  28.185  -0.766
  299    HB3  PRO  43           2HB      PRO  43   9.186  28.409  -2.500
  300    HG2  PRO  43           1HG      PRO  43   7.270  27.455  -0.407
  301    HG3  PRO  43           2HG      PRO  43   6.997  28.596  -1.737
  302    HD2  PRO  43           1HD      PRO  43   6.217  26.005  -1.857
  303    HD3  PRO  43           2HD      PRO  43   6.733  26.915  -3.292
  304    H    SER  44           H        SER  44  11.664  25.263  -1.453
  305    HA   SER  44           HA       SER  44  11.039  24.701   1.371
  306    HB2  SER  44           1HB      SER  44  11.121  22.712  -0.338
  307    HB3  SER  44           2HB      SER  44  12.867  22.914  -0.196
  308    HG   SER  44           HG       SER  44  12.801  22.118   1.758
  309    H    SER  45           H        SER  45  12.133  26.535   2.090
  310    HA   SER  45           HA       SER  45  14.915  26.213   2.529
  311    HB2  SER  45           1HB      SER  45  14.831  27.060   0.123
  312    HB3  SER  45           2HB      SER  45  14.238  28.583   0.786
  313    HG   SER  45           HG       SER  45  16.764  27.589   0.731
  314    H    GLY  46           H        GLY  46  15.846  28.097   3.730
  315    HA2  GLY  46           1HA      GLY  46  15.648  29.933   5.164
  316    HA3  GLY  46           2HA      GLY  46  13.917  29.956   4.858
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1  -0.709 -25.935   3.901
    2    HA2  GLY   1           1HA      GLY   1   0.193 -23.729   2.537
    3    HA3  GLY   1           2HA      GLY   1   0.061 -24.983   1.313
    4    H    SER   2           H        SER   2  -1.452 -22.895   0.842
    5    HA   SER   2           HA       SER   2  -4.114 -23.935   1.004
    6    HB2  SER   2           1HB      SER   2  -3.299 -21.624   2.730
    7    HB3  SER   2           2HB      SER   2  -4.924 -21.661   2.046
    8    HG   SER   2           HG       SER   2  -4.686 -22.662   4.160
    9    H    SER   3           H        SER   3  -5.308 -23.245  -0.682
   10    HA   SER   3           HA       SER   3  -4.525 -20.794  -2.079
   11    HB2  SER   3           1HB      SER   3  -4.435 -21.872  -4.231
   12    HB3  SER   3           2HB      SER   3  -3.360 -22.752  -3.145
   13    HG   SER   3           HG       SER   3  -5.436 -23.681  -4.525
   14    H    GLY   4           H        GLY   4  -6.161 -19.960  -3.506
   15    HA2  GLY   4           1HA      GLY   4  -8.374 -20.041  -4.434
   16    HA3  GLY   4           2HA      GLY   4  -8.831 -21.148  -3.148
   17    H    SER   5           H        SER   5 -10.486 -20.079  -2.210
   18    HA   SER   5           HA       SER   5 -10.080 -17.277  -1.441
   19    HB2  SER   5           1HB      SER   5 -12.483 -18.970  -1.957
   20    HB3  SER   5           2HB      SER   5 -12.636 -17.645  -0.803
   21    HG   SER   5           HG       SER   5 -12.943 -16.510  -2.553
   22    H    SER   6           H        SER   6  -8.642 -17.824   0.297
   23    HA   SER   6           HA       SER   6  -9.761 -19.321   2.531
   24    HB2  SER   6           1HB      SER   6  -7.047 -18.303   1.807
   25    HB3  SER   6           2HB      SER   6  -7.408 -18.592   3.509
   26    HG   SER   6           HG       SER   6  -7.867 -20.519   1.485
   27    H    GLY   7           H        GLY   7  -8.289 -16.107   2.029
   28    HA2  GLY   7           1HA      GLY   7  -9.617 -15.178   4.477
   29    HA3  GLY   7           2HA      GLY   7  -8.305 -14.358   3.644
   30    H    SER   8           H        SER   8 -11.721 -14.785   3.885
   31    HA   SER   8           HA       SER   8 -12.529 -13.539   1.498
   32    HB2  SER   8           1HB      SER   8 -13.907 -14.842   3.310
   33    HB3  SER   8           2HB      SER   8 -14.119 -13.244   4.024
   34    HG   SER   8           HG       SER   8 -15.370 -12.671   2.407
   35    H    GLY   9           H        GLY   9 -11.909 -12.221   4.736
   36    HA2  GLY   9           1HA      GLY   9 -12.625  -9.552   4.100
   37    HA3  GLY   9           2HA      GLY   9 -11.651 -10.059   5.472
   38    H    GLU  10           H        GLU  10 -11.655  -8.534   2.443
   39    HA   GLU  10           HA       GLU  10  -8.802  -8.021   2.676
   40    HB2  GLU  10           1HB      GLU  10  -8.343  -8.580   0.338
   41    HB3  GLU  10           2HB      GLU  10  -8.892  -9.992   1.231
   42    HG2  GLU  10           1HG      GLU  10 -11.203  -9.485   0.309
   43    HG3  GLU  10           2HG      GLU  10 -10.397  -8.366  -0.790
   44    H    LYS  11           H        LYS  11  -8.275  -5.994   2.086
   45    HA   LYS  11           HA       LYS  11 -10.434  -4.274   1.142
   46    HB2  LYS  11           1HB      LYS  11  -7.863  -3.854   2.583
   47    HB3  LYS  11           2HB      LYS  11  -8.466  -2.532   1.593
   48    HG2  LYS  11           1HG      LYS  11 -10.651  -2.770   2.851
   49    HG3  LYS  11           2HG      LYS  11  -9.776  -3.822   3.966
   50    HD2  LYS  11           1HD      LYS  11  -8.466  -2.103   4.769
   51    HD3  LYS  11           2HD      LYS  11  -8.650  -1.138   3.303
   52    HE2  LYS  11           1HE      LYS  11  -9.887  -0.086   5.067
   53    HE3  LYS  11           2HE      LYS  11 -11.032  -0.772   3.916
   54    HZ1  LYS  11           3HZ      LYS  11 -11.050  -1.174   6.601
   55    HZ2  LYS  11           1HZ      LYS  11 -10.335  -2.592   6.019
   56    HZ3  LYS  11           2HZ      LYS  11 -11.861  -2.123   5.460
   57    HA   PRO  12           HA       PRO  12  -8.906  -4.019  -2.979
   58    HB2  PRO  12           1HB      PRO  12  -9.961  -1.619  -3.685
   59    HB3  PRO  12           2HB      PRO  12 -10.936  -3.084  -3.514
   60    HG2  PRO  12           1HG      PRO  12 -10.554  -0.828  -1.584
   61    HG3  PRO  12           2HG      PRO  12 -12.043  -1.685  -2.023
   62    HD2  PRO  12           1HD      PRO  12 -10.672  -2.217   0.251
   63    HD3  PRO  12           2HD      PRO  12 -11.580  -3.463  -0.630
   64    H    TYR  13           H        TYR  13  -8.570  -1.095  -0.979
   65    HA   TYR  13           HA       TYR  13  -6.208  -0.307  -2.507
   66    HB2  TYR  13           1HB      TYR  13  -7.456   1.190  -0.205
   67    HB3  TYR  13           2HB      TYR  13  -6.384   1.820  -1.450
   68    HD1  TYR  13           HD1      TYR  13  -7.290   1.689  -3.898
   69    HD2  TYR  13           HD2      TYR  13  -9.748   1.468  -0.432
   70    HE1  TYR  13           HE1      TYR  13  -9.237   2.357  -5.244
   71    HE2  TYR  13           HE2      TYR  13 -11.702   2.134  -1.768
   72    HH   TYR  13           HH       TYR  13 -11.450   3.418  -4.878
   73    H    LYS  14           H        LYS  14  -4.733  -1.878  -1.815
   74    HA   LYS  14           HA       LYS  14  -3.871  -1.597   0.990
   75    HB2  LYS  14           1HB      LYS  14  -4.875  -3.851   0.235
   76    HB3  LYS  14           2HB      LYS  14  -3.379  -4.061  -0.665
   77    HG2  LYS  14           1HG      LYS  14  -3.297  -3.410   2.249
   78    HG3  LYS  14           2HG      LYS  14  -3.598  -5.063   1.710
   79    HD2  LYS  14           1HD      LYS  14  -1.306  -3.579   0.523
   80    HD3  LYS  14           2HD      LYS  14  -1.149  -4.186   2.172
   81    HE2  LYS  14           1HE      LYS  14  -1.392  -6.409   1.501
   82    HE3  LYS  14           2HE      LYS  14  -2.107  -5.961  -0.046
   83    HZ1  LYS  14           3HZ      LYS  14  -0.063  -5.405  -0.927
   84    HZ2  LYS  14           1HZ      LYS  14   0.325  -6.750   0.024
   85    HZ3  LYS  14           2HZ      LYS  14   0.666  -5.190   0.584
   86    H    CYS  15           H        CYS  15  -2.149  -0.289   0.931
   87    HA   CYS  15           HA       CYS  15  -0.428   0.174  -1.178
   88    HB2  CYS  15           1HB      CYS  15  -0.594   1.511   0.944
   89    HB3  CYS  15           2HB      CYS  15   0.358   0.261   1.739
   90    H    SER  16           H        SER  16   0.342  -1.586  -2.257
   91    HA   SER  16           HA       SER  16   1.347  -3.928  -1.084
   92    HB2  SER  16           1HB      SER  16   1.827  -2.677  -3.792
   93    HB3  SER  16           2HB      SER  16   2.471  -4.255  -3.338
   94    HG   SER  16           HG       SER  16  -0.261  -3.750  -2.974
   95    H    GLU  17           H        GLU  17   2.842  -0.853  -1.799
   96    HA   GLU  17           HA       GLU  17   5.522  -1.455  -1.775
   97    HB2  GLU  17           1HB      GLU  17   3.931   0.906  -0.902
   98    HB3  GLU  17           2HB      GLU  17   5.625   0.847  -0.439
   99    HG2  GLU  17           1HG      GLU  17   5.503   2.067  -2.455
  100    HG3  GLU  17           2HG      GLU  17   6.179   0.489  -2.854
  101    H    CYS  18           H        CYS  18   3.644  -0.496   1.106
  102    HA   CYS  18           HA       CYS  18   5.674  -1.797   2.779
  103    HB2  CYS  18           1HB      CYS  18   4.720  -0.507   4.634
  104    HB3  CYS  18           2HB      CYS  18   5.182   0.550   3.303
  105    H    GLY  19           H        GLY  19   2.185  -1.679   2.197
  106    HA2  GLY  19           1HA      GLY  19   1.063  -3.885   2.212
  107    HA3  GLY  19           2HA      GLY  19   1.955  -4.220   3.689
  108    H    LYS  20           H        LYS  20   0.622  -1.063   3.133
  109    HA   LYS  20           HA       LYS  20  -1.080  -1.377   5.461
  110    HB2  LYS  20           1HB      LYS  20  -0.210   0.952   3.779
  111    HB3  LYS  20           2HB      LYS  20  -1.564   1.117   4.889
  112    HG2  LYS  20           1HG      LYS  20   0.985  -0.014   5.921
  113    HG3  LYS  20           2HG      LYS  20   0.887   1.721   5.614
  114    HD2  LYS  20           1HD      LYS  20  -0.871   1.998   7.160
  115    HD3  LYS  20           2HD      LYS  20  -1.181   0.262   7.239
  116    HE2  LYS  20           1HE      LYS  20  -0.050   0.825   9.238
  117    HE3  LYS  20           2HE      LYS  20   1.135   0.018   8.213
  118    HZ1  LYS  20           3HZ      LYS  20   0.873   2.966   8.409
  119    HZ2  LYS  20           1HZ      LYS  20   2.110   2.094   7.652
  120    HZ3  LYS  20           2HZ      LYS  20   1.958   2.058   9.336
  121    H    ALA  21           H        ALA  21  -3.312  -0.374   5.361
  122    HA   ALA  21           HA       ALA  21  -4.635  -0.659   2.779
  123    HB1  ALA  21           3HB      ALA  21  -4.772  -2.899   3.643
  124    HB2  ALA  21           1HB      ALA  21  -5.377  -2.308   5.191
  125    HB3  ALA  21           2HB      ALA  21  -6.367  -2.152   3.739
  126    H    PHE  22           H        PHE  22  -6.556   0.481   2.606
  127    HA   PHE  22           HA       PHE  22  -7.514   1.912   4.973
  128    HB2  PHE  22           1HB      PHE  22  -6.942   3.300   2.349
  129    HB3  PHE  22           2HB      PHE  22  -7.523   4.045   3.834
  130    HD1  PHE  22           HD2      PHE  22  -6.019   4.241   5.787
  131    HD2  PHE  22           HD1      PHE  22  -4.640   2.862   2.004
  132    HE1  PHE  22           HE2      PHE  22  -3.698   4.672   6.480
  133    HE2  PHE  22           HE1      PHE  22  -2.317   3.290   2.691
  134    HZ   PHE  22           HZ       PHE  22  -1.843   4.197   4.931
  135    H    HIS  23           H        HIS  23  -9.633   2.957   4.605
  136    HA   HIS  23           HA       HIS  23 -11.304   1.222   2.965
  137    HB2  HIS  23           1HB      HIS  23 -11.964   1.577   5.294
  138    HB3  HIS  23           2HB      HIS  23 -12.045   3.315   5.021
  139    HD1  HIS  23           HD1      HIS  23 -13.558   0.417   3.065
  140    HD2  HIS  23           HD2      HIS  23 -14.673   3.927   4.988
  141    HE1  HIS  23           HE1      HIS  23 -16.029   0.651   2.659
  142    H    ARG  24           H        ARG  24 -10.541   4.652   3.359
  143    HA   ARG  24           HA       ARG  24 -12.105   5.264   0.953
  144    HB2  ARG  24           1HB      ARG  24 -10.938   7.041   3.098
  145    HB3  ARG  24           2HB      ARG  24 -11.709   7.653   1.641
  146    HG2  ARG  24           1HG      ARG  24 -13.761   6.358   2.325
  147    HG3  ARG  24           2HG      ARG  24 -12.963   6.086   3.876
  148    HD2  ARG  24           1HD      ARG  24 -12.819   8.476   4.253
  149    HD3  ARG  24           2HD      ARG  24 -13.516   8.792   2.664
  150    HE   ARG  24           HE       ARG  24 -15.368   7.240   3.949
  151   HH11  ARG  24          1HH1      ARG  24 -13.792  10.276   4.596
  152   HH12  ARG  24          2HH1      ARG  24 -15.127  10.928   5.487
  153   HH21  ARG  24          1HH2      ARG  24 -17.133   8.088   5.120
  154   HH22  ARG  24          2HH2      ARG  24 -17.026   9.682   5.785
  155    H    HIS  25           H        HIS  25 -11.046   5.285  -0.908
  156    HA   HIS  25           HA       HIS  25  -8.440   4.932  -1.442
  157    HB2  HIS  25           1HB      HIS  25  -9.816   4.988  -3.322
  158    HB3  HIS  25           2HB      HIS  25 -10.508   6.549  -2.892
  159    HD1  HIS  25           HD1      HIS  25  -9.078   8.668  -3.453
  160    HD2  HIS  25           HD2      HIS  25  -7.509   5.086  -4.856
  161    HE1  HIS  25           HE1      HIS  25  -7.311   9.315  -5.121
  162    H    THR  26           H        THR  26  -9.923   8.130  -0.958
  163    HA   THR  26           HA       THR  26  -7.855   9.822  -1.368
  164    HB   THR  26           HB       THR  26  -8.732  11.161   0.638
  165    HG1  THR  26           HG1      THR  26 -10.943  10.258   1.181
  166   HG21  THR  26          3HG2      THR  26 -10.794  11.761  -0.535
  167   HG22  THR  26          1HG2      THR  26 -10.682  10.289  -1.499
  168   HG23  THR  26          2HG2      THR  26  -9.462  11.551  -1.671
  169    H    HIS  27           H        HIS  27  -8.445   8.135   1.718
  170    HA   HIS  27           HA       HIS  27  -6.272   9.047   3.145
  171    HB2  HIS  27           1HB      HIS  27  -7.609   6.339   3.189
  172    HB3  HIS  27           2HB      HIS  27  -6.397   6.836   4.366
  173    HD1  HIS  27           HD1      HIS  27  -8.342   6.496   6.152
  174    HD2  HIS  27           HD2      HIS  27  -8.883   9.621   3.467
  175    HE1  HIS  27           HE1      HIS  27 -10.144   7.938   7.152
  176    H    LEU  28           H        LEU  28  -6.403   6.089   1.157
  177    HA   LEU  28           HA       LEU  28  -3.812   5.224   1.453
  178    HB2  LEU  28           1HB      LEU  28  -5.327   3.852   0.281
  179    HB3  LEU  28           2HB      LEU  28  -5.675   5.113  -0.900
  180    HG   LEU  28           HG       LEU  28  -3.252   4.840  -1.656
  181   HD11  LEU  28          1HD1      LEU  28  -1.930   3.365  -0.662
  182   HD12  LEU  28          2HD1      LEU  28  -3.119   2.081  -0.877
  183   HD13  LEU  28          3HD1      LEU  28  -3.187   3.116   0.549
  184   HD21  LEU  28          3HD2      LEU  28  -4.598   2.286  -2.219
  185   HD22  LEU  28          1HD2      LEU  28  -4.005   3.528  -3.321
  186   HD23  LEU  28          2HD2      LEU  28  -5.562   3.733  -2.519
  187    H    ASN  29           H        ASN  29  -4.907   7.097  -1.381
  188    HA   ASN  29           HA       ASN  29  -2.569   7.694  -2.570
  189    HB2  ASN  29           1HB      ASN  29  -4.689   8.502  -3.440
  190    HB3  ASN  29           2HB      ASN  29  -4.852   9.620  -2.090
  191   HD21  ASN  29          1HD2      ASN  29  -5.118  10.940  -4.194
  192   HD22  ASN  29          2HD2      ASN  29  -3.686  11.733  -4.746
  193    H    GLU  30           H        GLU  30  -3.963   9.705   0.028
  194    HA   GLU  30           HA       GLU  30  -1.841  11.476   0.304
  195    HB2  GLU  30           1HB      GLU  30  -4.231  11.348   1.442
  196    HB3  GLU  30           2HB      GLU  30  -3.317  10.600   2.745
  197    HG2  GLU  30           1HG      GLU  30  -1.781  12.641   2.581
  198    HG3  GLU  30           2HG      GLU  30  -3.081  13.372   1.642
  199    H    HIS  31           H        HIS  31  -2.383   8.348   1.876
  200    HA   HIS  31           HA       HIS  31  -0.199   8.398   3.622
  201    HB2  HIS  31           1HB      HIS  31  -1.662   6.672   4.088
  202    HB3  HIS  31           2HB      HIS  31  -1.856   6.237   2.392
  203    HD1  HIS  31           HD1      HIS  31   0.272   5.591   5.377
  204    HD2  HIS  31           HD2      HIS  31   0.106   4.487   1.376
  205    HE1  HIS  31           HE1      HIS  31   1.855   3.651   5.149
  206    H    ARG  32           H        ARG  32  -0.449   7.086   0.325
  207    HA   ARG  32           HA       ARG  32   2.028   5.991  -0.006
  208    HB2  ARG  32           1HB      ARG  32   0.566   7.687  -2.038
  209    HB3  ARG  32           2HB      ARG  32   1.833   6.519  -2.393
  210    HG2  ARG  32           1HG      ARG  32   0.370   4.741  -1.451
  211    HG3  ARG  32           2HG      ARG  32  -0.910   5.946  -1.299
  212    HD2  ARG  32           1HD      ARG  32   0.440   5.046  -3.840
  213    HD3  ARG  32           2HD      ARG  32  -1.214   4.695  -3.341
  214    HE   ARG  32           HE       ARG  32  -0.624   7.504  -3.544
  215   HH11  ARG  32          1HH1      ARG  32  -1.679   4.658  -5.250
  216   HH12  ARG  32          2HH1      ARG  32  -2.511   5.547  -6.483
  217   HH21  ARG  32          1HH2      ARG  32  -1.716   8.685  -5.161
  218   HH22  ARG  32          2HH2      ARG  32  -2.530   7.837  -6.432
  219    H    ARG  33           H        ARG  33   1.278   9.301   0.495
  220    HA   ARG  33           HA       ARG  33   3.326  10.663  -0.736
  221    HB2  ARG  33           1HB      ARG  33   2.019  11.114   1.944
  222    HB3  ARG  33           2HB      ARG  33   3.188  12.237   1.261
  223    HG2  ARG  33           1HG      ARG  33   1.756  12.660  -0.625
  224    HG3  ARG  33           2HG      ARG  33   0.618  11.426  -0.080
  225    HD2  ARG  33           1HD      ARG  33  -0.127  13.712   0.464
  226    HD3  ARG  33           2HD      ARG  33   0.109  12.714   1.899
  227    HE   ARG  33           HE       ARG  33   2.465  13.957   1.724
  228   HH11  ARG  33          1HH1      ARG  33  -0.791  15.170   1.495
  229   HH12  ARG  33          2HH1      ARG  33  -0.393  16.731   2.132
  230   HH21  ARG  33          1HH2      ARG  33   3.001  16.009   2.564
  231   HH22  ARG  33          2HH2      ARG  33   1.764  17.208   2.739
  232    H    ILE  34           H        ILE  34   3.409   8.948   2.363
  233    HA   ILE  34           HA       ILE  34   5.995   9.660   3.146
  234    HB   ILE  34           HB       ILE  34   5.962   7.751   4.617
  235   HG12  ILE  34          1HG1      ILE  34   3.391   6.739   3.489
  236   HG13  ILE  34          2HG1      ILE  34   4.884   6.320   2.657
  237   HG21  ILE  34          1HG2      ILE  34   4.635   9.161   5.744
  238   HG22  ILE  34          2HG2      ILE  34   3.643   9.510   4.329
  239   HG23  ILE  34          3HG2      ILE  34   3.337   8.060   5.284
  240   HD11  ILE  34          3HD1      ILE  34   4.422   5.823   5.584
  241   HD12  ILE  34          1HD1      ILE  34   4.078   4.642   4.320
  242   HD13  ILE  34          2HD1      ILE  34   5.730   5.207   4.574
  243    H    HIS  35           H        HIS  35   4.917   7.542   0.667
  244    HA   HIS  35           HA       HIS  35   7.456   6.130   0.494
  245    HB2  HIS  35           1HB      HIS  35   4.880   5.937  -1.065
  246    HB3  HIS  35           2HB      HIS  35   6.330   5.042  -1.513
  247    HD1  HIS  35           HD1      HIS  35   7.190   3.270   0.294
  248    HD2  HIS  35           HD2      HIS  35   3.376   4.796   0.918
  249    HE1  HIS  35           HE1      HIS  35   6.099   1.704   1.932
  250    H    THR  36           H        THR  36   5.931   8.896  -0.821
  251    HA   THR  36           HA       THR  36   7.974   9.061  -2.940
  252    HB   THR  36           HB       THR  36   5.917   9.116  -4.061
  253    HG1  THR  36           HG1      THR  36   6.182  11.890  -3.666
  254   HG21  THR  36          3HG2      THR  36   4.021  10.545  -3.355
  255   HG22  THR  36          1HG2      THR  36   4.928  10.993  -1.911
  256   HG23  THR  36          2HG2      THR  36   4.432   9.318  -2.158
  257    H    GLY  37           H        GLY  37   9.558  10.450  -2.537
  258    HA2  GLY  37           1HA      GLY  37   9.702  13.025  -2.198
  259    HA3  GLY  37           2HA      GLY  37   9.088  12.611  -0.604
  260    H    TYR  38           H        TYR  38  11.495  10.972  -2.638
  261    HA   TYR  38           HA       TYR  38  13.270  10.724  -0.381
  262    HB2  TYR  38           1HB      TYR  38  14.738   9.528  -1.998
  263    HB3  TYR  38           2HB      TYR  38  13.109   8.866  -1.920
  264    HD1  TYR  38           HD1      TYR  38  14.937  11.502  -3.851
  265    HD2  TYR  38           HD2      TYR  38  12.166   8.275  -3.932
  266    HE1  TYR  38           HE1      TYR  38  14.725  11.754  -6.288
  267    HE2  TYR  38           HE2      TYR  38  11.947   8.517  -6.370
  268    HH   TYR  38           HH       TYR  38  12.828  11.149  -8.042
  269    H    ARG  39           H        ARG  39  15.590  11.311  -0.574
  270    HA   ARG  39           HA       ARG  39  15.870  14.077  -1.087
  271    HB2  ARG  39           1HB      ARG  39  17.194  12.450   0.509
  272    HB3  ARG  39           2HB      ARG  39  18.253  12.283  -0.885
  273    HG2  ARG  39           1HG      ARG  39  18.769  14.601  -0.875
  274    HG3  ARG  39           2HG      ARG  39  17.510  14.937   0.314
  275    HD2  ARG  39           1HD      ARG  39  19.634  14.948   1.427
  276    HD3  ARG  39           2HD      ARG  39  18.741  13.515   1.935
  277    HE   ARG  39           HE       ARG  39  20.280  12.686  -0.175
  278   HH11  ARG  39          1HH1      ARG  39  20.878  14.180   2.913
  279   HH12  ARG  39          2HH1      ARG  39  22.441  13.459   3.106
  280   HH21  ARG  39          1HH2      ARG  39  22.337  11.731   0.068
  281   HH22  ARG  39          2HH2      ARG  39  23.271  12.067   1.487
  282    HA   PRO  40           HA       PRO  40  16.830  14.089  -5.389
  283    HB2  PRO  40           1HB      PRO  40  18.066  16.503  -5.518
  284    HB3  PRO  40           2HB      PRO  40  16.316  16.328  -5.336
  285    HG2  PRO  40           1HG      PRO  40  18.391  16.890  -3.252
  286    HG3  PRO  40           2HG      PRO  40  16.791  17.624  -3.465
  287    HD2  PRO  40           1HD      PRO  40  17.272  15.683  -1.639
  288    HD3  PRO  40           2HD      PRO  40  15.707  15.857  -2.458
  289    H    SER  41           H        SER  41  18.716  14.399  -6.863
  290    HA   SER  41           HA       SER  41  21.069  13.151  -5.683
  291    HB2  SER  41           1HB      SER  41  21.776  12.793  -8.023
  292    HB3  SER  41           2HB      SER  41  20.152  12.170  -7.731
  293    HG   SER  41           HG       SER  41  20.240  13.366  -9.665
  294    H    GLY  42           H        GLY  42  22.377  14.603  -4.727
  295    HA2  GLY  42           1HA      GLY  42  24.295  16.030  -5.223
  296    HA3  GLY  42           2HA      GLY  42  23.282  16.872  -6.386
  297    HA   PRO  43           HA       PRO  43  22.497  19.901  -3.303
  298    HB2  PRO  43           1HB      PRO  43  20.201  20.954  -4.296
  299    HB3  PRO  43           2HB      PRO  43  21.785  21.251  -5.020
  300    HG2  PRO  43           1HG      PRO  43  19.662  19.308  -5.842
  301    HG3  PRO  43           2HG      PRO  43  20.661  20.367  -6.854
  302    HD2  PRO  43           1HD      PRO  43  21.198  17.733  -6.529
  303    HD3  PRO  43           2HD      PRO  43  22.473  18.944  -6.775
  304    H    SER  44           H        SER  44  22.033  18.770  -1.431
  305    HA   SER  44           HA       SER  44  19.763  17.219  -0.944
  306    HB2  SER  44           1HB      SER  44  20.377  17.270   1.354
  307    HB3  SER  44           2HB      SER  44  21.890  17.361   0.452
  308    HG   SER  44           HG       SER  44  20.494  19.602   1.494
  309    H    SER  45           H        SER  45  18.015  17.723   0.629
  310    HA   SER  45           HA       SER  45  17.032  20.472   0.222
  311    HB2  SER  45           1HB      SER  45  15.805  18.439  -0.856
  312    HB3  SER  45           2HB      SER  45  15.210  18.149   0.778
  313    HG   SER  45           HG       SER  45  13.743  19.468  -0.231
  314    H    GLY  46           H        GLY  46  16.444  17.711   2.412
  315    HA2  GLY  46           1HA      GLY  46  17.153  19.228   4.734
  316    HA3  GLY  46           2HA      GLY  46  15.411  19.077   4.560
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1   9.981 -24.591  -3.458
    2    HA2  GLY   1           1HA      GLY   1   9.163 -22.570  -4.520
    3    HA3  GLY   1           2HA      GLY   1   8.136 -23.581  -5.526
    4    H    SER   2           H        SER   2   8.238 -21.620  -2.830
    5    HA   SER   2           HA       SER   2   5.595 -22.584  -1.982
    6    HB2  SER   2           1HB      SER   2   6.226 -22.054   0.385
    7    HB3  SER   2           2HB      SER   2   7.121 -23.410  -0.302
    8    HG   SER   2           HG       SER   2   8.647 -22.162   0.628
    9    H    SER   3           H        SER   3   4.104 -21.028  -1.775
   10    HA   SER   3           HA       SER   3   4.754 -18.353  -2.548
   11    HB2  SER   3           1HB      SER   3   2.561 -19.702  -2.961
   12    HB3  SER   3           2HB      SER   3   2.109 -19.133  -1.354
   13    HG   SER   3           HG       SER   3   1.369 -17.630  -2.795
   14    H    GLY   4           H        GLY   4   4.777 -16.492  -1.336
   15    HA2  GLY   4           1HA      GLY   4   5.155 -16.887   1.534
   16    HA3  GLY   4           2HA      GLY   4   5.597 -15.456   0.615
   17    H    SER   5           H        SER   5   2.491 -17.164   0.803
   18    HA   SER   5           HA       SER   5   0.837 -14.999   0.768
   19    HB2  SER   5           1HB      SER   5  -0.833 -16.396   1.952
   20    HB3  SER   5           2HB      SER   5  -0.006 -17.288   0.675
   21    HG   SER   5           HG       SER   5   0.160 -18.649   2.326
   22    H    SER   6           H        SER   6  -0.162 -13.670   2.291
   23    HA   SER   6           HA       SER   6   1.022 -13.658   4.983
   24    HB2  SER   6           1HB      SER   6   0.762 -11.351   3.062
   25    HB3  SER   6           2HB      SER   6   0.889 -11.093   4.802
   26    HG   SER   6           HG       SER   6   2.774 -12.232   3.038
   27    H    GLY   7           H        GLY   7  -1.614 -12.514   2.905
   28    HA2  GLY   7           1HA      GLY   7  -3.894 -13.023   3.644
   29    HA3  GLY   7           2HA      GLY   7  -3.377 -12.617   5.274
   30    H    SER   8           H        SER   8  -4.862 -11.009   5.636
   31    HA   SER   8           HA       SER   8  -5.942  -9.000   5.411
   32    HB2  SER   8           1HB      SER   8  -4.347  -7.078   5.120
   33    HB3  SER   8           2HB      SER   8  -3.871  -8.228   6.370
   34    HG   SER   8           HG       SER   8  -2.341  -9.067   5.002
   35    H    GLY   9           H        GLY   9  -6.260 -10.546   3.116
   36    HA2  GLY   9           1HA      GLY   9  -5.988  -8.583   0.931
   37    HA3  GLY   9           2HA      GLY   9  -6.134 -10.319   0.706
   38    H    GLU  10           H        GLU  10  -7.965  -7.715   2.321
   39    HA   GLU  10           HA       GLU  10 -10.392  -8.788   1.038
   40    HB2  GLU  10           1HB      GLU  10  -9.924  -7.892   3.855
   41    HB3  GLU  10           2HB      GLU  10 -11.520  -7.703   3.145
   42    HG2  GLU  10           1HG      GLU  10 -11.168 -10.233   2.511
   43    HG3  GLU  10           2HG      GLU  10 -10.043 -10.175   3.867
   44    H    LYS  11           H        LYS  11  -8.824  -5.913   2.388
   45    HA   LYS  11           HA       LYS  11 -10.738  -4.069   1.378
   46    HB2  LYS  11           1HB      LYS  11  -7.969  -3.829   2.506
   47    HB3  LYS  11           2HB      LYS  11  -8.739  -2.434   1.761
   48    HG2  LYS  11           1HG      LYS  11 -10.040  -4.012   3.960
   49    HG3  LYS  11           2HG      LYS  11  -8.958  -2.652   4.270
   50    HD2  LYS  11           1HD      LYS  11 -10.414  -1.172   3.015
   51    HD3  LYS  11           2HD      LYS  11 -11.467  -2.526   2.596
   52    HE2  LYS  11           1HE      LYS  11 -12.529  -1.421   4.387
   53    HE3  LYS  11           2HE      LYS  11 -11.790  -2.861   5.087
   54    HZ1  LYS  11           3HZ      LYS  11  -9.826  -1.150   5.453
   55    HZ2  LYS  11           1HZ      LYS  11 -11.079  -1.333   6.575
   56    HZ3  LYS  11           2HZ      LYS  11 -11.111  -0.051   5.472
   57    HA   PRO  12           HA       PRO  12  -9.512  -3.856  -2.850
   58    HB2  PRO  12           1HB      PRO  12 -10.552  -1.422  -3.454
   59    HB3  PRO  12           2HB      PRO  12 -11.549  -2.864  -3.229
   60    HG2  PRO  12           1HG      PRO  12 -10.973  -0.642  -1.308
   61    HG3  PRO  12           2HG      PRO  12 -12.511  -1.456  -1.648
   62    HD2  PRO  12           1HD      PRO  12 -10.996  -2.049   0.516
   63    HD3  PRO  12           2HD      PRO  12 -11.996  -3.261  -0.311
   64    H    TYR  13           H        TYR  13  -8.868  -1.081  -0.742
   65    HA   TYR  13           HA       TYR  13  -6.619  -0.307  -2.456
   66    HB2  TYR  13           1HB      TYR  13  -7.833   1.186  -0.123
   67    HB3  TYR  13           2HB      TYR  13  -6.617   1.801  -1.236
   68    HD1  TYR  13           HD1      TYR  13  -7.225   2.368  -3.550
   69    HD2  TYR  13           HD2      TYR  13 -10.156   1.101  -0.738
   70    HE1  TYR  13           HE1      TYR  13  -8.999   3.226  -5.022
   71    HE2  TYR  13           HE2      TYR  13 -11.938   1.955  -2.202
   72    HH   TYR  13           HH       TYR  13 -11.456   2.765  -5.406
   73    H    LYS  14           H        LYS  14  -4.959  -1.640  -1.929
   74    HA   LYS  14           HA       LYS  14  -4.058  -1.574   0.876
   75    HB2  LYS  14           1HB      LYS  14  -4.943  -3.805   0.211
   76    HB3  LYS  14           2HB      LYS  14  -3.722  -3.879  -1.052
   77    HG2  LYS  14           1HG      LYS  14  -2.105  -3.443   0.999
   78    HG3  LYS  14           2HG      LYS  14  -3.442  -4.183   1.883
   79    HD2  LYS  14           1HD      LYS  14  -3.357  -6.066   0.213
   80    HD3  LYS  14           2HD      LYS  14  -1.858  -5.360  -0.394
   81    HE2  LYS  14           1HE      LYS  14  -1.059  -6.902   1.118
   82    HE3  LYS  14           2HE      LYS  14  -1.136  -5.447   2.110
   83    HZ1  LYS  14           3HZ      LYS  14  -3.285  -7.490   2.008
   84    HZ2  LYS  14           1HZ      LYS  14  -3.168  -6.183   3.075
   85    HZ3  LYS  14           2HZ      LYS  14  -2.067  -7.462   3.182
   86    H    CYS  15           H        CYS  15  -2.083  -0.776   1.176
   87    HA   CYS  15           HA       CYS  15  -0.507   0.050  -1.081
   88    HB2  CYS  15           1HB      CYS  15  -0.730   1.422   0.980
   89    HB3  CYS  15           2HB      CYS  15   0.160   0.188   1.866
   90    H    SER  16           H        SER  16   0.693  -1.376  -2.148
   91    HA   SER  16           HA       SER  16   1.670  -3.785  -0.952
   92    HB2  SER  16           1HB      SER  16   1.003  -3.459  -3.396
   93    HB3  SER  16           2HB      SER  16   2.552  -2.643  -3.604
   94    HG   SER  16           HG       SER  16   2.803  -4.810  -4.108
   95    H    GLU  17           H        GLU  17   2.994  -0.628  -1.658
   96    HA   GLU  17           HA       GLU  17   5.702  -1.066  -1.584
   97    HB2  GLU  17           1HB      GLU  17   4.153   1.217  -0.350
   98    HB3  GLU  17           2HB      GLU  17   5.893   1.220  -0.603
   99    HG2  GLU  17           1HG      GLU  17   5.089   2.396  -2.422
  100    HG3  GLU  17           2HG      GLU  17   5.326   0.774  -3.068
  101    H    CYS  18           H        CYS  18   3.708  -0.251   1.263
  102    HA   CYS  18           HA       CYS  18   5.795  -1.402   2.974
  103    HB2  CYS  18           1HB      CYS  18   4.687  -0.205   4.815
  104    HB3  CYS  18           2HB      CYS  18   5.125   0.891   3.508
  105    H    GLY  19           H        GLY  19   2.366  -1.627   2.195
  106    HA2  GLY  19           1HA      GLY  19   1.319  -3.810   2.220
  107    HA3  GLY  19           2HA      GLY  19   2.311  -4.212   3.614
  108    H    LYS  20           H        LYS  20   0.231  -1.419   2.875
  109    HA   LYS  20           HA       LYS  20  -1.201  -1.959   5.393
  110    HB2  LYS  20           1HB      LYS  20  -0.296   0.581   4.107
  111    HB3  LYS  20           2HB      LYS  20  -1.762   0.604   5.078
  112    HG2  LYS  20           1HG      LYS  20  -0.400  -0.441   6.931
  113    HG3  LYS  20           2HG      LYS  20   1.026  -0.089   5.951
  114    HD2  LYS  20           1HD      LYS  20   0.668   2.237   6.081
  115    HD3  LYS  20           2HD      LYS  20  -0.982   2.029   6.673
  116    HE2  LYS  20           1HE      LYS  20   1.507   1.229   8.177
  117    HE3  LYS  20           2HE      LYS  20   0.614   2.726   8.435
  118    HZ1  LYS  20           3HZ      LYS  20  -1.367   1.244   8.881
  119    HZ2  LYS  20           1HZ      LYS  20  -0.152   1.247  10.059
  120    HZ3  LYS  20           2HZ      LYS  20  -0.274  -0.044   8.973
  121    H    ALA  21           H        ALA  21  -3.419  -0.661   5.307
  122    HA   ALA  21           HA       ALA  21  -4.703  -0.858   2.706
  123    HB1  ALA  21           3HB      ALA  21  -5.314  -2.686   4.993
  124    HB2  ALA  21           1HB      ALA  21  -6.578  -2.234   3.849
  125    HB3  ALA  21           2HB      ALA  21  -5.127  -3.060   3.280
  126    H    PHE  22           H        PHE  22  -6.533   0.399   2.516
  127    HA   PHE  22           HA       PHE  22  -7.435   1.831   4.918
  128    HB2  PHE  22           1HB      PHE  22  -6.843   3.118   2.244
  129    HB3  PHE  22           2HB      PHE  22  -7.510   3.935   3.653
  130    HD1  PHE  22           HD2      PHE  22  -6.120   4.412   5.591
  131    HD2  PHE  22           HD1      PHE  22  -4.514   2.545   2.119
  132    HE1  PHE  22           HE2      PHE  22  -3.844   4.915   6.377
  133    HE2  PHE  22           HE1      PHE  22  -2.235   3.045   2.900
  134    HZ   PHE  22           HZ       PHE  22  -1.898   4.233   5.031
  135    H    HIS  23           H        HIS  23  -9.534   2.975   4.551
  136    HA   HIS  23           HA       HIS  23 -11.316   1.212   3.061
  137    HB2  HIS  23           1HB      HIS  23 -12.195   1.515   5.182
  138    HB3  HIS  23           2HB      HIS  23 -11.668   3.193   5.275
  139    HD1  HIS  23           HD1      HIS  23 -13.897   1.553   2.669
  140    HD2  HIS  23           HD2      HIS  23 -14.002   4.548   5.546
  141    HE1  HIS  23           HE1      HIS  23 -16.137   2.664   2.402
  142    H    ARG  24           H        ARG  24 -10.299   4.578   3.174
  143    HA   ARG  24           HA       ARG  24 -11.903   5.100   0.761
  144    HB2  ARG  24           1HB      ARG  24 -10.975   6.893   2.987
  145    HB3  ARG  24           2HB      ARG  24 -11.430   7.555   1.423
  146    HG2  ARG  24           1HG      ARG  24 -13.264   5.768   2.985
  147    HG3  ARG  24           2HG      ARG  24 -13.207   7.514   3.236
  148    HD2  ARG  24           1HD      ARG  24 -13.568   6.367   0.493
  149    HD3  ARG  24           2HD      ARG  24 -14.941   6.538   1.586
  150    HE   ARG  24           HE       ARG  24 -13.431   8.952   1.342
  151   HH11  ARG  24          1HH1      ARG  24 -15.882   6.994  -0.168
  152   HH12  ARG  24          2HH1      ARG  24 -16.616   8.325  -1.001
  153   HH21  ARG  24          1HH2      ARG  24 -14.389  10.711   0.251
  154   HH22  ARG  24          2HH2      ARG  24 -15.765  10.438  -0.762
  155    H    HIS  25           H        HIS  25 -10.924   5.757  -1.079
  156    HA   HIS  25           HA       HIS  25  -8.202   5.257  -1.485
  157    HB2  HIS  25           1HB      HIS  25  -9.520   5.141  -3.412
  158    HB3  HIS  25           2HB      HIS  25 -10.304   6.684  -3.085
  159    HD1  HIS  25           HD1      HIS  25  -8.880   8.850  -3.607
  160    HD2  HIS  25           HD2      HIS  25  -7.240   5.277  -4.949
  161    HE1  HIS  25           HE1      HIS  25  -7.102   9.506  -5.260
  162    H    THR  26           H        THR  26  -9.875   8.119  -0.457
  163    HA   THR  26           HA       THR  26  -7.937  10.053  -1.089
  164    HB   THR  26           HB       THR  26  -9.001  11.180   1.072
  165    HG1  THR  26           HG1      THR  26 -10.070   9.114   1.587
  166   HG21  THR  26          3HG2      THR  26 -10.586  10.717  -1.457
  167   HG22  THR  26          1HG2      THR  26  -9.293  11.902  -1.276
  168   HG23  THR  26          2HG2      THR  26 -10.773  12.061  -0.331
  169    H    HIS  27           H        HIS  27  -8.135   7.712   1.473
  170    HA   HIS  27           HA       HIS  27  -6.120   8.969   3.108
  171    HB2  HIS  27           1HB      HIS  27  -7.754   6.484   3.250
  172    HB3  HIS  27           2HB      HIS  27  -6.239   6.513   4.148
  173    HD1  HIS  27           HD1      HIS  27  -7.608   6.442   6.371
  174    HD2  HIS  27           HD2      HIS  27  -8.244   9.826   4.046
  175    HE1  HIS  27           HE1      HIS  27  -8.780   8.081   7.876
  176    H    LEU  28           H        LEU  28  -6.290   6.106   1.009
  177    HA   LEU  28           HA       LEU  28  -3.646   5.250   1.360
  178    HB2  LEU  28           1HB      LEU  28  -5.302   3.823   0.355
  179    HB3  LEU  28           2HB      LEU  28  -5.511   4.946  -0.987
  180    HG   LEU  28           HG       LEU  28  -2.934   4.413  -1.340
  181   HD11  LEU  28          1HD1      LEU  28  -2.525   2.015  -0.895
  182   HD12  LEU  28          2HD1      LEU  28  -4.014   1.966   0.049
  183   HD13  LEU  28          3HD1      LEU  28  -2.670   2.979   0.574
  184   HD21  LEU  28          3HD2      LEU  28  -4.215   2.181  -2.477
  185   HD22  LEU  28          1HD2      LEU  28  -3.866   3.735  -3.235
  186   HD23  LEU  28          2HD2      LEU  28  -5.412   3.477  -2.425
  187    H    ASN  29           H        ASN  29  -5.062   7.331  -1.155
  188    HA   ASN  29           HA       ASN  29  -2.773   7.786  -2.655
  189    HB2  ASN  29           1HB      ASN  29  -5.047   8.484  -3.334
  190    HB3  ASN  29           2HB      ASN  29  -5.012   9.748  -2.108
  191   HD21  ASN  29          1HD2      ASN  29  -5.514  10.773  -4.366
  192   HD22  ASN  29          2HD2      ASN  29  -4.142  11.473  -5.149
  193    H    GLU  30           H        GLU  30  -3.964   9.514   0.201
  194    HA   GLU  30           HA       GLU  30  -1.831  11.417   0.208
  195    HB2  GLU  30           1HB      GLU  30  -3.780  12.165   1.268
  196    HB3  GLU  30           2HB      GLU  30  -3.986  10.662   2.157
  197    HG2  GLU  30           1HG      GLU  30  -2.456  11.236   3.763
  198    HG3  GLU  30           2HG      GLU  30  -1.588  12.340   2.696
  199    H    HIS  31           H        HIS  31  -2.333   8.252   1.565
  200    HA   HIS  31           HA       HIS  31  -0.280   8.342   3.519
  201    HB2  HIS  31           1HB      HIS  31  -1.769   6.609   3.896
  202    HB3  HIS  31           2HB      HIS  31  -1.854   6.171   2.192
  203    HD1  HIS  31           HD1      HIS  31   0.358   5.771   5.217
  204    HD2  HIS  31           HD2      HIS  31  -0.082   4.219   1.389
  205    HE1  HIS  31           HE1      HIS  31   1.904   3.791   5.113
  206    H    ARG  32           H        ARG  32  -0.371   6.885   0.265
  207    HA   ARG  32           HA       ARG  32   2.172   5.911   0.077
  208    HB2  ARG  32           1HB      ARG  32   0.492   7.284  -2.020
  209    HB3  ARG  32           2HB      ARG  32   2.018   6.492  -2.391
  210    HG2  ARG  32           1HG      ARG  32   1.128   4.371  -1.597
  211    HG3  ARG  32           2HG      ARG  32  -0.396   5.158  -1.182
  212    HD2  ARG  32           1HD      ARG  32  -0.678   4.068  -3.290
  213    HD3  ARG  32           2HD      ARG  32  -0.629   5.806  -3.579
  214    HE   ARG  32           HE       ARG  32   1.320   3.839  -4.422
  215   HH11  ARG  32          1HH1      ARG  32   0.603   7.207  -3.912
  216   HH12  ARG  32          2HH1      ARG  32   1.836   7.768  -4.994
  217   HH21  ARG  32          1HH2      ARG  32   2.946   4.564  -5.848
  218   HH22  ARG  32          2HH2      ARG  32   3.167   6.263  -6.095
  219    H    ARG  33           H        ARG  33   1.228   9.197   0.340
  220    HA   ARG  33           HA       ARG  33   3.262  10.570  -0.928
  221    HB2  ARG  33           1HB      ARG  33   1.859  11.202   1.672
  222    HB3  ARG  33           2HB      ARG  33   2.908  12.331   0.826
  223    HG2  ARG  33           1HG      ARG  33   1.418  12.278  -1.106
  224    HG3  ARG  33           2HG      ARG  33   0.368  11.135  -0.265
  225    HD2  ARG  33           1HD      ARG  33  -0.709  13.106   0.192
  226    HD3  ARG  33           2HD      ARG  33   0.363  12.994   1.588
  227    HE   ARG  33           HE       ARG  33   1.666  14.407  -0.459
  228   HH11  ARG  33          1HH1      ARG  33  -0.985  14.751   1.771
  229   HH12  ARG  33          2HH1      ARG  33  -0.862  16.478   1.854
  230   HH21  ARG  33          1HH2      ARG  33   1.838  16.680  -0.359
  231   HH22  ARG  33          2HH2      ARG  33   0.744  17.573   0.641
  232    H    ILE  34           H        ILE  34   3.307   8.876   2.145
  233    HA   ILE  34           HA       ILE  34   5.767   9.879   3.098
  234    HB   ILE  34           HB       ILE  34   5.776   8.038   4.649
  235   HG12  ILE  34          1HG1      ILE  34   3.372   6.775   3.412
  236   HG13  ILE  34          2HG1      ILE  34   4.944   6.449   2.689
  237   HG21  ILE  34          1HG2      ILE  34   3.282   8.164   5.389
  238   HG22  ILE  34          2HG2      ILE  34   4.281   9.616   5.416
  239   HG23  ILE  34          3HG2      ILE  34   3.152   9.347   4.088
  240   HD11  ILE  34          3HD1      ILE  34   3.899   5.695   5.373
  241   HD12  ILE  34          1HD1      ILE  34   4.731   4.711   4.169
  242   HD13  ILE  34          2HD1      ILE  34   5.636   5.880   5.131
  243    H    HIS  35           H        HIS  35   4.973   7.489   0.727
  244    HA   HIS  35           HA       HIS  35   7.559   6.215   0.757
  245    HB2  HIS  35           1HB      HIS  35   5.207   6.024  -1.128
  246    HB3  HIS  35           2HB      HIS  35   6.696   5.110  -1.346
  247    HD1  HIS  35           HD1      HIS  35   6.970   3.004   0.010
  248    HD2  HIS  35           HD2      HIS  35   3.706   5.278   1.209
  249    HE1  HIS  35           HE1      HIS  35   5.706   1.561   1.636
  250    H    THR  36           H        THR  36   6.264   9.049  -0.567
  251    HA   THR  36           HA       THR  36   8.531   9.253  -2.442
  252    HB   THR  36           HB       THR  36   6.152   9.165  -3.446
  253    HG1  THR  36           HG1      THR  36   7.950   9.835  -4.659
  254   HG21  THR  36          3HG2      THR  36   5.165  10.766  -1.834
  255   HG22  THR  36          1HG2      THR  36   4.952  11.267  -3.511
  256   HG23  THR  36          2HG2      THR  36   6.184  12.036  -2.511
  257    H    GLY  37           H        GLY  37   9.801  11.036  -2.317
  258    HA2  GLY  37           1HA      GLY  37   9.026  13.069  -0.315
  259    HA3  GLY  37           2HA      GLY  37  10.678  12.515  -0.539
  260    H    TYR  38           H        TYR  38  11.933  13.849  -1.641
  261    HA   TYR  38           HA       TYR  38  10.690  15.882  -3.337
  262    HB2  TYR  38           1HB      TYR  38  12.914  16.982  -3.248
  263    HB3  TYR  38           2HB      TYR  38  12.217  16.723  -1.653
  264    HD1  TYR  38           HD1      TYR  38  14.420  14.885  -4.059
  265    HD2  TYR  38           HD2      TYR  38  13.659  15.983  -0.019
  266    HE1  TYR  38           HE1      TYR  38  16.468  13.716  -3.362
  267    HE2  TYR  38           HE2      TYR  38  15.705  14.818   0.689
  268    HH   TYR  38           HH       TYR  38  17.719  13.057  -1.645
  269    H    ARG  39           H        ARG  39  12.293  16.554  -5.219
  270    HA   ARG  39           HA       ARG  39  12.468  14.211  -6.922
  271    HB2  ARG  39           1HB      ARG  39  13.227  16.094  -8.592
  272    HB3  ARG  39           2HB      ARG  39  11.537  15.934  -8.132
  273    HG2  ARG  39           1HG      ARG  39  13.295  17.739  -6.547
  274    HG3  ARG  39           2HG      ARG  39  12.718  18.266  -8.129
  275    HD2  ARG  39           1HD      ARG  39  10.755  17.115  -6.213
  276    HD3  ARG  39           2HD      ARG  39  11.348  18.750  -5.924
  277    HE   ARG  39           HE       ARG  39  10.386  18.239  -8.604
  278   HH11  ARG  39          1HH1      ARG  39   9.626  19.368  -5.399
  279   HH12  ARG  39          2HH1      ARG  39   8.252  20.292  -5.909
  280   HH21  ARG  39          1HH2      ARG  39   8.579  19.452  -9.288
  281   HH22  ARG  39          2HH2      ARG  39   7.657  20.339  -8.121
  282    HA   PRO  40           HA       PRO  40  16.802  13.593  -6.490
  283    HB2  PRO  40           1HB      PRO  40  17.318  12.388  -8.867
  284    HB3  PRO  40           2HB      PRO  40  16.471  11.579  -7.544
  285    HG2  PRO  40           1HG      PRO  40  15.349  12.894  -9.989
  286    HG3  PRO  40           2HG      PRO  40  14.890  11.356  -9.235
  287    HD2  PRO  40           1HD      PRO  40  13.471  13.635  -8.877
  288    HD3  PRO  40           2HD      PRO  40  13.604  12.386  -7.623
  289    H    SER  41           H        SER  41  18.801  14.391  -7.180
  290    HA   SER  41           HA       SER  41  18.631  16.601  -9.117
  291    HB2  SER  41           1HB      SER  41  19.209  17.355  -6.875
  292    HB3  SER  41           2HB      SER  41  20.534  16.194  -6.797
  293    HG   SER  41           HG       SER  41  21.610  17.878  -7.509
  294    H    GLY  42           H        GLY  42  19.367  15.983 -11.045
  295    HA2  GLY  42           1HA      GLY  42  21.858  15.597 -11.859
  296    HA3  GLY  42           2HA      GLY  42  21.498  13.996 -11.228
  297    HA   PRO  43           HA       PRO  43  20.308  14.069 -15.702
  298    HB2  PRO  43           1HB      PRO  43  21.435  11.668 -16.278
  299    HB3  PRO  43           2HB      PRO  43  22.337  13.187 -16.322
  300    HG2  PRO  43           1HG      PRO  43  22.236  11.105 -14.173
  301    HG3  PRO  43           2HG      PRO  43  23.635  11.988 -14.811
  302    HD2  PRO  43           1HD      PRO  43  22.423  12.663 -12.485
  303    HD3  PRO  43           2HD      PRO  43  23.187  13.863 -13.548
  304    H    SER  44           H        SER  44  19.182  12.224 -16.926
  305    HA   SER  44           HA       SER  44  16.972  11.352 -15.351
  306    HB2  SER  44           1HB      SER  44  16.194  10.290 -17.456
  307    HB3  SER  44           2HB      SER  44  16.652  11.978 -17.684
  308    HG   SER  44           HG       SER  44  18.007  11.298 -19.122
  309    H    SER  45           H        SER  45  19.570   9.620 -17.059
  310    HA   SER  45           HA       SER  45  18.832   7.035 -16.289
  311    HB2  SER  45           1HB      SER  45  21.356   8.305 -17.253
  312    HB3  SER  45           2HB      SER  45  21.450   6.681 -16.572
  313    HG   SER  45           HG       SER  45  20.751   6.014 -18.426
  314    H    GLY  46           H        GLY  46  18.232   7.089 -14.096
  315    HA2  GLY  46           1HA      GLY  46  19.770   6.061 -12.199
  316    HA3  GLY  46           2HA      GLY  46  20.286   7.740 -12.126
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -18.980 -29.948  -4.424
    2    HA2  GLY   1           1HA      GLY   1 -18.689 -27.904  -5.901
    3    HA3  GLY   1           2HA      GLY   1 -20.069 -27.269  -5.017
    4    H    SER   2           H        SER   2 -18.910 -25.498  -4.238
    5    HA   SER   2           HA       SER   2 -17.418 -26.025  -1.833
    6    HB2  SER   2           1HB      SER   2 -15.708 -26.161  -3.699
    7    HB3  SER   2           2HB      SER   2 -16.024 -24.454  -4.007
    8    HG   SER   2           HG       SER   2 -14.306 -25.369  -2.336
    9    H    SER   3           H        SER   3 -18.029 -24.566  -0.388
   10    HA   SER   3           HA       SER   3 -19.020 -21.966  -1.358
   11    HB2  SER   3           1HB      SER   3 -20.463 -21.907   0.625
   12    HB3  SER   3           2HB      SER   3 -20.768 -23.363  -0.323
   13    HG   SER   3           HG       SER   3 -20.108 -24.535   1.293
   14    H    GLY   4           H        GLY   4 -18.343 -20.094  -0.370
   15    HA2  GLY   4           1HA      GLY   4 -16.164 -20.416   1.602
   16    HA3  GLY   4           2HA      GLY   4 -16.155 -19.189   0.343
   17    H    SER   5           H        SER   5 -15.721 -18.205   2.720
   18    HA   SER   5           HA       SER   5 -18.276 -17.364   3.880
   19    HB2  SER   5           1HB      SER   5 -16.841 -16.419   5.704
   20    HB3  SER   5           2HB      SER   5 -16.668 -18.162   5.497
   21    HG   SER   5           HG       SER   5 -14.618 -17.528   5.529
   22    H    SER   6           H        SER   6 -19.088 -15.390   3.584
   23    HA   SER   6           HA       SER   6 -18.114 -13.639   1.649
   24    HB2  SER   6           1HB      SER   6 -20.057 -13.208   3.922
   25    HB3  SER   6           2HB      SER   6 -19.719 -11.974   2.708
   26    HG   SER   6           HG       SER   6 -21.022 -14.442   2.435
   27    H    GLY   7           H        GLY   7 -17.951 -13.357   5.198
   28    HA2  GLY   7           1HA      GLY   7 -16.693 -11.960   6.535
   29    HA3  GLY   7           2HA      GLY   7 -15.396 -12.443   5.452
   30    H    SER   8           H        SER   8 -18.015 -10.087   5.840
   31    HA   SER   8           HA       SER   8 -17.093  -8.335   3.808
   32    HB2  SER   8           1HB      SER   8 -18.951  -7.930   6.155
   33    HB3  SER   8           2HB      SER   8 -18.605  -6.663   4.978
   34    HG   SER   8           HG       SER   8 -19.331  -9.108   3.914
   35    H    GLY   9           H        GLY   9 -14.833  -8.163   4.260
   36    HA2  GLY   9           1HA      GLY   9 -14.260  -5.981   6.104
   37    HA3  GLY   9           2HA      GLY   9 -13.434  -7.498   6.423
   38    H    GLU  10           H        GLU  10 -12.890  -8.351   3.843
   39    HA   GLU  10           HA       GLU  10 -10.475  -7.410   3.219
   40    HB2  GLU  10           1HB      GLU  10 -12.578  -8.038   1.139
   41    HB3  GLU  10           2HB      GLU  10 -10.839  -8.052   0.881
   42    HG2  GLU  10           1HG      GLU  10 -12.421  -9.892   2.657
   43    HG3  GLU  10           2HG      GLU  10 -11.618 -10.301   1.142
   44    H    LYS  11           H        LYS  11  -9.513  -5.649   2.381
   45    HA   LYS  11           HA       LYS  11 -11.203  -3.327   1.850
   46    HB2  LYS  11           1HB      LYS  11  -8.275  -3.675   2.451
   47    HB3  LYS  11           2HB      LYS  11  -8.910  -2.152   1.841
   48    HG2  LYS  11           1HG      LYS  11  -8.863  -1.871   4.149
   49    HG3  LYS  11           2HG      LYS  11 -10.549  -2.259   3.800
   50    HD2  LYS  11           1HD      LYS  11 -10.019  -3.579   5.662
   51    HD3  LYS  11           2HD      LYS  11  -9.899  -4.686   4.292
   52    HE2  LYS  11           1HE      LYS  11  -7.436  -4.216   4.251
   53    HE3  LYS  11           2HE      LYS  11  -7.644  -3.328   5.759
   54    HZ1  LYS  11           3HZ      LYS  11  -7.822  -5.209   6.931
   55    HZ2  LYS  11           1HZ      LYS  11  -7.096  -5.951   5.595
   56    HZ3  LYS  11           2HZ      LYS  11  -8.778  -5.983   5.768
   57    HA   PRO  12           HA       PRO  12 -10.663  -3.522  -2.514
   58    HB2  PRO  12           1HB      PRO  12 -11.056  -0.905  -3.119
   59    HB3  PRO  12           2HB      PRO  12 -12.369  -1.988  -2.644
   60    HG2  PRO  12           1HG      PRO  12 -10.873   0.012  -0.994
   61    HG3  PRO  12           2HG      PRO  12 -12.613  -0.326  -1.036
   62    HD2  PRO  12           1HD      PRO  12 -10.989  -1.287   0.906
   63    HD3  PRO  12           2HD      PRO  12 -12.415  -2.173   0.329
   64    H    TYR  13           H        TYR  13  -8.950  -0.941  -0.777
   65    HA   TYR  13           HA       TYR  13  -6.786  -1.129  -2.766
   66    HB2  TYR  13           1HB      TYR  13  -7.167   1.165  -0.853
   67    HB3  TYR  13           2HB      TYR  13  -6.231   1.127  -2.343
   68    HD1  TYR  13           HD1      TYR  13  -7.343   1.293  -4.517
   69    HD2  TYR  13           HD2      TYR  13  -9.554   1.525  -0.889
   70    HE1  TYR  13           HE1      TYR  13  -9.261   2.212  -5.752
   71    HE2  TYR  13           HE2      TYR  13 -11.479   2.444  -2.115
   72    HH   TYR  13           HH       TYR  13 -11.475   3.852  -4.755
   73    H    LYS  14           H        LYS  14  -4.667  -1.344  -2.085
   74    HA   LYS  14           HA       LYS  14  -4.037  -1.443   0.737
   75    HB2  LYS  14           1HB      LYS  14  -4.914  -3.687   0.393
   76    HB3  LYS  14           2HB      LYS  14  -3.856  -3.916  -0.994
   77    HG2  LYS  14           1HG      LYS  14  -2.607  -3.254   1.616
   78    HG3  LYS  14           2HG      LYS  14  -3.262  -4.878   1.388
   79    HD2  LYS  14           1HD      LYS  14  -1.921  -4.728  -0.878
   80    HD3  LYS  14           2HD      LYS  14  -0.984  -3.530   0.018
   81    HE2  LYS  14           1HE      LYS  14  -0.992  -5.410   1.865
   82    HE3  LYS  14           2HE      LYS  14  -1.273  -6.460   0.477
   83    HZ1  LYS  14           3HZ      LYS  14   1.145  -5.760   1.306
   84    HZ2  LYS  14           1HZ      LYS  14   0.866  -4.512   0.198
   85    HZ3  LYS  14           2HZ      LYS  14   0.796  -6.124  -0.308
   86    H    CYS  15           H        CYS  15  -2.317  -0.141   0.705
   87    HA   CYS  15           HA       CYS  15  -0.602   0.347  -1.411
   88    HB2  CYS  15           1HB      CYS  15  -0.788   1.707   0.684
   89    HB3  CYS  15           2HB      CYS  15   0.148   0.469   1.515
   90    H    SER  16           H        SER  16   0.940  -0.790  -2.376
   91    HA   SER  16           HA       SER  16   1.733  -3.349  -1.267
   92    HB2  SER  16           1HB      SER  16   2.071  -1.990  -3.919
   93    HB3  SER  16           2HB      SER  16   3.097  -3.364  -3.507
   94    HG   SER  16           HG       SER  16   0.257  -3.353  -3.481
   95    H    GLU  17           H        GLU  17   3.047  -0.162  -1.696
   96    HA   GLU  17           HA       GLU  17   5.768  -0.613  -1.590
   97    HB2  GLU  17           1HB      GLU  17   4.015   1.609  -0.623
   98    HB3  GLU  17           2HB      GLU  17   5.722   1.626  -0.205
   99    HG2  GLU  17           1HG      GLU  17   4.969   1.199  -3.046
  100    HG3  GLU  17           2HG      GLU  17   4.816   2.818  -2.366
  101    H    CYS  18           H        CYS  18   3.552  -0.164   1.162
  102    HA   CYS  18           HA       CYS  18   5.618  -1.311   2.916
  103    HB2  CYS  18           1HB      CYS  18   4.255  -0.279   4.771
  104    HB3  CYS  18           2HB      CYS  18   5.012   0.871   3.673
  105    H    GLY  19           H        GLY  19   2.190  -1.457   2.065
  106    HA2  GLY  19           1HA      GLY  19   1.136  -3.632   1.889
  107    HA3  GLY  19           2HA      GLY  19   2.116  -4.157   3.250
  108    H    LYS  20           H        LYS  20   0.293  -1.144   2.960
  109    HA   LYS  20           HA       LYS  20  -1.258  -1.963   5.321
  110    HB2  LYS  20           1HB      LYS  20  -0.435   0.738   4.274
  111    HB3  LYS  20           2HB      LYS  20  -1.710   0.560   5.471
  112    HG2  LYS  20           1HG      LYS  20  -0.190  -0.410   7.043
  113    HG3  LYS  20           2HG      LYS  20   1.092  -0.476   5.831
  114    HD2  LYS  20           1HD      LYS  20   0.668   2.110   5.697
  115    HD3  LYS  20           2HD      LYS  20  -0.014   1.870   7.308
  116    HE2  LYS  20           1HE      LYS  20   2.105   0.776   7.986
  117    HE3  LYS  20           2HE      LYS  20   2.773   1.157   6.400
  118    HZ1  LYS  20           3HZ      LYS  20   2.069   3.559   7.046
  119    HZ2  LYS  20           1HZ      LYS  20   3.512   2.912   7.646
  120    HZ3  LYS  20           2HZ      LYS  20   2.136   2.962   8.628
  121    H    ALA  21           H        ALA  21  -3.495  -1.076   5.441
  122    HA   ALA  21           HA       ALA  21  -4.752  -0.886   2.785
  123    HB1  ALA  21           3HB      ALA  21  -6.022  -2.366   5.070
  124    HB2  ALA  21           1HB      ALA  21  -6.467  -2.385   3.364
  125    HB3  ALA  21           2HB      ALA  21  -4.976  -3.164   3.895
  126    H    PHE  22           H        PHE  22  -6.471   0.505   2.599
  127    HA   PHE  22           HA       PHE  22  -7.240   2.000   5.014
  128    HB2  PHE  22           1HB      PHE  22  -6.798   3.209   2.277
  129    HB3  PHE  22           2HB      PHE  22  -7.248   4.072   3.744
  130    HD1  PHE  22           HD2      PHE  22  -5.623   4.441   5.520
  131    HD2  PHE  22           HD1      PHE  22  -4.542   2.495   1.892
  132    HE1  PHE  22           HE2      PHE  22  -3.244   4.790   6.045
  133    HE2  PHE  22           HE1      PHE  22  -2.162   2.840   2.412
  134    HZ   PHE  22           HZ       PHE  22  -1.510   3.990   4.490
  135    H    HIS  23           H        HIS  23  -9.360   2.819   5.059
  136    HA   HIS  23           HA       HIS  23 -11.311   1.183   3.859
  137    HB2  HIS  23           1HB      HIS  23 -11.725   2.309   5.977
  138    HB3  HIS  23           2HB      HIS  23 -11.593   3.882   5.197
  139    HD1  HIS  23           HD1      HIS  23 -14.017   4.430   6.007
  140    HD2  HIS  23           HD2      HIS  23 -13.747   1.235   3.365
  141    HE1  HIS  23           HE1      HIS  23 -16.368   4.003   5.226
  142    H    ARG  24           H        ARG  24 -10.360   4.545   3.189
  143    HA   ARG  24           HA       ARG  24 -11.764   4.333   0.607
  144    HB2  ARG  24           1HB      ARG  24 -11.128   6.811   2.220
  145    HB3  ARG  24           2HB      ARG  24 -11.923   6.794   0.652
  146    HG2  ARG  24           1HG      ARG  24 -13.843   5.719   1.542
  147    HG3  ARG  24           2HG      ARG  24 -13.029   5.403   3.075
  148    HD2  ARG  24           1HD      ARG  24 -13.253   8.221   2.159
  149    HD3  ARG  24           2HD      ARG  24 -14.706   7.430   2.768
  150    HE   ARG  24           HE       ARG  24 -12.367   8.200   4.288
  151   HH11  ARG  24          1HH1      ARG  24 -15.277   6.293   4.179
  152   HH12  ARG  24          2HH1      ARG  24 -15.401   6.145   5.901
  153   HH21  ARG  24          1HH2      ARG  24 -12.519   8.013   6.557
  154   HH22  ARG  24          2HH2      ARG  24 -13.832   7.125   7.252
  155    H    HIS  25           H        HIS  25 -10.755   5.189  -1.250
  156    HA   HIS  25           HA       HIS  25  -8.013   4.681  -1.481
  157    HB2  HIS  25           1HB      HIS  25  -8.248   5.197  -3.713
  158    HB3  HIS  25           2HB      HIS  25  -9.930   4.896  -3.286
  159    HD1  HIS  25           HD1      HIS  25 -11.546   6.852  -3.424
  160    HD2  HIS  25           HD2      HIS  25  -7.596   7.936  -4.119
  161    HE1  HIS  25           HE1      HIS  25 -11.639   9.210  -4.294
  162    H    THR  26           H        THR  26  -9.773   7.725  -1.090
  163    HA   THR  26           HA       THR  26  -7.855   9.604  -1.499
  164    HB   THR  26           HB       THR  26  -8.918  10.971   0.291
  165    HG1  THR  26           HG1      THR  26 -10.846   9.889   1.243
  166   HG21  THR  26          3HG2      THR  26 -10.217   9.778  -2.005
  167   HG22  THR  26          1HG2      THR  26 -10.280  11.439  -1.417
  168   HG23  THR  26          2HG2      THR  26 -11.386  10.230  -0.764
  169    H    HIS  27           H        HIS  27  -8.328   7.782   1.522
  170    HA   HIS  27           HA       HIS  27  -6.241   8.951   2.973
  171    HB2  HIS  27           1HB      HIS  27  -7.597   6.269   3.151
  172    HB3  HIS  27           2HB      HIS  27  -6.291   6.712   4.246
  173    HD1  HIS  27           HD1      HIS  27  -9.208   6.174   5.210
  174    HD2  HIS  27           HD2      HIS  27  -7.608   9.926   4.418
  175    HE1  HIS  27           HE1      HIS  27 -10.597   7.792   6.543
  176    H    LEU  28           H        LEU  28  -6.270   6.031   0.951
  177    HA   LEU  28           HA       LEU  28  -3.660   5.189   1.380
  178    HB2  LEU  28           1HB      LEU  28  -5.052   3.721   0.218
  179    HB3  LEU  28           2HB      LEU  28  -5.525   4.951  -0.952
  180    HG   LEU  28           HG       LEU  28  -2.981   4.812  -1.626
  181   HD11  LEU  28          1HD1      LEU  28  -3.081   2.841   0.331
  182   HD12  LEU  28          2HD1      LEU  28  -1.794   3.106  -0.844
  183   HD13  LEU  28          3HD1      LEU  28  -3.087   1.960  -1.197
  184   HD21  LEU  28          3HD2      LEU  28  -4.947   2.663  -2.408
  185   HD22  LEU  28          1HD2      LEU  28  -3.578   3.246  -3.355
  186   HD23  LEU  28          2HD2      LEU  28  -4.949   4.310  -3.042
  187    H    ASN  29           H        ASN  29  -4.866   7.279  -1.246
  188    HA   ASN  29           HA       ASN  29  -2.455   7.818  -2.487
  189    HB2  ASN  29           1HB      ASN  29  -4.745   8.486  -3.291
  190    HB3  ASN  29           2HB      ASN  29  -4.695   9.818  -2.140
  191   HD21  ASN  29          1HD2      ASN  29  -5.056  10.836  -4.374
  192   HD22  ASN  29          2HD2      ASN  29  -3.630  11.384  -5.180
  193    H    GLU  30           H        GLU  30  -4.058   9.857  -0.034
  194    HA   GLU  30           HA       GLU  30  -2.021  11.711   0.293
  195    HB2  GLU  30           1HB      GLU  30  -4.265  10.752   2.004
  196    HB3  GLU  30           2HB      GLU  30  -3.025  11.747   2.754
  197    HG2  GLU  30           1HG      GLU  30  -4.686  13.246   2.097
  198    HG3  GLU  30           2HG      GLU  30  -3.428  13.402   0.873
  199    H    HIS  31           H        HIS  31  -2.189   8.435   1.327
  200    HA   HIS  31           HA       HIS  31  -0.152   8.696   3.360
  201    HB2  HIS  31           1HB      HIS  31  -1.546   6.959   3.933
  202    HB3  HIS  31           2HB      HIS  31  -1.807   6.473   2.261
  203    HD1  HIS  31           HD1      HIS  31   0.410   5.896   5.186
  204    HD2  HIS  31           HD2      HIS  31   0.157   4.732   1.206
  205    HE1  HIS  31           HE1      HIS  31   2.002   3.964   4.948
  206    H    ARG  32           H        ARG  32  -0.391   7.189   0.144
  207    HA   ARG  32           HA       ARG  32   1.981   6.046  -0.264
  208    HB2  ARG  32           1HB      ARG  32   0.720   8.036  -2.160
  209    HB3  ARG  32           2HB      ARG  32   1.940   6.849  -2.603
  210    HG2  ARG  32           1HG      ARG  32   0.306   5.088  -1.777
  211    HG3  ARG  32           2HG      ARG  32  -0.900   6.376  -1.765
  212    HD2  ARG  32           1HD      ARG  32  -0.024   6.778  -4.208
  213    HD3  ARG  32           2HD      ARG  32   0.503   5.101  -4.066
  214    HE   ARG  32           HE       ARG  32  -2.066   4.970  -3.281
  215   HH11  ARG  32          1HH1      ARG  32  -0.526   6.403  -6.055
  216   HH12  ARG  32          2HH1      ARG  32  -1.891   6.169  -7.097
  217   HH21  ARG  32          1HH2      ARG  32  -3.869   4.656  -4.642
  218   HH22  ARG  32          2HH2      ARG  32  -3.792   5.175  -6.292
  219    H    ARG  33           H        ARG  33   1.484   9.489   0.123
  220    HA   ARG  33           HA       ARG  33   3.819  10.573  -0.798
  221    HB2  ARG  33           1HB      ARG  33   2.167  11.241   1.627
  222    HB3  ARG  33           2HB      ARG  33   3.588  12.183   1.197
  223    HG2  ARG  33           1HG      ARG  33   1.577  13.237   0.360
  224    HG3  ARG  33           2HG      ARG  33   2.589  12.691  -0.978
  225    HD2  ARG  33           1HD      ARG  33   1.189  10.734  -1.275
  226    HD3  ARG  33           2HD      ARG  33   0.215  11.192   0.122
  227    HE   ARG  33           HE       ARG  33  -0.073  12.154  -2.527
  228   HH11  ARG  33          1HH1      ARG  33  -0.266  13.159   0.801
  229   HH12  ARG  33          2HH1      ARG  33  -1.412  14.420   0.490
  230   HH21  ARG  33          1HH2      ARG  33  -1.581  13.812  -2.949
  231   HH22  ARG  33          2HH2      ARG  33  -2.159  14.791  -1.644
  232    H    ILE  34           H        ILE  34   3.300   9.140   2.417
  233    HA   ILE  34           HA       ILE  34   5.681   9.544   3.639
  234    HB   ILE  34           HB       ILE  34   5.391   7.488   4.857
  235   HG12  ILE  34          1HG1      ILE  34   3.133   6.592   3.124
  236   HG13  ILE  34          2HG1      ILE  34   4.776   6.280   2.572
  237   HG21  ILE  34          1HG2      ILE  34   3.087   7.741   5.610
  238   HG22  ILE  34          2HG2      ILE  34   3.838   9.314   5.344
  239   HG23  ILE  34          3HG2      ILE  34   2.705   8.666   4.158
  240   HD11  ILE  34          3HD1      ILE  34   4.035   4.354   3.728
  241   HD12  ILE  34          1HD1      ILE  34   5.200   5.167   4.773
  242   HD13  ILE  34          2HD1      ILE  34   3.472   5.312   5.097
  243    H    HIS  35           H        HIS  35   5.127   7.606   0.828
  244    HA   HIS  35           HA       HIS  35   7.713   6.291   0.998
  245    HB2  HIS  35           1HB      HIS  35   5.532   6.193  -1.094
  246    HB3  HIS  35           2HB      HIS  35   7.033   5.276  -1.188
  247    HD1  HIS  35           HD1      HIS  35   7.351   3.940   1.388
  248    HD2  HIS  35           HD2      HIS  35   3.584   4.536  -0.258
  249    HE1  HIS  35           HE1      HIS  35   5.862   2.233   2.481
  250    H    THR  36           H        THR  36   6.154   8.899  -0.750
  251    HA   THR  36           HA       THR  36   8.498   9.313  -2.431
  252    HB   THR  36           HB       THR  36   7.196  11.087  -3.509
  253    HG1  THR  36           HG1      THR  36   4.881  11.145  -2.765
  254   HG21  THR  36          3HG2      THR  36   6.725   8.383  -3.666
  255   HG22  THR  36          1HG2      THR  36   6.108   9.597  -4.785
  256   HG23  THR  36          2HG2      THR  36   5.107   9.048  -3.442
  257    H    GLY  37           H        GLY  37  10.001   9.912  -0.797
  258    HA2  GLY  37           1HA      GLY  37   9.715  11.844   1.149
  259    HA3  GLY  37           2HA      GLY  37  11.230  11.493   0.331
  260    H    TYR  38           H        TYR  38  10.430  14.048   1.277
  261    HA   TYR  38           HA       TYR  38   9.376  15.664  -0.793
  262    HB2  TYR  38           1HB      TYR  38   9.243  16.594   1.357
  263    HB3  TYR  38           2HB      TYR  38  10.928  16.239   1.717
  264    HD1  TYR  38           HD1      TYR  38   8.684  18.460  -0.207
  265    HD2  TYR  38           HD2      TYR  38  12.649  17.787   1.183
  266    HE1  TYR  38           HE1      TYR  38   9.301  20.744  -0.879
  267    HE2  TYR  38           HE2      TYR  38  13.276  20.070   0.515
  268    HH   TYR  38           HH       TYR  38  12.009  21.811  -1.497
  269    H    ARG  39           H        ARG  39  10.419  17.100  -2.201
  270    HA   ARG  39           HA       ARG  39  13.204  16.365  -2.814
  271    HB2  ARG  39           1HB      ARG  39  10.878  17.131  -4.533
  272    HB3  ARG  39           2HB      ARG  39  12.509  17.470  -5.096
  273    HG2  ARG  39           1HG      ARG  39  13.087  15.160  -5.055
  274    HG3  ARG  39           2HG      ARG  39  11.584  14.743  -4.229
  275    HD2  ARG  39           1HD      ARG  39  10.454  15.812  -6.311
  276    HD3  ARG  39           2HD      ARG  39  12.023  15.557  -7.074
  277    HE   ARG  39           HE       ARG  39  11.535  13.335  -7.211
  278   HH11  ARG  39          1HH1      ARG  39   9.485  14.779  -4.796
  279   HH12  ARG  39          2HH1      ARG  39   8.554  13.340  -4.539
  280   HH21  ARG  39          1HH2      ARG  39  10.316  11.435  -6.881
  281   HH22  ARG  39          2HH2      ARG  39   9.028  11.438  -5.724
  282    HA   PRO  40           HA       PRO  40  14.483  20.458  -1.825
  283    HB2  PRO  40           1HB      PRO  40  16.751  20.576  -3.313
  284    HB3  PRO  40           2HB      PRO  40  16.626  19.628  -1.827
  285    HG2  PRO  40           1HG      PRO  40  16.413  18.724  -4.673
  286    HG3  PRO  40           2HG      PRO  40  17.265  17.961  -3.318
  287    HD2  PRO  40           1HD      PRO  40  14.839  17.118  -4.173
  288    HD3  PRO  40           2HD      PRO  40  15.338  17.020  -2.473
  289    H    SER  41           H        SER  41  15.288  22.492  -2.979
  290    HA   SER  41           HA       SER  41  13.396  23.153  -5.022
  291    HB2  SER  41           1HB      SER  41  15.457  24.623  -3.451
  292    HB3  SER  41           2HB      SER  41  14.929  25.340  -4.973
  293    HG   SER  41           HG       SER  41  13.684  25.962  -3.085
  294    H    GLY  42           H        GLY  42  16.914  22.741  -4.901
  295    HA2  GLY  42           1HA      GLY  42  17.035  21.896  -7.616
  296    HA3  GLY  42           2HA      GLY  42  17.583  23.559  -7.461
  297    HA   PRO  43           HA       PRO  43  21.588  22.247  -6.276
  298    HB2  PRO  43           1HB      PRO  43  22.264  24.006  -4.322
  299    HB3  PRO  43           2HB      PRO  43  22.155  24.459  -6.027
  300    HG2  PRO  43           1HG      PRO  43  20.162  24.859  -3.830
  301    HG3  PRO  43           2HG      PRO  43  20.661  25.984  -5.106
  302    HD2  PRO  43           1HD      PRO  43  18.364  24.556  -5.240
  303    HD3  PRO  43           2HD      PRO  43  19.299  24.998  -6.683
  304    H    SER  44           H        SER  44  21.196  20.198  -5.390
  305    HA   SER  44           HA       SER  44  21.086  20.131  -2.445
  306    HB2  SER  44           1HB      SER  44  19.838  18.054  -2.559
  307    HB3  SER  44           2HB      SER  44  18.999  19.277  -3.513
  308    HG   SER  44           HG       SER  44  19.114  17.356  -4.680
  309    H    SER  45           H        SER  45  23.065  19.657  -1.752
  310    HA   SER  45           HA       SER  45  25.197  18.633  -3.064
  311    HB2  SER  45           1HB      SER  45  25.313  19.459  -0.755
  312    HB3  SER  45           2HB      SER  45  24.460  18.023  -0.190
  313    HG   SER  45           HG       SER  45  27.056  18.214  -1.288
  314    H    GLY  46           H        GLY  46  23.075  16.594  -1.037
  315    HA2  GLY  46           1HA      GLY  46  22.715  14.319  -1.074
  316    HA3  GLY  46           2HA      GLY  46  22.558  14.569  -2.807
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -21.988 -19.161  12.286
    2    HA2  GLY   1           1HA      GLY   1 -19.834 -20.271  13.640
    3    HA3  GLY   1           2HA      GLY   1 -20.985 -21.576  13.395
    4    H    SER   2           H        SER   2 -18.418 -19.883  12.065
    5    HA   SER   2           HA       SER   2 -18.892 -21.154   9.456
    6    HB2  SER   2           1HB      SER   2 -19.327 -18.686   9.347
    7    HB3  SER   2           2HB      SER   2 -17.647 -18.418   9.810
    8    HG   SER   2           HG       SER   2 -16.979 -19.309   7.910
    9    H    SER   3           H        SER   3 -17.136 -22.092   8.502
   10    HA   SER   3           HA       SER   3 -15.066 -23.058  10.032
   11    HB2  SER   3           1HB      SER   3 -13.968 -23.686   7.945
   12    HB3  SER   3           2HB      SER   3 -15.707 -23.948   7.808
   13    HG   SER   3           HG       SER   3 -14.471 -22.768   6.046
   14    H    GLY   4           H        GLY   4 -13.052 -22.407  10.601
   15    HA2  GLY   4           1HA      GLY   4 -11.169 -21.075  10.748
   16    HA3  GLY   4           2HA      GLY   4 -11.736 -20.187   9.342
   17    H    SER   5           H        SER   5 -10.856 -18.357  10.621
   18    HA   SER   5           HA       SER   5 -12.840 -17.398  12.579
   19    HB2  SER   5           1HB      SER   5 -11.011 -16.035  13.558
   20    HB3  SER   5           2HB      SER   5 -10.679 -17.765  13.645
   21    HG   SER   5           HG       SER   5  -9.762 -16.396  11.399
   22    H    SER   6           H        SER   6 -14.028 -15.755  11.899
   23    HA   SER   6           HA       SER   6 -13.226 -14.260   9.542
   24    HB2  SER   6           1HB      SER   6 -15.593 -15.175  10.023
   25    HB3  SER   6           2HB      SER   6 -15.751 -13.801  11.117
   26    HG   SER   6           HG       SER   6 -16.458 -12.996   9.244
   27    H    GLY   7           H        GLY   7 -12.280 -12.332   9.594
   28    HA2  GLY   7           1HA      GLY   7 -12.879 -10.140  11.094
   29    HA3  GLY   7           2HA      GLY   7 -11.767 -11.039  12.116
   30    H    SER   8           H        SER   8 -11.955 -10.230   8.645
   31    HA   SER   8           HA       SER   8  -9.167  -9.291   8.834
   32    HB2  SER   8           1HB      SER   8 -10.541 -10.694   6.530
   33    HB3  SER   8           2HB      SER   8  -8.930  -9.981   6.444
   34    HG   SER   8           HG       SER   8  -9.425 -11.761   8.526
   35    H    GLY   9           H        GLY   9 -12.007  -9.021   6.682
   36    HA2  GLY   9           1HA      GLY   9 -13.087  -7.113   5.930
   37    HA3  GLY   9           2HA      GLY   9 -11.995  -6.148   6.912
   38    H    GLU  10           H        GLU  10 -11.968  -8.182   3.987
   39    HA   GLU  10           HA       GLU  10  -9.632  -7.075   2.885
   40    HB2  GLU  10           1HB      GLU  10 -10.239  -8.173   0.847
   41    HB3  GLU  10           2HB      GLU  10 -10.715  -9.220   2.178
   42    HG2  GLU  10           1HG      GLU  10 -13.026  -8.418   1.958
   43    HG3  GLU  10           2HG      GLU  10 -12.534  -7.425   0.587
   44    H    LYS  11           H        LYS  11  -9.245  -5.191   1.929
   45    HA   LYS  11           HA       LYS  11 -11.548  -3.559   1.081
   46    HB2  LYS  11           1HB      LYS  11  -8.849  -2.508   1.929
   47    HB3  LYS  11           2HB      LYS  11 -10.327  -1.589   1.675
   48    HG2  LYS  11           1HG      LYS  11 -10.345  -3.730   3.733
   49    HG3  LYS  11           2HG      LYS  11  -9.488  -2.228   4.087
   50    HD2  LYS  11           1HD      LYS  11 -11.564  -1.665   4.853
   51    HD3  LYS  11           2HD      LYS  11 -11.731  -1.160   3.169
   52    HE2  LYS  11           1HE      LYS  11 -12.577  -3.591   2.803
   53    HE3  LYS  11           2HE      LYS  11 -12.841  -3.574   4.546
   54    HZ1  LYS  11           3HZ      LYS  11 -14.393  -2.383   2.488
   55    HZ2  LYS  11           1HZ      LYS  11 -13.909  -1.216   3.614
   56    HZ3  LYS  11           2HZ      LYS  11 -14.763  -2.583   4.126
   57    HA   PRO  12           HA       PRO  12  -9.967  -3.473  -3.016
   58    HB2  PRO  12           1HB      PRO  12 -10.809  -1.024  -3.833
   59    HB3  PRO  12           2HB      PRO  12 -11.907  -2.391  -3.606
   60    HG2  PRO  12           1HG      PRO  12 -11.338  -0.094  -1.773
   61    HG3  PRO  12           2HG      PRO  12 -12.894  -0.838  -2.185
   62    HD2  PRO  12           1HD      PRO  12 -11.582  -1.386   0.120
   63    HD3  PRO  12           2HD      PRO  12 -12.591  -2.586  -0.713
   64    H    TYR  13           H        TYR  13  -9.012  -1.092  -0.701
   65    HA   TYR  13           HA       TYR  13  -6.768  -0.273  -2.423
   66    HB2  TYR  13           1HB      TYR  13  -7.764   1.157   0.045
   67    HB3  TYR  13           2HB      TYR  13  -6.623   1.758  -1.154
   68    HD1  TYR  13           HD1      TYR  13  -7.495   2.117  -3.539
   69    HD2  TYR  13           HD2      TYR  13 -10.050   1.590  -0.178
   70    HE1  TYR  13           HE1      TYR  13  -9.345   3.144  -4.792
   71    HE2  TYR  13           HE2      TYR  13 -11.908   2.615  -1.422
   72    HH   TYR  13           HH       TYR  13 -12.515   3.668  -3.287
   73    H    LYS  14           H        LYS  14  -4.752  -0.793  -1.853
   74    HA   LYS  14           HA       LYS  14  -4.006  -1.277   0.884
   75    HB2  LYS  14           1HB      LYS  14  -5.014  -3.439   0.284
   76    HB3  LYS  14           2HB      LYS  14  -3.932  -3.561  -1.097
   77    HG2  LYS  14           1HG      LYS  14  -2.801  -3.249   1.647
   78    HG3  LYS  14           2HG      LYS  14  -3.384  -4.824   1.104
   79    HD2  LYS  14           1HD      LYS  14  -1.917  -4.301  -1.003
   80    HD3  LYS  14           2HD      LYS  14  -1.094  -3.194   0.098
   81    HE2  LYS  14           1HE      LYS  14  -0.377  -4.915   1.488
   82    HE3  LYS  14           2HE      LYS  14  -1.601  -6.036   0.893
   83    HZ1  LYS  14           3HZ      LYS  14   0.381  -6.752  -0.067
   84    HZ2  LYS  14           1HZ      LYS  14   0.903  -5.183  -0.425
   85    HZ3  LYS  14           2HZ      LYS  14  -0.364  -5.874  -1.307
   86    H    CYS  15           H        CYS  15  -2.150  -0.212   1.004
   87    HA   CYS  15           HA       CYS  15  -0.520   0.369  -1.244
   88    HB2  CYS  15           1HB      CYS  15  -0.667   1.826   0.753
   89    HB3  CYS  15           2HB      CYS  15   0.158   0.590   1.697
   90    H    SER  16           H        SER  16   0.868  -0.927  -2.228
   91    HA   SER  16           HA       SER  16   1.679  -3.420  -1.040
   92    HB2  SER  16           1HB      SER  16   1.135  -3.180  -3.468
   93    HB3  SER  16           2HB      SER  16   2.584  -2.193  -3.655
   94    HG   SER  16           HG       SER  16   2.327  -4.920  -3.370
   95    H    GLU  17           H        GLU  17   3.104  -0.284  -1.629
   96    HA   GLU  17           HA       GLU  17   5.791  -0.753  -1.461
   97    HB2  GLU  17           1HB      GLU  17   4.261   1.485  -0.123
   98    HB3  GLU  17           2HB      GLU  17   5.995   1.479  -0.414
   99    HG2  GLU  17           1HG      GLU  17   3.980   1.231  -2.624
  100    HG3  GLU  17           2HG      GLU  17   4.578   2.783  -2.043
  101    H    CYS  18           H        CYS  18   3.675  -0.116   1.342
  102    HA   CYS  18           HA       CYS  18   5.699  -1.373   3.062
  103    HB2  CYS  18           1HB      CYS  18   4.484  -0.260   4.931
  104    HB3  CYS  18           2HB      CYS  18   5.135   0.873   3.750
  105    H    GLY  19           H        GLY  19   2.266  -1.421   2.235
  106    HA2  GLY  19           1HA      GLY  19   1.175  -3.595   2.098
  107    HA3  GLY  19           2HA      GLY  19   2.100  -4.078   3.512
  108    H    LYS  20           H        LYS  20   0.417  -1.011   3.079
  109    HA   LYS  20           HA       LYS  20  -1.194  -1.649   5.445
  110    HB2  LYS  20           1HB      LYS  20   0.283   0.473   5.208
  111    HB3  LYS  20           2HB      LYS  20  -1.012   1.068   4.177
  112    HG2  LYS  20           1HG      LYS  20  -2.544   1.132   5.925
  113    HG3  LYS  20           2HG      LYS  20  -1.588   0.037   6.928
  114    HD2  LYS  20           1HD      LYS  20   0.173   1.839   7.011
  115    HD3  LYS  20           2HD      LYS  20  -1.004   2.916   6.256
  116    HE2  LYS  20           1HE      LYS  20  -1.248   3.349   8.531
  117    HE3  LYS  20           2HE      LYS  20  -2.560   2.223   8.183
  118    HZ1  LYS  20           3HZ      LYS  20  -1.334   1.683  10.230
  119    HZ2  LYS  20           1HZ      LYS  20   0.070   1.441   9.317
  120    HZ3  LYS  20           2HZ      LYS  20  -1.270   0.434   9.090
  121    H    ALA  21           H        ALA  21  -3.441  -0.744   5.466
  122    HA   ALA  21           HA       ALA  21  -4.693  -0.796   2.807
  123    HB1  ALA  21           3HB      ALA  21  -6.438  -2.259   3.553
  124    HB2  ALA  21           1HB      ALA  21  -4.886  -3.025   3.895
  125    HB3  ALA  21           2HB      ALA  21  -5.800  -2.260   5.197
  126    H    PHE  22           H        PHE  22  -6.456   0.526   2.543
  127    HA   PHE  22           HA       PHE  22  -7.347   2.069   4.880
  128    HB2  PHE  22           1HB      PHE  22  -6.709   3.234   2.161
  129    HB3  PHE  22           2HB      PHE  22  -7.346   4.123   3.541
  130    HD1  PHE  22           HD2      PHE  22  -5.931   4.448   5.552
  131    HD2  PHE  22           HD1      PHE  22  -4.404   2.757   1.957
  132    HE1  PHE  22           HE2      PHE  22  -3.638   4.906   6.316
  133    HE2  PHE  22           HE1      PHE  22  -2.108   3.211   2.715
  134    HZ   PHE  22           HZ       PHE  22  -1.722   4.288   4.896
  135    H    HIS  23           H        HIS  23  -9.496   2.482   4.982
  136    HA   HIS  23           HA       HIS  23 -11.261   0.957   3.393
  137    HB2  HIS  23           1HB      HIS  23 -12.977   1.784   4.742
  138    HB3  HIS  23           2HB      HIS  23 -11.570   1.873   5.799
  139    HD1  HIS  23           HD1      HIS  23 -14.387   3.754   5.193
  140    HD2  HIS  23           HD2      HIS  23 -10.346   4.721   5.193
  141    HE1  HIS  23           HE1      HIS  23 -14.291   6.242   5.543
  142    H    ARG  24           H        ARG  24 -10.152   4.270   3.214
  143    HA   ARG  24           HA       ARG  24 -11.830   4.660   0.823
  144    HB2  ARG  24           1HB      ARG  24 -10.793   6.679   2.815
  145    HB3  ARG  24           2HB      ARG  24 -11.533   7.119   1.281
  146    HG2  ARG  24           1HG      ARG  24 -13.028   5.322   3.121
  147    HG3  ARG  24           2HG      ARG  24 -12.932   7.044   3.497
  148    HD2  ARG  24           1HD      ARG  24 -14.874   6.885   2.231
  149    HD3  ARG  24           2HD      ARG  24 -13.666   7.393   1.052
  150    HE   ARG  24           HE       ARG  24 -13.908   5.381  -0.021
  151   HH11  ARG  24          1HH1      ARG  24 -15.400   5.204   3.120
  152   HH12  ARG  24          2HH1      ARG  24 -16.142   3.666   2.825
  153   HH21  ARG  24          1HH2      ARG  24 -14.880   3.356  -0.421
  154   HH22  ARG  24          2HH2      ARG  24 -15.845   2.616   0.810
  155    H    HIS  25           H        HIS  25 -10.899   5.768  -0.963
  156    HA   HIS  25           HA       HIS  25  -8.231   5.010  -1.524
  157    HB2  HIS  25           1HB      HIS  25  -9.574   5.137  -3.421
  158    HB3  HIS  25           2HB      HIS  25 -10.290   6.670  -2.935
  159    HD1  HIS  25           HD1      HIS  25  -9.149   8.794  -3.711
  160    HD2  HIS  25           HD2      HIS  25  -6.981   5.362  -4.596
  161    HE1  HIS  25           HE1      HIS  25  -7.303   9.542  -5.246
  162    H    THR  26           H        THR  26  -9.724   8.144  -0.794
  163    HA   THR  26           HA       THR  26  -7.663   9.878  -1.168
  164    HB   THR  26           HB       THR  26  -8.536  11.177   0.802
  165    HG1  THR  26           HG1      THR  26 -10.598   9.261   0.981
  166   HG21  THR  26          3HG2      THR  26 -10.307  11.947  -0.408
  167   HG22  THR  26          1HG2      THR  26 -10.937  10.330  -0.722
  168   HG23  THR  26          2HG2      THR  26  -9.566  10.938  -1.650
  169    H    HIS  27           H        HIS  27  -8.162   7.826   1.687
  170    HA   HIS  27           HA       HIS  27  -5.939   8.741   3.148
  171    HB2  HIS  27           1HB      HIS  27  -7.686   6.325   3.238
  172    HB3  HIS  27           2HB      HIS  27  -6.170   6.284   4.133
  173    HD1  HIS  27           HD1      HIS  27  -6.679   6.741   6.502
  174    HD2  HIS  27           HD2      HIS  27  -8.923   9.138   3.957
  175    HE1  HIS  27           HE1      HIS  27  -8.010   8.256   8.005
  176    H    LEU  28           H        LEU  28  -6.310   6.004   0.919
  177    HA   LEU  28           HA       LEU  28  -3.744   4.934   1.196
  178    HB2  LEU  28           1HB      LEU  28  -5.366   3.635   0.092
  179    HB3  LEU  28           2HB      LEU  28  -5.721   4.918  -1.063
  180    HG   LEU  28           HG       LEU  28  -3.253   4.519  -1.827
  181   HD11  LEU  28          1HD1      LEU  28  -3.841   2.178  -0.104
  182   HD12  LEU  28          2HD1      LEU  28  -2.313   2.996  -0.425
  183   HD13  LEU  28          3HD1      LEU  28  -2.989   1.890  -1.621
  184   HD21  LEU  28          3HD2      LEU  28  -4.253   2.432  -3.147
  185   HD22  LEU  28          1HD2      LEU  28  -4.742   4.092  -3.485
  186   HD23  LEU  28          2HD2      LEU  28  -5.753   3.066  -2.468
  187    H    ASN  29           H        ASN  29  -4.949   7.093  -1.379
  188    HA   ASN  29           HA       ASN  29  -2.547   7.531  -2.678
  189    HB2  ASN  29           1HB      ASN  29  -4.811   8.269  -3.463
  190    HB3  ASN  29           2HB      ASN  29  -4.728   9.593  -2.305
  191   HD21  ASN  29          1HD2      ASN  29  -4.227  11.428  -3.234
  192   HD22  ASN  29          2HD2      ASN  29  -3.128  11.644  -4.549
  193    H    GLU  30           H        GLU  30  -4.002   9.518  -0.101
  194    HA   GLU  30           HA       GLU  30  -1.940  11.377   0.134
  195    HB2  GLU  30           1HB      GLU  30  -4.100  10.403   1.946
  196    HB3  GLU  30           2HB      GLU  30  -2.820  11.391   2.637
  197    HG2  GLU  30           1HG      GLU  30  -3.376  12.959   0.607
  198    HG3  GLU  30           2HG      GLU  30  -4.922  12.115   0.665
  199    H    HIS  31           H        HIS  31  -2.424   8.308   1.854
  200    HA   HIS  31           HA       HIS  31  -0.239   8.441   3.569
  201    HB2  HIS  31           1HB      HIS  31  -1.636   6.676   4.069
  202    HB3  HIS  31           2HB      HIS  31  -1.831   6.212   2.381
  203    HD1  HIS  31           HD1      HIS  31   0.182   5.529   5.395
  204    HD2  HIS  31           HD2      HIS  31   0.325   4.641   1.339
  205    HE1  HIS  31           HE1      HIS  31   1.855   3.664   5.173
  206    H    ARG  32           H        ARG  32  -0.423   6.995   0.321
  207    HA   ARG  32           HA       ARG  32   2.062   5.971  -0.002
  208    HB2  ARG  32           1HB      ARG  32   0.318   7.496  -1.914
  209    HB3  ARG  32           2HB      ARG  32   1.885   6.885  -2.425
  210    HG2  ARG  32           1HG      ARG  32   1.237   4.651  -2.120
  211    HG3  ARG  32           2HG      ARG  32  -0.184   5.108  -1.178
  212    HD2  ARG  32           1HD      ARG  32  -0.914   4.457  -3.361
  213    HD3  ARG  32           2HD      ARG  32  -1.100   6.204  -3.218
  214    HE   ARG  32           HE       ARG  32   1.344   5.925  -4.350
  215   HH11  ARG  32          1HH1      ARG  32  -1.819   4.695  -5.126
  216   HH12  ARG  32          2HH1      ARG  32  -1.522   4.639  -6.832
  217   HH21  ARG  32          1HH2      ARG  32   1.748   5.856  -6.594
  218   HH22  ARG  32          2HH2      ARG  32   0.508   5.299  -7.666
  219    H    ARG  33           H        ARG  33   1.262   9.303   0.408
  220    HA   ARG  33           HA       ARG  33   3.328  10.668  -0.754
  221    HB2  ARG  33           1HB      ARG  33   1.946  11.101   1.887
  222    HB3  ARG  33           2HB      ARG  33   3.158  12.220   1.278
  223    HG2  ARG  33           1HG      ARG  33   1.825  12.761  -0.615
  224    HG3  ARG  33           2HG      ARG  33   0.685  11.463  -0.253
  225    HD2  ARG  33           1HD      ARG  33   0.131  12.618   1.874
  226    HD3  ARG  33           2HD      ARG  33   1.179  13.947   1.382
  227    HE   ARG  33           HE       ARG  33  -1.483  13.465   0.510
  228   HH11  ARG  33          1HH1      ARG  33   1.602  14.695  -0.531
  229   HH12  ARG  33          2HH1      ARG  33   0.925  15.746  -1.731
  230   HH21  ARG  33          1HH2      ARG  33  -2.387  14.843  -1.067
  231   HH22  ARG  33          2HH2      ARG  33  -1.344  15.830  -2.035
  232    H    ILE  34           H        ILE  34   3.372   9.135   2.458
  233    HA   ILE  34           HA       ILE  34   5.932   9.808   3.243
  234    HB   ILE  34           HB       ILE  34   5.895   7.932   4.732
  235   HG12  ILE  34          1HG1      ILE  34   3.612   6.853   3.063
  236   HG13  ILE  34          2HG1      ILE  34   5.253   6.215   3.079
  237   HG21  ILE  34          1HG2      ILE  34   4.436   9.215   5.827
  238   HG22  ILE  34          2HG2      ILE  34   3.559   9.617   4.351
  239   HG23  ILE  34          3HG2      ILE  34   3.190   8.126   5.217
  240   HD11  ILE  34          3HD1      ILE  34   4.291   4.771   4.529
  241   HD12  ILE  34          1HD1      ILE  34   4.742   6.034   5.674
  242   HD13  ILE  34          2HD1      ILE  34   3.087   5.940   5.071
  243    H    HIS  35           H        HIS  35   4.914   7.544   0.827
  244    HA   HIS  35           HA       HIS  35   7.531   6.284   0.663
  245    HB2  HIS  35           1HB      HIS  35   4.992   5.875  -0.927
  246    HB3  HIS  35           2HB      HIS  35   6.480   4.972  -1.193
  247    HD1  HIS  35           HD1      HIS  35   7.212   4.433   1.777
  248    HD2  HIS  35           HD2      HIS  35   3.437   3.892   0.130
  249    HE1  HIS  35           HE1      HIS  35   6.063   2.763   3.265
  250    H    THR  36           H        THR  36   5.855   8.920  -0.703
  251    HA   THR  36           HA       THR  36   7.970   9.217  -2.729
  252    HB   THR  36           HB       THR  36   6.281  10.362  -4.191
  253    HG1  THR  36           HG1      THR  36   4.412   9.135  -2.420
  254   HG21  THR  36          3HG2      THR  36   5.025   8.086  -4.664
  255   HG22  THR  36          1HG2      THR  36   6.221   7.457  -3.532
  256   HG23  THR  36          2HG2      THR  36   6.745   8.268  -5.008
  257    H    GLY  37           H        GLY  37   9.138  10.638  -1.427
  258    HA2  GLY  37           1HA      GLY  37   8.350  13.370  -1.587
  259    HA3  GLY  37           2HA      GLY  37   8.184  12.768   0.056
  260    H    TYR  38           H        TYR  38  10.010  12.302   1.265
  261    HA   TYR  38           HA       TYR  38  12.590  12.984   0.023
  262    HB2  TYR  38           1HB      TYR  38  13.225  14.062   2.193
  263    HB3  TYR  38           2HB      TYR  38  11.951  14.905   1.319
  264    HD1  TYR  38           HD2      TYR  38   9.528  14.448   2.045
  265    HD2  TYR  38           HD1      TYR  38  12.909  13.426   4.418
  266    HE1  TYR  38           HE2      TYR  38   8.092  14.352   4.040
  267    HE2  TYR  38           HE1      TYR  38  11.482  13.326   6.419
  268    HH   TYR  38           HH       TYR  38   8.473  12.919   6.513
  269    H    ARG  39           H        ARG  39  14.470  12.153   1.227
  270    HA   ARG  39           HA       ARG  39  13.837   9.553   2.452
  271    HB2  ARG  39           1HB      ARG  39  16.572  10.178   1.446
  272    HB3  ARG  39           2HB      ARG  39  15.709   8.646   1.471
  273    HG2  ARG  39           1HG      ARG  39  15.164  10.941  -0.402
  274    HG3  ARG  39           2HG      ARG  39  16.036   9.460  -0.802
  275    HD2  ARG  39           1HD      ARG  39  13.833   8.326   0.094
  276    HD3  ARG  39           2HD      ARG  39  13.129   9.889  -0.319
  277    HE   ARG  39           HE       ARG  39  13.224   9.263  -2.503
  278   HH11  ARG  39          1HH1      ARG  39  15.610   7.442  -0.738
  279   HH12  ARG  39          2HH1      ARG  39  16.092   6.497  -2.108
  280   HH21  ARG  39          1HH2      ARG  39  13.850   8.025  -4.314
  281   HH22  ARG  39          2HH2      ARG  39  15.091   6.830  -4.142
  282    HA   PRO  40           HA       PRO  40  15.542  12.091   5.912
  283    HB2  PRO  40           1HB      PRO  40  13.882  11.042   7.786
  284    HB3  PRO  40           2HB      PRO  40  13.430  12.408   6.759
  285    HG2  PRO  40           1HG      PRO  40  12.738   9.509   6.470
  286    HG3  PRO  40           2HG      PRO  40  11.703  10.933   6.257
  287    HD2  PRO  40           1HD      PRO  40  12.794   9.600   4.169
  288    HD3  PRO  40           2HD      PRO  40  12.499  11.350   4.134
  289    H    SER  41           H        SER  41  14.744   8.658   5.690
  290    HA   SER  41           HA       SER  41  17.310   7.949   6.798
  291    HB2  SER  41           1HB      SER  41  15.724   8.316   8.780
  292    HB3  SER  41           2HB      SER  41  14.880   6.871   8.224
  293    HG   SER  41           HG       SER  41  17.271   6.063   8.254
  294    H    GLY  42           H        GLY  42  18.038   6.288   5.652
  295    HA2  GLY  42           1HA      GLY  42  16.661   4.990   3.648
  296    HA3  GLY  42           2HA      GLY  42  18.091   4.339   4.435
  297    HA   PRO  43           HA       PRO  43  14.348   1.613   5.230
  298    HB2  PRO  43           1HB      PRO  43  15.368  -0.628   4.085
  299    HB3  PRO  43           2HB      PRO  43  14.439   0.575   3.182
  300    HG2  PRO  43           1HG      PRO  43  17.405   0.210   3.352
  301    HG3  PRO  43           2HG      PRO  43  16.400   0.556   1.933
  302    HD2  PRO  43           1HD      PRO  43  17.814   2.474   3.219
  303    HD3  PRO  43           2HD      PRO  43  16.263   2.804   2.422
  304    H    SER  44           H        SER  44  14.409   1.017   7.300
  305    HA   SER  44           HA       SER  44  16.756  -0.486   8.257
  306    HB2  SER  44           1HB      SER  44  16.607   1.829   9.203
  307    HB3  SER  44           2HB      SER  44  15.057   1.388   9.919
  308    HG   SER  44           HG       SER  44  16.284   0.768  11.518
  309    H    SER  45           H        SER  45  13.309   0.154   8.869
  310    HA   SER  45           HA       SER  45  12.949  -2.210  10.430
  311    HB2  SER  45           1HB      SER  45  11.476  -0.345  10.819
  312    HB3  SER  45           2HB      SER  45  10.973  -0.325   9.129
  313    HG   SER  45           HG       SER  45   9.942  -2.292   9.445
  314    H    GLY  46           H        GLY  46  13.727  -3.914   9.144
  315    HA2  GLY  46           1HA      GLY  46  13.321  -5.764   7.823
  316    HA3  GLY  46           2HA      GLY  46  11.749  -5.083   7.430
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1   2.877 -26.994  -4.121
    2    HA2  GLY   1           1HA      GLY   1   1.793 -28.792  -2.041
    3    HA3  GLY   1           2HA      GLY   1   2.600 -27.280  -1.652
    4    H    SER   2           H        SER   2   0.377 -27.224  -0.495
    5    HA   SER   2           HA       SER   2  -1.303 -25.451  -2.066
    6    HB2  SER   2           1HB      SER   2  -2.193 -28.132  -1.068
    7    HB3  SER   2           2HB      SER   2  -3.347 -26.799  -1.105
    8    HG   SER   2           HG       SER   2  -3.530 -27.705  -3.072
    9    H    SER   3           H        SER   3  -2.403 -23.961  -0.842
   10    HA   SER   3           HA       SER   3  -2.456 -24.248   2.056
   11    HB2  SER   3           1HB      SER   3  -1.156 -21.851   0.742
   12    HB3  SER   3           2HB      SER   3  -1.342 -22.130   2.473
   13    HG   SER   3           HG       SER   3   0.148 -23.732   2.385
   14    H    GLY   4           H        GLY   4  -3.854 -22.714   3.108
   15    HA2  GLY   4           1HA      GLY   4  -6.025 -21.873   1.341
   16    HA3  GLY   4           2HA      GLY   4  -6.107 -22.016   3.090
   17    H    SER   5           H        SER   5  -7.055 -19.806   1.587
   18    HA   SER   5           HA       SER   5  -5.189 -17.704   2.476
   19    HB2  SER   5           1HB      SER   5  -5.696 -17.992  -0.064
   20    HB3  SER   5           2HB      SER   5  -7.244 -17.244   0.332
   21    HG   SER   5           HG       SER   5  -5.948 -15.525   1.310
   22    H    SER   6           H        SER   6  -5.961 -17.065   4.399
   23    HA   SER   6           HA       SER   6  -8.623 -17.141   5.237
   24    HB2  SER   6           1HB      SER   6  -7.900 -15.604   7.044
   25    HB3  SER   6           2HB      SER   6  -6.779 -16.946   6.822
   26    HG   SER   6           HG       SER   6  -5.493 -15.195   6.900
   27    H    GLY   7           H        GLY   7  -6.731 -14.419   3.941
   28    HA2  GLY   7           1HA      GLY   7  -8.861 -13.293   2.515
   29    HA3  GLY   7           2HA      GLY   7  -8.793 -12.505   4.084
   30    H    SER   8           H        SER   8  -7.899 -12.133   0.997
   31    HA   SER   8           HA       SER   8  -5.268 -10.981   1.542
   32    HB2  SER   8           1HB      SER   8  -5.249 -12.279  -0.436
   33    HB3  SER   8           2HB      SER   8  -6.774 -11.595  -0.997
   34    HG   SER   8           HG       SER   8  -4.665  -9.828  -0.578
   35    H    GLY   9           H        GLY   9  -5.198  -8.943   2.207
   36    HA2  GLY   9           1HA      GLY   9  -5.906  -6.778   2.630
   37    HA3  GLY   9           2HA      GLY   9  -5.912  -6.711   0.874
   38    H    GLU  10           H        GLU  10  -7.913  -7.480   3.690
   39    HA   GLU  10           HA       GLU  10 -10.354  -7.970   2.738
   40    HB2  GLU  10           1HB      GLU  10 -11.233  -6.326   4.543
   41    HB3  GLU  10           2HB      GLU  10 -10.272  -7.711   5.045
   42    HG2  GLU  10           1HG      GLU  10  -8.298  -5.970   4.779
   43    HG3  GLU  10           2HG      GLU  10  -9.605  -4.824   5.071
   44    H    LYS  11           H        LYS  11  -8.978  -4.692   2.871
   45    HA   LYS  11           HA       LYS  11 -11.190  -3.630   1.323
   46    HB2  LYS  11           1HB      LYS  11  -8.873  -2.494   2.803
   47    HB3  LYS  11           2HB      LYS  11  -9.520  -1.547   1.470
   48    HG2  LYS  11           1HG      LYS  11 -10.501  -0.902   3.610
   49    HG3  LYS  11           2HG      LYS  11 -11.715  -1.545   2.501
   50    HD2  LYS  11           1HD      LYS  11 -11.542  -3.733   3.644
   51    HD3  LYS  11           2HD      LYS  11 -10.408  -3.015   4.792
   52    HE2  LYS  11           1HE      LYS  11 -12.155  -1.390   5.439
   53    HE3  LYS  11           2HE      LYS  11 -13.280  -2.201   4.351
   54    HZ1  LYS  11           3HZ      LYS  11 -11.916  -3.825   6.366
   55    HZ2  LYS  11           1HZ      LYS  11 -13.475  -3.981   5.727
   56    HZ3  LYS  11           2HZ      LYS  11 -13.153  -2.798   6.891
   57    HA   PRO  12           HA       PRO  12  -9.324  -3.997  -2.639
   58    HB2  PRO  12           1HB      PRO  12 -10.466  -1.881  -3.900
   59    HB3  PRO  12           2HB      PRO  12 -11.355  -3.356  -3.503
   60    HG2  PRO  12           1HG      PRO  12 -11.290  -0.736  -2.057
   61    HG3  PRO  12           2HG      PRO  12 -12.677  -1.781  -2.417
   62    HD2  PRO  12           1HD      PRO  12 -11.480  -1.734   0.012
   63    HD3  PRO  12           2HD      PRO  12 -12.224  -3.200  -0.658
   64    H    TYR  13           H        TYR  13  -8.657  -1.462  -0.532
   65    HA   TYR  13           HA       TYR  13  -6.641  -0.335  -2.361
   66    HB2  TYR  13           1HB      TYR  13  -7.831   0.957   0.101
   67    HB3  TYR  13           2HB      TYR  13  -6.713   1.702  -1.035
   68    HD1  TYR  13           HD2      TYR  13 -10.172   0.625  -0.487
   69    HD2  TYR  13           HD1      TYR  13  -7.472   2.480  -3.201
   70    HE1  TYR  13           HE2      TYR  13 -12.076   1.437  -1.816
   71    HE2  TYR  13           HE1      TYR  13  -9.368   3.299  -4.537
   72    HH   TYR  13           HH       TYR  13 -12.438   3.459  -3.464
   73    H    LYS  14           H        LYS  14  -4.802  -1.419  -1.990
   74    HA   LYS  14           HA       LYS  14  -3.819  -1.507   0.782
   75    HB2  LYS  14           1HB      LYS  14  -4.524  -3.757   0.179
   76    HB3  LYS  14           2HB      LYS  14  -3.570  -3.689  -1.297
   77    HG2  LYS  14           1HG      LYS  14  -2.139  -4.866   0.010
   78    HG3  LYS  14           2HG      LYS  14  -1.612  -3.232   0.423
   79    HD2  LYS  14           1HD      LYS  14  -2.947  -3.259   2.431
   80    HD3  LYS  14           2HD      LYS  14  -3.643  -4.821   1.991
   81    HE2  LYS  14           1HE      LYS  14  -0.681  -4.540   2.250
   82    HE3  LYS  14           2HE      LYS  14  -1.671  -4.685   3.701
   83    HZ1  LYS  14           3HZ      LYS  14  -0.830  -6.712   1.945
   84    HZ2  LYS  14           1HZ      LYS  14  -2.520  -6.641   1.912
   85    HZ3  LYS  14           2HZ      LYS  14  -1.711  -6.861   3.381
   86    H    CYS  15           H        CYS  15  -2.155  -0.154   0.879
   87    HA   CYS  15           HA       CYS  15  -0.715   0.900  -1.226
   88    HB2  CYS  15           1HB      CYS  15  -0.696   1.795   1.083
   89    HB3  CYS  15           2HB      CYS  15   0.298   0.432   1.587
   90    H    SER  16           H        SER  16   0.601  -0.001  -2.651
   91    HA   SER  16           HA       SER  16   1.776  -2.602  -2.113
   92    HB2  SER  16           1HB      SER  16   0.660  -2.007  -4.307
   93    HB3  SER  16           2HB      SER  16   2.035  -0.953  -4.633
   94    HG   SER  16           HG       SER  16   2.045  -3.269  -5.412
   95    H    GLU  17           H        GLU  17   2.801  -0.464  -0.554
   96    HA   GLU  17           HA       GLU  17   5.574  -0.396  -1.544
   97    HB2  GLU  17           1HB      GLU  17   4.149   1.793  -0.022
   98    HB3  GLU  17           2HB      GLU  17   5.843   1.812  -0.492
   99    HG2  GLU  17           1HG      GLU  17   3.637   1.571  -2.507
  100    HG3  GLU  17           2HG      GLU  17   4.213   3.131  -1.924
  101    H    CYS  18           H        CYS  18   3.496  -0.173   1.328
  102    HA   CYS  18           HA       CYS  18   5.701  -1.308   2.918
  103    HB2  CYS  18           1HB      CYS  18   4.522  -0.347   4.893
  104    HB3  CYS  18           2HB      CYS  18   5.066   0.872   3.744
  105    H    GLY  19           H        GLY  19   2.161  -1.357   2.538
  106    HA2  GLY  19           1HA      GLY  19   1.250  -3.675   2.238
  107    HA3  GLY  19           2HA      GLY  19   2.189  -4.089   3.664
  108    H    LYS  20           H        LYS  20   0.288  -1.159   3.128
  109    HA   LYS  20           HA       LYS  20  -1.378  -1.933   5.430
  110    HB2  LYS  20           1HB      LYS  20  -0.303   0.692   4.489
  111    HB3  LYS  20           2HB      LYS  20  -1.827   0.669   5.365
  112    HG2  LYS  20           1HG      LYS  20  -0.800  -0.289   7.286
  113    HG3  LYS  20           2HG      LYS  20   0.706  -0.572   6.409
  114    HD2  LYS  20           1HD      LYS  20   1.309   1.649   6.462
  115    HD3  LYS  20           2HD      LYS  20  -0.359   2.208   6.603
  116    HE2  LYS  20           1HE      LYS  20   0.422   2.603   8.729
  117    HE3  LYS  20           2HE      LYS  20  -0.257   0.987   8.914
  118    HZ1  LYS  20           3HZ      LYS  20   2.601   1.467   8.297
  119    HZ2  LYS  20           1HZ      LYS  20   1.878   0.026   8.810
  120    HZ3  LYS  20           2HZ      LYS  20   2.015   1.330   9.878
  121    H    ALA  21           H        ALA  21  -3.621  -1.370   5.391
  122    HA   ALA  21           HA       ALA  21  -4.710  -0.962   2.683
  123    HB1  ALA  21           3HB      ALA  21  -5.144  -3.167   4.534
  124    HB2  ALA  21           1HB      ALA  21  -6.644  -2.425   3.977
  125    HB3  ALA  21           2HB      ALA  21  -5.482  -3.053   2.807
  126    H    PHE  22           H        PHE  22  -6.418   0.414   2.489
  127    HA   PHE  22           HA       PHE  22  -7.496   1.588   4.963
  128    HB2  PHE  22           1HB      PHE  22  -6.775   3.096   2.441
  129    HB3  PHE  22           2HB      PHE  22  -7.506   3.792   3.884
  130    HD1  PHE  22           HD2      PHE  22  -6.204   4.007   5.953
  131    HD2  PHE  22           HD1      PHE  22  -4.445   2.609   2.338
  132    HE1  PHE  22           HE2      PHE  22  -3.966   4.429   6.883
  133    HE2  PHE  22           HE1      PHE  22  -2.204   3.028   3.263
  134    HZ   PHE  22           HZ       PHE  22  -1.962   3.940   5.538
  135    H    HIS  23           H        HIS  23  -9.590   2.694   4.651
  136    HA   HIS  23           HA       HIS  23 -11.296   1.085   2.934
  137    HB2  HIS  23           1HB      HIS  23 -11.719   1.786   5.427
  138    HB3  HIS  23           2HB      HIS  23 -12.322   3.274   4.705
  139    HD1  HIS  23           HD1      HIS  23 -14.013   1.022   6.253
  140    HD2  HIS  23           HD2      HIS  23 -13.849   1.653   2.149
  141    HE1  HIS  23           HE1      HIS  23 -16.138   0.038   5.335
  142    H    ARG  24           H        ARG  24 -10.453   4.493   3.408
  143    HA   ARG  24           HA       ARG  24 -11.916   5.172   0.957
  144    HB2  ARG  24           1HB      ARG  24 -10.922   6.802   3.280
  145    HB3  ARG  24           2HB      ARG  24 -11.363   7.565   1.758
  146    HG2  ARG  24           1HG      ARG  24 -13.226   7.686   3.250
  147    HG3  ARG  24           2HG      ARG  24 -13.614   6.549   1.957
  148    HD2  ARG  24           1HD      ARG  24 -14.336   5.638   4.071
  149    HD3  ARG  24           2HD      ARG  24 -12.986   4.687   3.452
  150    HE   ARG  24           HE       ARG  24 -11.837   6.549   5.093
  151   HH11  ARG  24          1HH1      ARG  24 -14.283   4.098   5.453
  152   HH12  ARG  24          2HH1      ARG  24 -13.932   3.809   7.125
  153   HH21  ARG  24          1HH2      ARG  24 -11.365   6.177   7.294
  154   HH22  ARG  24          2HH2      ARG  24 -12.273   4.992   8.171
  155    H    HIS  25           H        HIS  25 -10.833   5.424  -0.875
  156    HA   HIS  25           HA       HIS  25  -8.154   5.012  -1.258
  157    HB2  HIS  25           1HB      HIS  25  -9.656   5.010  -3.132
  158    HB3  HIS  25           2HB      HIS  25 -10.062   6.705  -2.877
  159    HD1  HIS  25           HD1      HIS  25  -8.375   8.468  -3.712
  160    HD2  HIS  25           HD2      HIS  25  -7.227   4.543  -4.450
  161    HE1  HIS  25           HE1      HIS  25  -6.459   8.621  -5.334
  162    H    THR  26           H        THR  26  -9.762   8.175  -0.968
  163    HA   THR  26           HA       THR  26  -7.781   9.947  -1.316
  164    HB   THR  26           HB       THR  26  -8.748  11.357   0.485
  165    HG1  THR  26           HG1      THR  26 -10.744  10.280   1.432
  166   HG21  THR  26          3HG2      THR  26 -11.235  10.395  -0.632
  167   HG22  THR  26          1HG2      THR  26  -9.969  10.459  -1.857
  168   HG23  THR  26          2HG2      THR  26 -10.379  11.906  -0.937
  169    H    HIS  27           H        HIS  27  -8.214   7.999   1.616
  170    HA   HIS  27           HA       HIS  27  -6.035   9.109   3.038
  171    HB2  HIS  27           1HB      HIS  27  -7.448   6.452   3.308
  172    HB3  HIS  27           2HB      HIS  27  -6.221   7.024   4.434
  173    HD1  HIS  27           HD1      HIS  27  -9.149   6.449   5.305
  174    HD2  HIS  27           HD2      HIS  27  -7.673  10.190   4.263
  175    HE1  HIS  27           HE1      HIS  27 -10.669   8.108   6.428
  176    H    LEU  28           H        LEU  28  -6.330   6.006   1.303
  177    HA   LEU  28           HA       LEU  28  -3.768   5.068   1.593
  178    HB2  LEU  28           1HB      LEU  28  -5.317   3.650   0.562
  179    HB3  LEU  28           2HB      LEU  28  -5.729   4.847  -0.664
  180    HG   LEU  28           HG       LEU  28  -3.192   4.460  -1.350
  181   HD11  LEU  28          1HD1      LEU  28  -2.729   1.996  -1.150
  182   HD12  LEU  28          2HD1      LEU  28  -4.002   1.933   0.069
  183   HD13  LEU  28          3HD1      LEU  28  -2.568   2.923   0.342
  184   HD21  LEU  28          3HD2      LEU  28  -5.062   2.303  -2.187
  185   HD22  LEU  28          1HD2      LEU  28  -4.002   3.323  -3.160
  186   HD23  LEU  28          2HD2      LEU  28  -5.508   3.978  -2.516
  187    H    ASN  29           H        ASN  29  -4.949   7.113  -1.080
  188    HA   ASN  29           HA       ASN  29  -2.504   7.434  -2.383
  189    HB2  ASN  29           1HB      ASN  29  -4.813   8.080  -3.225
  190    HB3  ASN  29           2HB      ASN  29  -4.660   9.544  -2.257
  191   HD21  ASN  29          1HD2      ASN  29  -5.048  10.037  -4.764
  192   HD22  ASN  29          2HD2      ASN  29  -3.601  10.489  -5.594
  193    H    GLU  30           H        GLU  30  -4.091   9.725  -0.152
  194    HA   GLU  30           HA       GLU  30  -2.008  11.553   0.031
  195    HB2  GLU  30           1HB      GLU  30  -4.244  10.799   1.882
  196    HB3  GLU  30           2HB      GLU  30  -3.033  11.966   2.394
  197    HG2  GLU  30           1HG      GLU  30  -3.579  13.410   0.542
  198    HG3  GLU  30           2HG      GLU  30  -4.716  12.219  -0.087
  199    H    HIS  31           H        HIS  31  -2.158   8.367   1.191
  200    HA   HIS  31           HA       HIS  31  -0.193   8.777   3.296
  201    HB2  HIS  31           1HB      HIS  31  -1.642   7.135   4.004
  202    HB3  HIS  31           2HB      HIS  31  -1.886   6.499   2.380
  203    HD1  HIS  31           HD1      HIS  31   0.186   6.089   5.415
  204    HD2  HIS  31           HD2      HIS  31   0.136   4.690   1.503
  205    HE1  HIS  31           HE1      HIS  31   1.758   4.126   5.383
  206    H    ARG  32           H        ARG  32  -0.432   6.936   0.256
  207    HA   ARG  32           HA       ARG  32   1.988   5.777   0.046
  208    HB2  ARG  32           1HB      ARG  32   0.507   7.302  -2.099
  209    HB3  ARG  32           2HB      ARG  32   1.896   6.273  -2.424
  210    HG2  ARG  32           1HG      ARG  32   0.686   4.344  -1.560
  211    HG3  ARG  32           2HG      ARG  32  -0.703   5.371  -1.200
  212    HD2  ARG  32           1HD      ARG  32  -1.244   4.387  -3.246
  213    HD3  ARG  32           2HD      ARG  32  -0.648   5.987  -3.686
  214    HE   ARG  32           HE       ARG  32   1.559   4.410  -3.828
  215   HH11  ARG  32          1HH1      ARG  32  -1.626   4.259  -5.225
  216   HH12  ARG  32          2HH1      ARG  32  -1.100   3.441  -6.659
  217   HH21  ARG  32          1HH2      ARG  32   2.264   3.333  -5.711
  218   HH22  ARG  32          2HH2      ARG  32   1.113   2.914  -6.934
  219    H    ARG  33           H        ARG  33   1.374   9.186   0.061
  220    HA   ARG  33           HA       ARG  33   3.618  10.225  -1.164
  221    HB2  ARG  33           1HB      ARG  33   2.019  11.179   1.201
  222    HB3  ARG  33           2HB      ARG  33   3.371  12.107   0.565
  223    HG2  ARG  33           1HG      ARG  33   1.307  12.947  -0.342
  224    HG3  ARG  33           2HG      ARG  33   2.253  12.190  -1.626
  225    HD2  ARG  33           1HD      ARG  33   0.178  10.629  -0.135
  226    HD3  ARG  33           2HD      ARG  33  -0.286  11.697  -1.458
  227    HE   ARG  33           HE       ARG  33   0.957   9.145  -1.679
  228   HH11  ARG  33          1HH1      ARG  33   0.747  12.287  -3.164
  229   HH12  ARG  33          2HH1      ARG  33   1.157  11.711  -4.745
  230   HH21  ARG  33          1HH2      ARG  33   1.498   8.374  -3.757
  231   HH22  ARG  33          2HH2      ARG  33   1.583   9.485  -5.082
  232    H    ILE  34           H        ILE  34   3.260   9.132   2.193
  233    HA   ILE  34           HA       ILE  34   5.676   9.851   3.258
  234    HB   ILE  34           HB       ILE  34   5.471   8.067   4.828
  235   HG12  ILE  34          1HG1      ILE  34   3.401   6.769   3.054
  236   HG13  ILE  34          2HG1      ILE  34   5.099   6.308   3.031
  237   HG21  ILE  34          1HG2      ILE  34   3.232   8.371   5.618
  238   HG22  ILE  34          2HG2      ILE  34   3.766   9.882   4.882
  239   HG23  ILE  34          3HG2      ILE  34   2.671   8.813   4.006
  240   HD11  ILE  34          3HD1      ILE  34   4.245   4.758   4.470
  241   HD12  ILE  34          1HD1      ILE  34   4.731   6.016   5.605
  242   HD13  ILE  34          2HD1      ILE  34   3.040   5.866   5.126
  243    H    HIS  35           H        HIS  35   5.090   7.566   0.758
  244    HA   HIS  35           HA       HIS  35   7.751   6.382   1.027
  245    HB2  HIS  35           1HB      HIS  35   5.508   5.714  -0.891
  246    HB3  HIS  35           2HB      HIS  35   7.020   4.826  -0.731
  247    HD1  HIS  35           HD1      HIS  35   7.339   4.182   2.084
  248    HD2  HIS  35           HD2      HIS  35   3.562   4.343   0.362
  249    HE1  HIS  35           HE1      HIS  35   5.858   2.809   3.582
  250    H    THR  36           H        THR  36   5.994   8.690  -0.843
  251    HA   THR  36           HA       THR  36   8.319   8.993  -2.631
  252    HB   THR  36           HB       THR  36   6.522   8.278  -4.013
  253    HG1  THR  36           HG1      THR  36   6.711   9.882  -5.412
  254   HG21  THR  36          3HG2      THR  36   4.819  10.434  -2.759
  255   HG22  THR  36          1HG2      THR  36   4.700   8.711  -2.403
  256   HG23  THR  36          2HG2      THR  36   4.321   9.306  -4.020
  257    H    GLY  37           H        GLY  37   9.439  10.744  -2.083
  258    HA2  GLY  37           1HA      GLY  37   8.008  13.040  -0.927
  259    HA3  GLY  37           2HA      GLY  37   9.729  12.723  -0.766
  260    H    TYR  38           H        TYR  38   7.269  13.455  -3.229
  261    HA   TYR  38           HA       TYR  38   8.711  14.124  -5.390
  262    HB2  TYR  38           1HB      TYR  38   6.980  15.562  -6.065
  263    HB3  TYR  38           2HB      TYR  38   6.194  14.433  -4.968
  264    HD1  TYR  38           HD2      TYR  38   6.147  15.238  -2.436
  265    HD2  TYR  38           HD1      TYR  38   6.553  17.815  -5.798
  266    HE1  TYR  38           HE2      TYR  38   5.320  17.120  -1.086
  267    HE2  TYR  38           HE1      TYR  38   5.729  19.704  -4.456
  268    HH   TYR  38           HH       TYR  38   5.000  19.331  -1.010
  269    H    ARG  39           H        ARG  39  10.305  15.469  -5.919
  270    HA   ARG  39           HA       ARG  39  11.252  17.369  -3.930
  271    HB2  ARG  39           1HB      ARG  39  12.471  16.600  -6.588
  272    HB3  ARG  39           2HB      ARG  39  13.248  17.536  -5.318
  273    HG2  ARG  39           1HG      ARG  39  13.333  15.652  -3.870
  274    HG3  ARG  39           2HG      ARG  39  12.304  14.706  -4.947
  275    HD2  ARG  39           1HD      ARG  39  15.078  15.712  -5.572
  276    HD3  ARG  39           2HD      ARG  39  14.648  14.053  -5.156
  277    HE   ARG  39           HE       ARG  39  13.218  15.064  -7.430
  278   HH11  ARG  39          1HH1      ARG  39  16.167  13.557  -6.355
  279   HH12  ARG  39          2HH1      ARG  39  16.515  12.842  -7.893
  280   HH21  ARG  39          1HH2      ARG  39  13.666  14.127  -9.460
  281   HH22  ARG  39          2HH2      ARG  39  15.093  13.167  -9.659
  282    HA   PRO  40           HA       PRO  40   9.520  20.915  -5.879
  283    HB2  PRO  40           1HB      PRO  40  11.230  22.802  -4.938
  284    HB3  PRO  40           2HB      PRO  40   9.999  22.033  -3.929
  285    HG2  PRO  40           1HG      PRO  40  12.922  21.424  -4.144
  286    HG3  PRO  40           2HG      PRO  40  11.905  21.531  -2.696
  287    HD2  PRO  40           1HD      PRO  40  12.600  19.166  -3.817
  288    HD3  PRO  40           2HD      PRO  40  11.050  19.410  -2.986
  289    H    SER  41           H        SER  41  12.701  19.799  -6.500
  290    HA   SER  41           HA       SER  41  13.395  21.822  -8.423
  291    HB2  SER  41           1HB      SER  41  15.358  20.456  -8.867
  292    HB3  SER  41           2HB      SER  41  15.109  20.573  -7.125
  293    HG   SER  41           HG       SER  41  14.330  18.401  -8.781
  294    H    GLY  42           H        GLY  42  14.008  21.138 -10.696
  295    HA2  GLY  42           1HA      GLY  42  12.770  18.907 -11.918
  296    HA3  GLY  42           2HA      GLY  42  11.738  20.319 -12.093
  297    HA   PRO  43           HA       PRO  43  15.482  20.187 -15.132
  298    HB2  PRO  43           1HB      PRO  43  14.483  18.690 -17.164
  299    HB3  PRO  43           2HB      PRO  43  15.432  18.002 -15.841
  300    HG2  PRO  43           1HG      PRO  43  12.463  18.054 -16.215
  301    HG3  PRO  43           2HG      PRO  43  13.497  16.725 -15.659
  302    HD2  PRO  43           1HD      PRO  43  12.059  18.263 -13.956
  303    HD3  PRO  43           2HD      PRO  43  13.627  17.557 -13.513
  304    H    SER  44           H        SER  44  12.114  20.761 -15.175
  305    HA   SER  44           HA       SER  44  12.023  22.084 -17.727
  306    HB2  SER  44           1HB      SER  44  10.093  20.946 -16.308
  307    HB3  SER  44           2HB      SER  44   9.948  22.568 -15.631
  308    HG   SER  44           HG       SER  44   9.178  21.635 -18.061
  309    H    SER  45           H        SER  45  13.537  23.721 -17.710
  310    HA   SER  45           HA       SER  45  12.728  26.216 -16.685
  311    HB2  SER  45           1HB      SER  45  14.232  26.628 -14.919
  312    HB3  SER  45           2HB      SER  45  13.620  25.008 -14.591
  313    HG   SER  45           HG       SER  45  15.638  24.496 -16.022
  314    H    GLY  46           H        GLY  46  14.184  27.949 -17.272
  315    HA2  GLY  46           1HA      GLY  46  16.647  27.530 -18.585
  316    HA3  GLY  46           2HA      GLY  46  15.364  27.611 -19.784
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1   5.268 -26.107  -0.067
    2    HA2  GLY   1           1HA      GLY   1   4.461 -23.552  -0.006
    3    HA3  GLY   1           2HA      GLY   1   4.337 -23.909  -1.722
    4    H    SER   2           H        SER   2   2.622 -25.050  -2.474
    5    HA   SER   2           HA       SER   2   0.398 -25.640  -2.430
    6    HB2  SER   2           1HB      SER   2   0.041 -27.786  -1.228
    7    HB3  SER   2           2HB      SER   2   1.514 -27.790  -2.196
    8    HG   SER   2           HG       SER   2   1.252 -28.222   0.417
    9    H    SER   3           H        SER   3   0.772 -23.416  -0.820
   10    HA   SER   3           HA       SER   3  -1.148 -23.942   1.351
   11    HB2  SER   3           1HB      SER   3   1.215 -22.050   1.408
   12    HB3  SER   3           2HB      SER   3  -0.031 -22.134   2.653
   13    HG   SER   3           HG       SER   3   1.227 -24.515   1.948
   14    H    GLY   4           H        GLY   4   0.314 -21.190  -0.400
   15    HA2  GLY   4           1HA      GLY   4  -0.929 -19.765  -1.858
   16    HA3  GLY   4           2HA      GLY   4  -2.399 -20.250  -1.026
   17    H    SER   5           H        SER   5  -2.787 -17.904  -1.004
   18    HA   SER   5           HA       SER   5  -1.426 -16.638   1.282
   19    HB2  SER   5           1HB      SER   5  -1.029 -15.680  -1.116
   20    HB3  SER   5           2HB      SER   5  -2.651 -15.014  -0.927
   21    HG   SER   5           HG       SER   5  -1.900 -13.597   0.436
   22    H    SER   6           H        SER   6  -2.682 -15.758   2.839
   23    HA   SER   6           HA       SER   6  -5.503 -16.366   2.771
   24    HB2  SER   6           1HB      SER   6  -3.827 -16.516   4.790
   25    HB3  SER   6           2HB      SER   6  -4.219 -14.808   4.986
   26    HG   SER   6           HG       SER   6  -5.837 -15.621   6.081
   27    H    GLY   7           H        GLY   7  -7.066 -14.670   3.624
   28    HA2  GLY   7           1HA      GLY   7  -6.389 -11.968   2.693
   29    HA3  GLY   7           2HA      GLY   7  -7.787 -12.774   1.997
   30    H    SER   8           H        SER   8  -7.951 -10.329   3.341
   31    HA   SER   8           HA       SER   8  -9.000 -10.925   5.995
   32    HB2  SER   8           1HB      SER   8  -8.242  -8.443   4.523
   33    HB3  SER   8           2HB      SER   8  -9.448  -8.310   5.803
   34    HG   SER   8           HG       SER   8  -7.856  -9.471   7.134
   35    H    GLY   9           H        GLY   9 -10.130  -9.390   2.982
   36    HA2  GLY   9           1HA      GLY   9 -12.488 -10.583   2.576
   37    HA3  GLY   9           2HA      GLY   9 -12.884  -9.506   3.907
   38    H    GLU  10           H        GLU  10 -13.002  -7.295   3.559
   39    HA   GLU  10           HA       GLU  10 -13.224  -6.537   0.739
   40    HB2  GLU  10           1HB      GLU  10 -14.350  -4.469   1.778
   41    HB3  GLU  10           2HB      GLU  10 -15.214  -5.998   1.840
   42    HG2  GLU  10           1HG      GLU  10 -13.484  -5.253   4.137
   43    HG3  GLU  10           2HG      GLU  10 -15.033  -4.436   3.942
   44    H    LYS  11           H        LYS  11 -10.965  -6.307   0.377
   45    HA   LYS  11           HA       LYS  11  -9.876  -3.807   1.487
   46    HB2  LYS  11           1HB      LYS  11  -8.830  -5.995   2.364
   47    HB3  LYS  11           2HB      LYS  11  -8.130  -6.147   0.758
   48    HG2  LYS  11           1HG      LYS  11  -7.093  -3.903   1.074
   49    HG3  LYS  11           2HG      LYS  11  -7.673  -3.931   2.742
   50    HD2  LYS  11           1HD      LYS  11  -5.993  -6.155   1.623
   51    HD3  LYS  11           2HD      LYS  11  -5.263  -4.694   2.291
   52    HE2  LYS  11           1HE      LYS  11  -7.236  -6.405   3.792
   53    HE3  LYS  11           2HE      LYS  11  -5.489  -6.625   3.890
   54    HZ1  LYS  11           3HZ      LYS  11  -7.038  -4.228   4.702
   55    HZ2  LYS  11           1HZ      LYS  11  -5.349  -4.271   4.622
   56    HZ3  LYS  11           2HZ      LYS  11  -6.170  -5.276   5.707
   57    HA   PRO  12           HA       PRO  12 -10.003  -3.691  -3.161
   58    HB2  PRO  12           1HB      PRO  12 -11.094  -1.209  -3.307
   59    HB3  PRO  12           2HB      PRO  12 -12.066  -2.679  -3.166
   60    HG2  PRO  12           1HG      PRO  12 -11.259  -0.730  -1.042
   61    HG3  PRO  12           2HG      PRO  12 -12.830  -1.507  -1.309
   62    HD2  PRO  12           1HD      PRO  12 -11.079  -2.370   0.567
   63    HD3  PRO  12           2HD      PRO  12 -12.173  -3.470  -0.296
   64    H    TYR  13           H        TYR  13  -9.032  -1.313  -0.739
   65    HA   TYR  13           HA       TYR  13  -6.930  -0.369  -2.573
   66    HB2  TYR  13           1HB      TYR  13  -7.825   1.113  -0.114
   67    HB3  TYR  13           2HB      TYR  13  -6.980   1.736  -1.526
   68    HD1  TYR  13           HD1      TYR  13  -8.229   1.991  -3.684
   69    HD2  TYR  13           HD2      TYR  13 -10.192   1.057  -0.027
   70    HE1  TYR  13           HE1      TYR  13 -10.374   2.689  -4.664
   71    HE2  TYR  13           HE2      TYR  13 -12.343   1.751  -0.997
   72    HH   TYR  13           HH       TYR  13 -12.849   2.160  -4.244
   73    H    LYS  14           H        LYS  14  -4.996  -1.177  -2.151
   74    HA   LYS  14           HA       LYS  14  -4.114  -1.392   0.632
   75    HB2  LYS  14           1HB      LYS  14  -4.944  -3.630  -0.162
   76    HB3  LYS  14           2HB      LYS  14  -3.675  -3.603  -1.379
   77    HG2  LYS  14           1HG      LYS  14  -2.092  -3.253   0.646
   78    HG3  LYS  14           2HG      LYS  14  -3.447  -3.884   1.584
   79    HD2  LYS  14           1HD      LYS  14  -3.455  -5.919   0.293
   80    HD3  LYS  14           2HD      LYS  14  -2.218  -5.279  -0.792
   81    HE2  LYS  14           1HE      LYS  14  -1.137  -6.756   0.731
   82    HE3  LYS  14           2HE      LYS  14  -0.695  -5.111   1.187
   83    HZ1  LYS  14           3HZ      LYS  14  -3.041  -5.922   2.550
   84    HZ2  LYS  14           1HZ      LYS  14  -1.557  -5.420   3.189
   85    HZ3  LYS  14           2HZ      LYS  14  -1.806  -7.049   2.808
   86    H    CYS  15           H        CYS  15  -2.060  -0.747   0.948
   87    HA   CYS  15           HA       CYS  15  -0.645   0.449  -1.237
   88    HB2  CYS  15           1HB      CYS  15  -0.622   1.468   0.991
   89    HB3  CYS  15           2HB      CYS  15   0.174   0.042   1.647
   90    H    SER  16           H        SER  16   0.616  -0.611  -2.601
   91    HA   SER  16           HA       SER  16   1.709  -3.208  -1.852
   92    HB2  SER  16           1HB      SER  16   0.538  -2.900  -4.038
   93    HB3  SER  16           2HB      SER  16   1.827  -1.801  -4.530
   94    HG   SER  16           HG       SER  16   1.783  -4.490  -4.575
   95    H    GLU  17           H        GLU  17   2.861  -1.040  -0.508
   96    HA   GLU  17           HA       GLU  17   5.588  -1.118  -1.609
   97    HB2  GLU  17           1HB      GLU  17   4.288   1.265  -0.277
   98    HB3  GLU  17           2HB      GLU  17   5.955   1.179  -0.829
   99    HG2  GLU  17           1HG      GLU  17   5.380   1.326  -3.043
  100    HG3  GLU  17           2HG      GLU  17   3.763   0.676  -2.777
  101    H    CYS  18           H        CYS  18   3.525  -0.805   1.231
  102    HA   CYS  18           HA       CYS  18   5.755  -1.816   2.869
  103    HB2  CYS  18           1HB      CYS  18   4.973  -0.488   4.743
  104    HB3  CYS  18           2HB      CYS  18   5.269   0.565   3.364
  105    H    GLY  19           H        GLY  19   2.229  -1.589   2.537
  106    HA2  GLY  19           1HA      GLY  19   1.090  -3.812   2.580
  107    HA3  GLY  19           2HA      GLY  19   2.030  -4.133   4.030
  108    H    LYS  20           H        LYS  20   0.434  -1.100   3.192
  109    HA   LYS  20           HA       LYS  20  -1.352  -1.499   5.503
  110    HB2  LYS  20           1HB      LYS  20   0.234   0.869   4.614
  111    HB3  LYS  20           2HB      LYS  20  -1.314   1.147   5.401
  112    HG2  LYS  20           1HG      LYS  20  -0.604   0.185   7.404
  113    HG3  LYS  20           2HG      LYS  20   0.765  -0.622   6.636
  114    HD2  LYS  20           1HD      LYS  20   1.783   1.591   6.212
  115    HD3  LYS  20           2HD      LYS  20   0.442   2.347   7.074
  116    HE2  LYS  20           1HE      LYS  20   1.970   0.187   8.437
  117    HE3  LYS  20           2HE      LYS  20   2.721   1.775   8.282
  118    HZ1  LYS  20           3HZ      LYS  20  -0.009   1.450   9.369
  119    HZ2  LYS  20           1HZ      LYS  20   1.038   2.769   9.530
  120    HZ3  LYS  20           2HZ      LYS  20   1.358   1.330  10.357
  121    H    ALA  21           H        ALA  21  -3.455  -1.493   5.068
  122    HA   ALA  21           HA       ALA  21  -4.339  -0.512   2.445
  123    HB1  ALA  21           3HB      ALA  21  -6.044  -2.061   2.482
  124    HB2  ALA  21           1HB      ALA  21  -4.766  -2.920   3.344
  125    HB3  ALA  21           2HB      ALA  21  -6.072  -2.147   4.244
  126    H    PHE  22           H        PHE  22  -6.441   0.572   2.329
  127    HA   PHE  22           HA       PHE  22  -7.252   1.946   4.784
  128    HB2  PHE  22           1HB      PHE  22  -6.751   3.428   2.198
  129    HB3  PHE  22           2HB      PHE  22  -7.200   4.121   3.753
  130    HD1  PHE  22           HD1      PHE  22  -4.498   2.321   1.975
  131    HD2  PHE  22           HD2      PHE  22  -5.570   4.730   5.316
  132    HE1  PHE  22           HE1      PHE  22  -2.118   2.605   2.530
  133    HE2  PHE  22           HE2      PHE  22  -3.192   5.019   5.876
  134    HZ   PHE  22           HZ       PHE  22  -1.462   3.957   4.481
  135    H    HIS  23           H        HIS  23  -9.397   2.092   4.990
  136    HA   HIS  23           HA       HIS  23 -11.159   0.778   3.287
  137    HB2  HIS  23           1HB      HIS  23 -12.926   1.661   4.625
  138    HB3  HIS  23           2HB      HIS  23 -11.556   1.404   5.702
  139    HD1  HIS  23           HD1      HIS  23  -9.969   3.894   5.517
  140    HD2  HIS  23           HD2      HIS  23 -14.122   3.938   5.430
  141    HE1  HIS  23           HE1      HIS  23 -10.632   6.213   6.228
  142    H    ARG  24           H        ARG  24 -10.123   4.127   3.333
  143    HA   ARG  24           HA       ARG  24 -11.814   4.643   0.977
  144    HB2  ARG  24           1HB      ARG  24 -10.995   6.338   3.280
  145    HB3  ARG  24           2HB      ARG  24 -11.137   7.121   1.712
  146    HG2  ARG  24           1HG      ARG  24 -13.458   6.033   1.602
  147    HG3  ARG  24           2HG      ARG  24 -13.258   5.773   3.336
  148    HD2  ARG  24           1HD      ARG  24 -13.405   8.357   1.821
  149    HD3  ARG  24           2HD      ARG  24 -14.392   7.814   3.177
  150    HE   ARG  24           HE       ARG  24 -11.651   8.060   3.903
  151   HH11  ARG  24          1HH1      ARG  24 -14.560   9.885   3.335
  152   HH12  ARG  24          2HH1      ARG  24 -14.103  11.187   4.382
  153   HH21  ARG  24          1HH2      ARG  24 -11.038   9.768   5.284
  154   HH22  ARG  24          2HH2      ARG  24 -12.099  11.120   5.490
  155    H    HIS  25           H        HIS  25 -10.909   5.927  -0.730
  156    HA   HIS  25           HA       HIS  25  -8.189   5.225  -1.300
  157    HB2  HIS  25           1HB      HIS  25  -9.742   5.211  -3.125
  158    HB3  HIS  25           2HB      HIS  25 -10.229   6.872  -2.799
  159    HD1  HIS  25           HD1      HIS  25  -9.580   7.639  -5.171
  160    HD2  HIS  25           HD2      HIS  25  -6.426   6.037  -2.992
  161    HE1  HIS  25           HE1      HIS  25  -7.503   8.233  -6.458
  162    H    THR  26           H        THR  26  -9.917   8.275  -0.728
  163    HA   THR  26           HA       THR  26  -7.966  10.127  -1.128
  164    HB   THR  26           HB       THR  26 -10.222  10.745  -0.422
  165    HG1  THR  26           HG1      THR  26  -8.470  11.763   1.557
  166   HG21  THR  26          3HG2      THR  26  -9.714   8.961   1.706
  167   HG22  THR  26          1HG2      THR  26 -11.187   9.875   1.387
  168   HG23  THR  26          2HG2      THR  26  -9.931  10.558   2.420
  169    H    HIS  27           H        HIS  27  -8.188   7.841   1.508
  170    HA   HIS  27           HA       HIS  27  -6.128   9.075   3.085
  171    HB2  HIS  27           1HB      HIS  27  -7.719   6.551   3.245
  172    HB3  HIS  27           2HB      HIS  27  -6.231   6.669   4.179
  173    HD1  HIS  27           HD1      HIS  27  -7.985   6.474   6.232
  174    HD2  HIS  27           HD2      HIS  27  -8.037  10.020   4.067
  175    HE1  HIS  27           HE1      HIS  27  -9.180   8.137   7.693
  176    H    LEU  28           H        LEU  28  -6.326   6.187   1.020
  177    HA   LEU  28           HA       LEU  28  -3.676   5.341   1.340
  178    HB2  LEU  28           1HB      LEU  28  -5.204   3.827   0.384
  179    HB3  LEU  28           2HB      LEU  28  -5.682   4.976  -0.864
  180    HG   LEU  28           HG       LEU  28  -3.215   4.717  -1.663
  181   HD11  LEU  28          1HD1      LEU  28  -3.233   2.937   0.517
  182   HD12  LEU  28          2HD1      LEU  28  -1.949   3.198  -0.664
  183   HD13  LEU  28          3HD1      LEU  28  -3.166   1.953  -0.945
  184   HD21  LEU  28          3HD2      LEU  28  -4.131   2.351  -2.652
  185   HD22  LEU  28          1HD2      LEU  28  -4.563   3.942  -3.278
  186   HD23  LEU  28          2HD2      LEU  28  -5.630   3.126  -2.135
  187    H    ASN  29           H        ASN  29  -5.121   7.308  -1.258
  188    HA   ASN  29           HA       ASN  29  -2.855   7.773  -2.763
  189    HB2  ASN  29           1HB      ASN  29  -5.161   8.452  -3.399
  190    HB3  ASN  29           2HB      ASN  29  -5.069   9.765  -2.230
  191   HD21  ASN  29          1HD2      ASN  29  -5.568  10.969  -4.253
  192   HD22  ASN  29          2HD2      ASN  29  -4.232  11.510  -5.206
  193    H    GLU  30           H        GLU  30  -3.962   9.443   0.144
  194    HA   GLU  30           HA       GLU  30  -1.844  11.385   0.069
  195    HB2  GLU  30           1HB      GLU  30  -3.831  12.115   1.116
  196    HB3  GLU  30           2HB      GLU  30  -3.944  10.662   2.100
  197    HG2  GLU  30           1HG      GLU  30  -2.432  11.406   3.630
  198    HG3  GLU  30           2HG      GLU  30  -1.568  12.400   2.458
  199    H    HIS  31           H        HIS  31  -2.267   8.201   1.323
  200    HA   HIS  31           HA       HIS  31  -0.260   8.300   3.339
  201    HB2  HIS  31           1HB      HIS  31  -1.757   6.541   3.629
  202    HB3  HIS  31           2HB      HIS  31  -1.729   6.102   1.924
  203    HD1  HIS  31           HD1      HIS  31   0.515   5.932   4.978
  204    HD2  HIS  31           HD2      HIS  31  -0.051   4.047   1.320
  205    HE1  HIS  31           HE1      HIS  31   2.078   3.963   4.989
  206    H    ARG  32           H        ARG  32  -0.264   6.798   0.100
  207    HA   ARG  32           HA       ARG  32   2.251   5.879  -0.127
  208    HB2  ARG  32           1HB      ARG  32   0.704   7.466  -2.178
  209    HB3  ARG  32           2HB      ARG  32   2.188   6.597  -2.544
  210    HG2  ARG  32           1HG      ARG  32   1.199   4.534  -2.320
  211    HG3  ARG  32           2HG      ARG  32  -0.080   5.144  -1.268
  212    HD2  ARG  32           1HD      ARG  32  -1.343   5.910  -3.018
  213    HD3  ARG  32           2HD      ARG  32   0.058   6.161  -4.058
  214    HE   ARG  32           HE       ARG  32  -0.084   3.454  -3.747
  215   HH11  ARG  32          1HH1      ARG  32  -2.279   5.924  -4.843
  216   HH12  ARG  32          2HH1      ARG  32  -3.123   4.873  -5.932
  217   HH21  ARG  32          1HH2      ARG  32  -1.188   2.061  -5.176
  218   HH22  ARG  32          2HH2      ARG  32  -2.502   2.676  -6.120
  219    H    ARG  33           H        ARG  33   1.337   9.219   0.122
  220    HA   ARG  33           HA       ARG  33   3.480  10.575  -0.910
  221    HB2  ARG  33           1HB      ARG  33   1.826  11.096   1.551
  222    HB3  ARG  33           2HB      ARG  33   3.088  12.207   1.037
  223    HG2  ARG  33           1HG      ARG  33   0.712  12.723   0.307
  224    HG3  ARG  33           2HG      ARG  33   1.963  12.756  -0.938
  225    HD2  ARG  33           1HD      ARG  33   1.335  10.451  -1.575
  226    HD3  ARG  33           2HD      ARG  33   0.035  10.504  -0.386
  227    HE   ARG  33           HE       ARG  33  -1.190  11.819  -1.818
  228   HH11  ARG  33          1HH1      ARG  33   2.097  11.605  -2.945
  229   HH12  ARG  33          2HH1      ARG  33   1.759  12.350  -4.472
  230   HH21  ARG  33          1HH2      ARG  33  -1.647  12.802  -3.825
  231   HH22  ARG  33          2HH2      ARG  33  -0.370  13.032  -4.971
  232    H    ILE  34           H        ILE  34   3.248   9.112   2.320
  233    HA   ILE  34           HA       ILE  34   5.751   9.901   3.276
  234    HB   ILE  34           HB       ILE  34   5.564   8.144   4.914
  235   HG12  ILE  34          1HG1      ILE  34   3.115   7.007   3.643
  236   HG13  ILE  34          2HG1      ILE  34   4.682   6.525   3.002
  237   HG21  ILE  34          1HG2      ILE  34   2.700   8.771   4.663
  238   HG22  ILE  34          2HG2      ILE  34   3.815   9.060   5.998
  239   HG23  ILE  34          3HG2      ILE  34   3.791  10.156   4.617
  240   HD11  ILE  34          3HD1      ILE  34   5.303   5.917   5.379
  241   HD12  ILE  34          1HD1      ILE  34   3.591   6.101   5.761
  242   HD13  ILE  34          2HD1      ILE  34   4.107   4.895   4.582
  243    H    HIS  35           H        HIS  35   4.886   7.498   0.960
  244    HA   HIS  35           HA       HIS  35   7.432   6.111   1.153
  245    HB2  HIS  35           1HB      HIS  35   5.012   5.741  -0.612
  246    HB3  HIS  35           2HB      HIS  35   6.494   4.812  -0.822
  247    HD1  HIS  35           HD1      HIS  35   7.093   4.285   2.190
  248    HD2  HIS  35           HD2      HIS  35   3.396   3.764   0.368
  249    HE1  HIS  35           HE1      HIS  35   5.862   2.631   3.629
  250    H    THR  36           H        THR  36   6.095   8.762  -0.510
  251    HA   THR  36           HA       THR  36   8.322   8.719  -2.443
  252    HB   THR  36           HB       THR  36   6.252   8.555  -3.659
  253    HG1  THR  36           HG1      THR  36   7.035   9.973  -5.010
  254   HG21  THR  36          3HG2      THR  36   4.842  10.882  -3.288
  255   HG22  THR  36          1HG2      THR  36   5.335  10.468  -1.647
  256   HG23  THR  36          2HG2      THR  36   4.417   9.311  -2.610
  257    H    GLY  37           H        GLY  37   9.277   9.683  -0.307
  258    HA2  GLY  37           1HA      GLY  37   8.869  12.610  -0.369
  259    HA3  GLY  37           2HA      GLY  37   9.340  11.719   1.071
  260    H    TYR  38           H        TYR  38  11.276  10.036  -0.177
  261    HA   TYR  38           HA       TYR  38  13.397  12.026  -0.589
  262    HB2  TYR  38           1HB      TYR  38  14.140  10.757   1.176
  263    HB3  TYR  38           2HB      TYR  38  13.310   9.306   0.625
  264    HD1  TYR  38           HD2      TYR  38  14.327   7.871  -1.093
  265    HD2  TYR  38           HD1      TYR  38  16.377  11.264   0.452
  266    HE1  TYR  38           HE2      TYR  38  16.438   7.011  -2.018
  267    HE2  TYR  38           HE1      TYR  38  18.493  10.414  -0.470
  268    HH   TYR  38           HH       TYR  38  19.369   8.916  -1.990
  269    H    ARG  39           H        ARG  39  14.451  12.165  -2.468
  270    HA   ARG  39           HA       ARG  39  13.899  10.110  -4.504
  271    HB2  ARG  39           1HB      ARG  39  14.440  13.066  -4.759
  272    HB3  ARG  39           2HB      ARG  39  14.512  11.969  -6.132
  273    HG2  ARG  39           1HG      ARG  39  12.068  12.091  -4.414
  274    HG3  ARG  39           2HG      ARG  39  12.342  13.285  -5.683
  275    HD2  ARG  39           1HD      ARG  39  12.791  11.157  -7.150
  276    HD3  ARG  39           2HD      ARG  39  11.837  10.354  -5.904
  277    HE   ARG  39           HE       ARG  39  10.406  12.593  -6.673
  278   HH11  ARG  39          1HH1      ARG  39  11.585   9.668  -8.148
  279   HH12  ARG  39          2HH1      ARG  39  10.300   9.579  -9.307
  280   HH21  ARG  39          1HH2      ARG  39   8.709  12.487  -8.195
  281   HH22  ARG  39          2HH2      ARG  39   8.665  11.184  -9.333
  282    HA   PRO  40           HA       PRO  40  18.168   9.089  -4.689
  283    HB2  PRO  40           1HB      PRO  40  18.373   8.316  -7.283
  284    HB3  PRO  40           2HB      PRO  40  17.555   7.345  -6.053
  285    HG2  PRO  40           1HG      PRO  40  16.384   9.188  -8.101
  286    HG3  PRO  40           2HG      PRO  40  15.832   7.580  -7.598
  287    HD2  PRO  40           1HD      PRO  40  14.682   9.861  -6.701
  288    HD3  PRO  40           2HD      PRO  40  14.786   8.391  -5.711
  289    H    SER  41           H        SER  41  20.007   9.328  -6.584
  290    HA   SER  41           HA       SER  41  20.031  12.181  -7.323
  291    HB2  SER  41           1HB      SER  41  21.511  11.544  -5.343
  292    HB3  SER  41           2HB      SER  41  22.487  10.633  -6.494
  293    HG   SER  41           HG       SER  41  23.384  12.442  -7.030
  294    H    GLY  42           H        GLY  42  19.151  10.192  -9.059
  295    HA2  GLY  42           1HA      GLY  42  19.810  10.471 -11.464
  296    HA3  GLY  42           2HA      GLY  42  21.412   9.966 -10.948
  297    HA   PRO  43           HA       PRO  43  20.338   5.828 -11.934
  298    HB2  PRO  43           1HB      PRO  43  22.041   4.493 -10.294
  299    HB3  PRO  43           2HB      PRO  43  22.577   5.347 -11.746
  300    HG2  PRO  43           1HG      PRO  43  22.661   6.233  -8.888
  301    HG3  PRO  43           2HG      PRO  43  23.899   6.397 -10.147
  302    HD2  PRO  43           1HD      PRO  43  22.269   8.437  -9.432
  303    HD3  PRO  43           2HD      PRO  43  22.878   8.237 -11.088
  304    H    SER  44           H        SER  44  18.570   4.755 -11.342
  305    HA   SER  44           HA       SER  44  17.117   5.031  -9.058
  306    HB2  SER  44           1HB      SER  44  17.349   2.811 -11.047
  307    HB3  SER  44           2HB      SER  44  16.391   2.542  -9.591
  308    HG   SER  44           HG       SER  44  16.012   4.861 -11.142
  309    H    SER  45           H        SER  45  19.314   2.284  -9.664
  310    HA   SER  45           HA       SER  45  19.166   1.167  -7.117
  311    HB2  SER  45           1HB      SER  45  21.309   0.051  -7.682
  312    HB3  SER  45           2HB      SER  45  20.139  -0.041  -8.998
  313    HG   SER  45           HG       SER  45  21.314   2.016  -9.688
  314    H    GLY  46           H        GLY  46  19.762   1.934  -5.207
  315    HA2  GLY  46           1HA      GLY  46  21.997   2.671  -4.116
  316    HA3  GLY  46           2HA      GLY  46  21.751   4.097  -5.114
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1  -4.631 -15.803  -0.541
    2    HA2  GLY   1           1HA      GLY   1  -4.687 -16.044   2.372
    3    HA3  GLY   1           2HA      GLY   1  -5.744 -15.038   1.392
    4    H    SER   2           H        SER   2  -5.055 -18.386   2.303
    5    HA   SER   2           HA       SER   2  -7.602 -19.308   1.290
    6    HB2  SER   2           1HB      SER   2  -6.902 -21.504   2.100
    7    HB3  SER   2           2HB      SER   2  -5.590 -20.749   1.195
    8    HG   SER   2           HG       SER   2  -4.704 -21.546   3.055
    9    H    SER   3           H        SER   3  -8.148 -17.333   3.034
   10    HA   SER   3           HA       SER   3  -9.026 -18.714   5.484
   11    HB2  SER   3           1HB      SER   3  -8.329 -15.823   4.973
   12    HB3  SER   3           2HB      SER   3  -9.242 -16.330   6.394
   13    HG   SER   3           HG       SER   3  -6.823 -16.186   6.518
   14    H    GLY   4           H        GLY   4  -9.994 -16.277   3.082
   15    HA2  GLY   4           1HA      GLY   4 -12.069 -15.928   2.122
   16    HA3  GLY   4           2HA      GLY   4 -12.679 -17.300   3.035
   17    H    SER   5           H        SER   5 -11.287 -14.147   3.947
   18    HA   SER   5           HA       SER   5 -13.765 -13.583   5.428
   19    HB2  SER   5           1HB      SER   5 -12.006 -14.357   6.998
   20    HB3  SER   5           2HB      SER   5 -10.965 -13.044   6.448
   21    HG   SER   5           HG       SER   5 -13.320 -12.934   7.975
   22    H    SER   6           H        SER   6 -13.369 -12.613   2.918
   23    HA   SER   6           HA       SER   6 -12.041 -10.384   2.308
   24    HB2  SER   6           1HB      SER   6 -13.724 -11.285   0.810
   25    HB3  SER   6           2HB      SER   6 -15.014 -10.794   1.907
   26    HG   SER   6           HG       SER   6 -13.436  -8.695   1.292
   27    H    GLY   7           H        GLY   7 -11.423  -8.964   3.865
   28    HA2  GLY   7           1HA      GLY   7 -13.382  -7.027   4.720
   29    HA3  GLY   7           2HA      GLY   7 -12.738  -8.000   6.035
   30    H    SER   8           H        SER   8 -10.985  -7.255   7.023
   31    HA   SER   8           HA       SER   8  -9.784  -4.821   6.338
   32    HB2  SER   8           1HB      SER   8  -9.056  -7.036   8.230
   33    HB3  SER   8           2HB      SER   8  -7.942  -5.694   7.972
   34    HG   SER   8           HG       SER   8 -10.425  -5.738   9.222
   35    H    GLY   9           H        GLY   9  -8.120  -4.273   5.061
   36    HA2  GLY   9           1HA      GLY   9  -6.151  -4.522   3.841
   37    HA3  GLY   9           2HA      GLY   9  -6.142  -6.231   4.252
   38    H    GLU  10           H        GLU  10  -8.587  -7.057   3.309
   39    HA   GLU  10           HA       GLU  10  -8.142  -7.691   0.696
   40    HB2  GLU  10           1HB      GLU  10  -9.989  -8.498   2.318
   41    HB3  GLU  10           2HB      GLU  10 -10.943  -7.178   1.657
   42    HG2  GLU  10           1HG      GLU  10 -11.515  -9.158   0.478
   43    HG3  GLU  10           2HG      GLU  10 -10.580  -8.134  -0.610
   44    H    LYS  11           H        LYS  11  -9.575  -4.754   1.953
   45    HA   LYS  11           HA       LYS  11 -10.848  -3.607  -0.126
   46    HB2  LYS  11           1HB      LYS  11  -8.977  -2.473   1.912
   47    HB3  LYS  11           2HB      LYS  11  -9.570  -1.427   0.629
   48    HG2  LYS  11           1HG      LYS  11 -11.109  -1.053   2.290
   49    HG3  LYS  11           2HG      LYS  11 -11.905  -2.315   1.348
   50    HD2  LYS  11           1HD      LYS  11 -11.442  -3.959   2.933
   51    HD3  LYS  11           2HD      LYS  11 -10.146  -3.015   3.672
   52    HE2  LYS  11           1HE      LYS  11 -13.012  -2.116   3.731
   53    HE3  LYS  11           2HE      LYS  11 -12.348  -3.200   4.952
   54    HZ1  LYS  11           3HZ      LYS  11 -11.091  -0.599   4.315
   55    HZ2  LYS  11           1HZ      LYS  11 -10.858  -1.569   5.682
   56    HZ3  LYS  11           2HZ      LYS  11 -12.318  -0.741   5.471
   57    HA   PRO  12           HA       PRO  12  -8.093  -3.396  -3.556
   58    HB2  PRO  12           1HB      PRO  12  -9.299  -1.400  -4.945
   59    HB3  PRO  12           2HB      PRO  12  -9.963  -3.035  -4.841
   60    HG2  PRO  12           1HG      PRO  12 -10.713  -0.585  -3.294
   61    HG3  PRO  12           2HG      PRO  12 -11.764  -1.814  -4.021
   62    HD2  PRO  12           1HD      PRO  12 -11.169  -1.784  -1.380
   63    HD3  PRO  12           2HD      PRO  12 -11.458  -3.289  -2.277
   64    H    TYR  13           H        TYR  13  -8.301  -1.079  -1.176
   65    HA   TYR  13           HA       TYR  13  -6.382   0.720  -2.484
   66    HB2  TYR  13           1HB      TYR  13  -7.754   1.218   0.152
   67    HB3  TYR  13           2HB      TYR  13  -6.989   2.389  -0.916
   68    HD1  TYR  13           HD2      TYR  13  -9.901   0.113  -0.603
   69    HD2  TYR  13           HD1      TYR  13  -8.227   3.477  -2.598
   70    HE1  TYR  13           HE2      TYR  13 -12.077   0.564  -1.656
   71    HE2  TYR  13           HE1      TYR  13 -10.399   3.939  -3.655
   72    HH   TYR  13           HH       TYR  13 -12.607   2.141  -4.184
   73    H    LYS  14           H        LYS  14  -5.533  -1.842  -1.614
   74    HA   LYS  14           HA       LYS  14  -4.171  -1.517   0.914
   75    HB2  LYS  14           1HB      LYS  14  -5.099  -3.708  -0.006
   76    HB3  LYS  14           2HB      LYS  14  -3.726  -3.712  -1.105
   77    HG2  LYS  14           1HG      LYS  14  -2.368  -3.397   1.130
   78    HG3  LYS  14           2HG      LYS  14  -3.809  -4.135   1.834
   79    HD2  LYS  14           1HD      LYS  14  -3.559  -5.955   0.086
   80    HD3  LYS  14           2HD      LYS  14  -1.966  -5.275  -0.257
   81    HE2  LYS  14           1HE      LYS  14  -1.347  -5.602   2.104
   82    HE3  LYS  14           2HE      LYS  14  -2.924  -6.330   2.403
   83    HZ1  LYS  14           3HZ      LYS  14  -2.294  -7.972   0.607
   84    HZ2  LYS  14           1HZ      LYS  14  -1.460  -8.108   2.072
   85    HZ3  LYS  14           2HZ      LYS  14  -0.715  -7.381   0.739
   86    H    CYS  15           H        CYS  15  -2.218  -0.668   1.191
   87    HA   CYS  15           HA       CYS  15  -0.722   0.352  -1.007
   88    HB2  CYS  15           1HB      CYS  15  -0.568   1.624   0.962
   89    HB3  CYS  15           2HB      CYS  15  -0.253   0.208   1.960
   90    H    SER  16           H        SER  16   0.341  -0.964  -2.339
   91    HA   SER  16           HA       SER  16   1.544  -3.418  -1.348
   92    HB2  SER  16           1HB      SER  16   1.001  -2.272  -4.064
   93    HB3  SER  16           2HB      SER  16   2.193  -3.559  -3.889
   94    HG   SER  16           HG       SER  16  -0.263  -3.925  -2.633
   95    H    GLU  17           H        GLU  17   2.718  -1.090  -0.319
   96    HA   GLU  17           HA       GLU  17   5.367  -1.175  -1.608
   97    HB2  GLU  17           1HB      GLU  17   4.133   1.169  -0.151
   98    HB3  GLU  17           2HB      GLU  17   5.732   1.132  -0.879
   99    HG2  GLU  17           1HG      GLU  17   4.418   2.276  -2.419
  100    HG3  GLU  17           2HG      GLU  17   4.538   0.644  -3.075
  101    H    CYS  18           H        CYS  18   3.550  -0.977   1.396
  102    HA   CYS  18           HA       CYS  18   5.921  -1.979   2.816
  103    HB2  CYS  18           1HB      CYS  18   5.426  -0.581   4.733
  104    HB3  CYS  18           2HB      CYS  18   5.604   0.434   3.305
  105    H    GLY  19           H        GLY  19   2.403  -1.674   2.725
  106    HA2  GLY  19           1HA      GLY  19   1.263  -3.895   2.991
  107    HA3  GLY  19           2HA      GLY  19   2.234  -4.071   4.445
  108    H    LYS  20           H        LYS  20   0.258  -1.428   3.095
  109    HA   LYS  20           HA       LYS  20  -1.171  -1.334   5.671
  110    HB2  LYS  20           1HB      LYS  20   0.415   0.628   4.861
  111    HB3  LYS  20           2HB      LYS  20  -1.001   1.076   3.919
  112    HG2  LYS  20           1HG      LYS  20  -2.252   1.580   5.781
  113    HG3  LYS  20           2HG      LYS  20  -1.297   0.535   6.835
  114    HD2  LYS  20           1HD      LYS  20   0.583   2.105   6.672
  115    HD3  LYS  20           2HD      LYS  20  -0.389   3.153   5.636
  116    HE2  LYS  20           1HE      LYS  20  -0.564   4.094   7.777
  117    HE3  LYS  20           2HE      LYS  20  -2.070   3.205   7.552
  118    HZ1  LYS  20           3HZ      LYS  20  -0.854   1.318   8.738
  119    HZ2  LYS  20           1HZ      LYS  20  -1.380   2.625   9.675
  120    HZ3  LYS  20           2HZ      LYS  20   0.249   2.500   9.236
  121    H    ALA  21           H        ALA  21  -3.371  -0.312   5.490
  122    HA   ALA  21           HA       ALA  21  -4.654  -0.678   2.894
  123    HB1  ALA  21           3HB      ALA  21  -5.349  -2.728   3.464
  124    HB2  ALA  21           1HB      ALA  21  -4.970  -2.486   5.170
  125    HB3  ALA  21           2HB      ALA  21  -6.493  -1.887   4.511
  126    H    PHE  22           H        PHE  22  -6.624   0.423   2.667
  127    HA   PHE  22           HA       PHE  22  -7.559   2.025   4.921
  128    HB2  PHE  22           1HB      PHE  22  -7.058   3.368   2.275
  129    HB3  PHE  22           2HB      PHE  22  -7.350   4.109   3.845
  130    HD1  PHE  22           HD1      PHE  22  -4.875   2.464   1.708
  131    HD2  PHE  22           HD2      PHE  22  -5.576   4.379   5.444
  132    HE1  PHE  22           HE1      PHE  22  -2.447   2.660   2.059
  133    HE2  PHE  22           HE2      PHE  22  -3.150   4.579   5.801
  134    HZ   PHE  22           HZ       PHE  22  -1.582   3.720   4.107
  135    H    HIS  23           H        HIS  23  -9.707   2.687   4.763
  136    HA   HIS  23           HA       HIS  23 -11.329   1.083   3.004
  137    HB2  HIS  23           1HB      HIS  23 -13.228   2.060   4.228
  138    HB3  HIS  23           2HB      HIS  23 -12.012   1.418   5.328
  139    HD1  HIS  23           HD1      HIS  23 -10.327   3.335   6.325
  140    HD2  HIS  23           HD2      HIS  23 -13.958   4.616   4.763
  141    HE1  HIS  23           HE1      HIS  23 -10.686   5.641   7.262
  142    H    ARG  24           H        ARG  24 -10.413   4.458   3.298
  143    HA   ARG  24           HA       ARG  24 -12.093   5.129   0.986
  144    HB2  ARG  24           1HB      ARG  24 -10.896   6.714   3.218
  145    HB3  ARG  24           2HB      ARG  24 -11.207   7.518   1.685
  146    HG2  ARG  24           1HG      ARG  24 -13.577   6.381   1.989
  147    HG3  ARG  24           2HG      ARG  24 -13.108   6.448   3.689
  148    HD2  ARG  24           1HD      ARG  24 -13.241   8.765   1.763
  149    HD3  ARG  24           2HD      ARG  24 -14.353   8.437   3.092
  150    HE   ARG  24           HE       ARG  24 -11.940   8.609   4.313
  151   HH11  ARG  24          1HH1      ARG  24 -13.690  10.682   2.132
  152   HH12  ARG  24          2HH1      ARG  24 -13.011  12.143   2.768
  153   HH21  ARG  24          1HH2      ARG  24 -11.038  10.526   5.159
  154   HH22  ARG  24          2HH2      ARG  24 -11.502  12.053   4.489
  155    H    HIS  25           H        HIS  25 -11.228   6.156  -0.836
  156    HA   HIS  25           HA       HIS  25  -8.681   5.258  -1.651
  157    HB2  HIS  25           1HB      HIS  25 -10.800   6.001  -3.033
  158    HB3  HIS  25           2HB      HIS  25 -10.003   7.572  -3.009
  159    HD1  HIS  25           HD1      HIS  25 -10.408   5.115  -5.312
  160    HD2  HIS  25           HD2      HIS  25  -6.966   6.767  -3.673
  161    HE1  HIS  25           HE1      HIS  25  -8.580   4.645  -6.973
  162    H    THR  26           H        THR  26  -9.852   8.465  -0.677
  163    HA   THR  26           HA       THR  26  -7.593   9.974  -1.126
  164    HB   THR  26           HB       THR  26  -9.679  10.984  -0.379
  165    HG1  THR  26           HG1      THR  26  -8.712  12.364   1.291
  166   HG21  THR  26          3HG2      THR  26 -10.712  10.581   1.612
  167   HG22  THR  26          1HG2      THR  26  -9.198  10.267   2.460
  168   HG23  THR  26          2HG2      THR  26  -9.900   9.027   1.421
  169    H    HIS  27           H        HIS  27  -8.336   7.930   1.667
  170    HA   HIS  27           HA       HIS  27  -6.136   8.628   3.254
  171    HB2  HIS  27           1HB      HIS  27  -7.954   6.260   3.109
  172    HB3  HIS  27           2HB      HIS  27  -6.504   6.154   4.102
  173    HD1  HIS  27           HD1      HIS  27  -8.110   5.985   6.185
  174    HD2  HIS  27           HD2      HIS  27  -8.251   9.594   4.132
  175    HE1  HIS  27           HE1      HIS  27  -9.281   7.590   7.727
  176    H    LEU  28           H        LEU  28  -6.525   5.964   0.929
  177    HA   LEU  28           HA       LEU  28  -4.042   4.774   1.217
  178    HB2  LEU  28           1HB      LEU  28  -5.700   3.696  -0.088
  179    HB3  LEU  28           2HB      LEU  28  -5.829   5.072  -1.182
  180    HG   LEU  28           HG       LEU  28  -3.563   4.570  -2.029
  181   HD11  LEU  28          1HD1      LEU  28  -2.218   3.300  -0.806
  182   HD12  LEU  28          2HD1      LEU  28  -3.216   1.912  -1.242
  183   HD13  LEU  28          3HD1      LEU  28  -3.548   2.806   0.242
  184   HD21  LEU  28          3HD2      LEU  28  -4.825   1.975  -2.428
  185   HD22  LEU  28          1HD2      LEU  28  -4.463   3.252  -3.590
  186   HD23  LEU  28          2HD2      LEU  28  -5.941   3.327  -2.630
  187    H    ASN  29           H        ASN  29  -4.975   7.354  -1.055
  188    HA   ASN  29           HA       ASN  29  -2.441   7.698  -2.210
  189    HB2  ASN  29           1HB      ASN  29  -4.693   8.609  -3.016
  190    HB3  ASN  29           2HB      ASN  29  -4.457   9.913  -1.856
  191   HD21  ASN  29          1HD2      ASN  29  -4.706  10.842  -4.217
  192   HD22  ASN  29          2HD2      ASN  29  -3.205  11.247  -4.970
  193    H    GLU  30           H        GLU  30  -4.031   9.601   0.354
  194    HA   GLU  30           HA       GLU  30  -2.085  11.413   0.939
  195    HB2  GLU  30           1HB      GLU  30  -3.906   9.913   2.819
  196    HB3  GLU  30           2HB      GLU  30  -2.885  11.244   3.343
  197    HG2  GLU  30           1HG      GLU  30  -4.890  11.508   1.124
  198    HG3  GLU  30           2HG      GLU  30  -5.283  11.808   2.816
  199    H    HIS  31           H        HIS  31  -2.218   8.043   2.000
  200    HA   HIS  31           HA       HIS  31   0.086   8.169   3.654
  201    HB2  HIS  31           1HB      HIS  31  -1.414   6.384   4.071
  202    HB3  HIS  31           2HB      HIS  31  -1.417   5.888   2.381
  203    HD1  HIS  31           HD1      HIS  31   0.920   5.951   5.367
  204    HD2  HIS  31           HD2      HIS  31   0.384   3.937   1.773
  205    HE1  HIS  31           HE1      HIS  31   2.609   4.088   5.382
  206    H    ARG  32           H        ARG  32  -0.396   6.768   0.408
  207    HA   ARG  32           HA       ARG  32   2.097   5.924  -0.213
  208    HB2  ARG  32           1HB      ARG  32   0.083   7.368  -1.921
  209    HB3  ARG  32           2HB      ARG  32   1.593   6.765  -2.590
  210    HG2  ARG  32           1HG      ARG  32   0.963   4.584  -2.419
  211    HG3  ARG  32           2HG      ARG  32  -0.079   4.879  -1.026
  212    HD2  ARG  32           1HD      ARG  32  -1.809   5.733  -2.367
  213    HD3  ARG  32           2HD      ARG  32  -0.742   5.938  -3.756
  214    HE   ARG  32           HE       ARG  32  -2.078   3.517  -2.927
  215   HH11  ARG  32          1HH1      ARG  32   0.498   4.909  -4.810
  216   HH12  ARG  32          2HH1      ARG  32   0.625   3.552  -5.880
  217   HH21  ARG  32          1HH2      ARG  32  -1.919   1.724  -4.328
  218   HH22  ARG  32          2HH2      ARG  32  -0.751   1.741  -5.605
  219    H    ARG  33           H        ARG  33   1.124   9.196   0.308
  220    HA   ARG  33           HA       ARG  33   2.984  10.671  -1.077
  221    HB2  ARG  33           1HB      ARG  33   1.935  11.130   1.720
  222    HB3  ARG  33           2HB      ARG  33   2.817  12.329   0.783
  223    HG2  ARG  33           1HG      ARG  33   1.060  12.316  -0.906
  224    HG3  ARG  33           2HG      ARG  33   0.180  11.095   0.015
  225    HD2  ARG  33           1HD      ARG  33  -0.843  13.124   0.588
  226    HD3  ARG  33           2HD      ARG  33   0.226  12.763   1.943
  227    HE   ARG  33           HE       ARG  33   1.509  14.594   1.392
  228   HH11  ARG  33          1HH1      ARG  33  -0.774  13.937  -1.152
  229   HH12  ARG  33          2HH1      ARG  33  -0.473  15.427  -1.985
  230   HH21  ARG  33          1HH2      ARG  33   1.914  16.558   0.306
  231   HH22  ARG  33          2HH2      ARG  33   1.057  16.916  -1.155
  232    H    ILE  34           H        ILE  34   3.394   9.029   2.035
  233    HA   ILE  34           HA       ILE  34   6.030   9.945   2.512
  234    HB   ILE  34           HB       ILE  34   6.171   8.249   4.220
  235   HG12  ILE  34          1HG1      ILE  34   3.513   7.095   3.502
  236   HG13  ILE  34          2HG1      ILE  34   4.921   6.569   2.586
  237   HG21  ILE  34          1HG2      ILE  34   3.593   9.729   3.945
  238   HG22  ILE  34          2HG2      ILE  34   3.843   8.654   5.320
  239   HG23  ILE  34          3HG2      ILE  34   4.938  10.010   5.050
  240   HD11  ILE  34          3HD1      ILE  34   5.885   6.270   5.055
  241   HD12  ILE  34          1HD1      ILE  34   4.169   6.037   5.387
  242   HD13  ILE  34          2HD1      ILE  34   4.987   5.009   4.210
  243    H    HIS  35           H        HIS  35   4.755   7.580   0.401
  244    HA   HIS  35           HA       HIS  35   7.240   6.086   0.201
  245    HB2  HIS  35           1HB      HIS  35   4.522   5.819  -1.056
  246    HB3  HIS  35           2HB      HIS  35   5.901   4.927  -1.692
  247    HD1  HIS  35           HD1      HIS  35   7.238   4.086   0.946
  248    HD2  HIS  35           HD2      HIS  35   3.154   3.843   0.220
  249    HE1  HIS  35           HE1      HIS  35   6.376   2.334   2.531
  250    H    THR  36           H        THR  36   5.490   8.576  -1.499
  251    HA   THR  36           HA       THR  36   7.331   8.466  -3.764
  252    HB   THR  36           HB       THR  36   4.820   8.801  -4.050
  253    HG1  THR  36           HG1      THR  36   5.194  10.191  -5.800
  254   HG21  THR  36          3HG2      THR  36   4.720  10.530  -2.194
  255   HG22  THR  36          1HG2      THR  36   3.877  10.943  -3.686
  256   HG23  THR  36          2HG2      THR  36   5.451  11.658  -3.335
  257    H    GLY  37           H        GLY  37   8.754  10.096  -4.298
  258    HA2  GLY  37           1HA      GLY  37   8.848  12.625  -3.034
  259    HA3  GLY  37           2HA      GLY  37   9.969  11.531  -2.239
  260    H    TYR  38           H        TYR  38  11.764  10.733  -3.393
  261    HA   TYR  38           HA       TYR  38  12.908  12.580  -5.200
  262    HB2  TYR  38           1HB      TYR  38  14.832  11.299  -5.070
  263    HB3  TYR  38           2HB      TYR  38  14.026  10.860  -3.568
  264    HD1  TYR  38           HD2      TYR  38  12.105   8.877  -4.242
  265    HD2  TYR  38           HD1      TYR  38  15.959   9.487  -5.938
  266    HE1  TYR  38           HE2      TYR  38  12.190   6.505  -4.885
  267    HE2  TYR  38           HE1      TYR  38  16.054   7.116  -6.587
  268    HH   TYR  38           HH       TYR  38  14.548   4.826  -5.416
  269    H    ARG  39           H        ARG  39  13.659  12.140  -7.379
  270    HA   ARG  39           HA       ARG  39  11.661  10.622  -8.893
  271    HB2  ARG  39           1HB      ARG  39  13.534  12.862  -9.622
  272    HB3  ARG  39           2HB      ARG  39  12.721  11.904 -10.853
  273    HG2  ARG  39           1HG      ARG  39  10.575  12.611 -10.091
  274    HG3  ARG  39           2HG      ARG  39  11.278  13.388  -8.671
  275    HD2  ARG  39           1HD      ARG  39  12.169  14.229 -11.392
  276    HD3  ARG  39           2HD      ARG  39  10.615  14.796 -10.781
  277    HE   ARG  39           HE       ARG  39  12.506  15.264  -8.798
  278   HH11  ARG  39          1HH1      ARG  39  11.830  16.304 -12.051
  279   HH12  ARG  39          2HH1      ARG  39  12.539  17.870 -11.836
  280   HH21  ARG  39          1HH2      ARG  39  13.442  17.323  -8.503
  281   HH22  ARG  39          2HH2      ARG  39  13.457  18.448  -9.818
  282    HA   PRO  40           HA       PRO  40  14.542   7.454  -9.911
  283    HB2  PRO  40           1HB      PRO  40  13.398   6.552 -12.202
  284    HB3  PRO  40           2HB      PRO  40  12.723   6.231 -10.601
  285    HG2  PRO  40           1HG      PRO  40  11.927   8.301 -12.611
  286    HG3  PRO  40           2HG      PRO  40  10.898   7.260 -11.611
  287    HD2  PRO  40           1HD      PRO  40  11.394   9.848 -10.989
  288    HD3  PRO  40           2HD      PRO  40  11.132   8.602  -9.752
  289    H    SER  41           H        SER  41  16.464   7.433 -10.904
  290    HA   SER  41           HA       SER  41  17.309   9.518 -12.581
  291    HB2  SER  41           1HB      SER  41  19.378   8.237 -12.842
  292    HB3  SER  41           2HB      SER  41  18.841   8.192 -11.163
  293    HG   SER  41           HG       SER  41  17.905   6.122 -11.653
  294    H    GLY  42           H        GLY  42  16.449   6.149 -13.319
  295    HA2  GLY  42           1HA      GLY  42  15.388   6.783 -15.858
  296    HA3  GLY  42           2HA      GLY  42  17.028   6.182 -16.051
  297    HA   PRO  43           HA       PRO  43  15.776   2.000 -15.642
  298    HB2  PRO  43           1HB      PRO  43  17.348   0.929 -13.705
  299    HB3  PRO  43           2HB      PRO  43  17.962   1.380 -15.300
  300    HG2  PRO  43           1HG      PRO  43  18.121   2.881 -12.715
  301    HG3  PRO  43           2HG      PRO  43  19.371   2.645 -13.951
  302    HD2  PRO  43           1HD      PRO  43  17.931   4.930 -13.752
  303    HD3  PRO  43           2HD      PRO  43  18.523   4.306 -15.305
  304    H    SER  44           H        SER  44  13.665   2.053 -14.915
  305    HA   SER  44           HA       SER  44  13.167   0.984 -12.328
  306    HB2  SER  44           1HB      SER  44  11.877   2.823 -11.380
  307    HB3  SER  44           2HB      SER  44  13.524   3.361 -11.711
  308    HG   SER  44           HG       SER  44  11.481   3.727 -13.616
  309    H    SER  45           H        SER  45  10.770   0.784 -11.918
  310    HA   SER  45           HA       SER  45   9.491  -0.530 -13.941
  311    HB2  SER  45           1HB      SER  45   8.532   0.836 -11.468
  312    HB3  SER  45           2HB      SER  45   7.326   0.294 -12.634
  313    HG   SER  45           HG       SER  45   8.382  -1.800 -12.507
  314    H    GLY  46           H        GLY  46   8.007  -0.044 -15.536
  315    HA2  GLY  46           1HA      GLY  46   8.293   2.298 -16.971
  316    HA3  GLY  46           2HA      GLY  46   6.910   1.223 -17.108
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1  -7.370 -28.758 -10.002
    2    HA2  GLY   1           1HA      GLY   1  -9.319 -28.369  -8.221
    3    HA3  GLY   1           2HA      GLY   1  -8.082 -29.088  -7.200
    4    H    SER   2           H        SER   2  -9.013 -26.581  -6.642
    5    HA   SER   2           HA       SER   2  -6.586 -25.035  -6.847
    6    HB2  SER   2           1HB      SER   2  -9.155 -23.981  -8.053
    7    HB3  SER   2           2HB      SER   2  -7.690 -23.033  -7.800
    8    HG   SER   2           HG       SER   2  -7.956 -23.942  -9.952
    9    H    SER   3           H        SER   3  -6.434 -23.415  -5.289
   10    HA   SER   3           HA       SER   3  -8.715 -22.891  -3.564
   11    HB2  SER   3           1HB      SER   3  -6.286 -24.428  -2.707
   12    HB3  SER   3           2HB      SER   3  -7.119 -23.392  -1.549
   13    HG   SER   3           HG       SER   3  -8.682 -24.793  -1.444
   14    H    GLY   4           H        GLY   4  -8.683 -20.869  -2.761
   15    HA2  GLY   4           1HA      GLY   4  -6.775 -19.296  -1.774
   16    HA3  GLY   4           2HA      GLY   4  -6.427 -19.178  -3.492
   17    H    SER   5           H        SER   5  -9.398 -19.159  -1.517
   18    HA   SER   5           HA       SER   5 -10.068 -16.555  -2.705
   19    HB2  SER   5           1HB      SER   5 -12.343 -17.228  -3.113
   20    HB3  SER   5           2HB      SER   5 -11.287 -18.421  -3.871
   21    HG   SER   5           HG       SER   5 -12.891 -18.652  -1.582
   22    H    SER   6           H        SER   6 -10.832 -18.924  -0.177
   23    HA   SER   6           HA       SER   6 -12.472 -17.670   1.510
   24    HB2  SER   6           1HB      SER   6 -11.185 -18.646   3.420
   25    HB3  SER   6           2HB      SER   6 -11.473 -19.791   2.110
   26    HG   SER   6           HG       SER   6  -9.088 -18.521   2.877
   27    H    GLY   7           H        GLY   7 -12.585 -15.527   1.821
   28    HA2  GLY   7           1HA      GLY   7 -10.359 -14.245   3.210
   29    HA3  GLY   7           2HA      GLY   7 -10.859 -13.526   1.686
   30    H    SER   8           H        SER   8 -11.230 -13.370   4.958
   31    HA   SER   8           HA       SER   8 -13.990 -12.392   4.844
   32    HB2  SER   8           1HB      SER   8 -13.693 -13.899   6.653
   33    HB3  SER   8           2HB      SER   8 -12.172 -13.144   7.132
   34    HG   SER   8           HG       SER   8 -13.376 -12.032   8.442
   35    H    GLY   9           H        GLY   9 -14.242 -10.305   4.413
   36    HA2  GLY   9           1HA      GLY   9 -13.966  -8.027   4.465
   37    HA3  GLY   9           2HA      GLY   9 -13.119  -8.261   5.987
   38    H    GLU  10           H        GLU  10 -12.828  -7.370   2.744
   39    HA   GLU  10           HA       GLU  10  -9.963  -6.992   3.078
   40    HB2  GLU  10           1HB      GLU  10 -10.354  -9.234   1.953
   41    HB3  GLU  10           2HB      GLU  10 -11.014  -8.338   0.592
   42    HG2  GLU  10           1HG      GLU  10  -8.946  -7.342   0.104
   43    HG3  GLU  10           2HG      GLU  10  -8.264  -7.807   1.661
   44    H    LYS  11           H        LYS  11  -9.575  -4.946   2.592
   45    HA   LYS  11           HA       LYS  11 -11.434  -3.443   0.953
   46    HB2  LYS  11           1HB      LYS  11  -9.134  -2.766   2.737
   47    HB3  LYS  11           2HB      LYS  11  -9.634  -1.596   1.523
   48    HG2  LYS  11           1HG      LYS  11 -11.686  -1.240   2.517
   49    HG3  LYS  11           2HG      LYS  11 -11.661  -2.789   3.363
   50    HD2  LYS  11           1HD      LYS  11  -9.607  -0.716   4.009
   51    HD3  LYS  11           2HD      LYS  11 -11.236  -0.567   4.673
   52    HE2  LYS  11           1HE      LYS  11 -11.052  -2.749   5.701
   53    HE3  LYS  11           2HE      LYS  11  -9.475  -3.000   4.954
   54    HZ1  LYS  11           3HZ      LYS  11  -9.875  -1.998   7.424
   55    HZ2  LYS  11           1HZ      LYS  11  -9.658  -0.587   6.515
   56    HZ3  LYS  11           2HZ      LYS  11  -8.465  -1.787   6.513
   57    HA   PRO  12           HA       PRO  12  -9.150  -3.723  -2.800
   58    HB2  PRO  12           1HB      PRO  12 -10.033  -1.460  -4.014
   59    HB3  PRO  12           2HB      PRO  12 -11.034  -2.906  -3.832
   60    HG2  PRO  12           1HG      PRO  12 -11.006  -0.402  -2.191
   61    HG3  PRO  12           2HG      PRO  12 -12.392  -1.338  -2.782
   62    HD2  PRO  12           1HD      PRO  12 -11.482  -1.531  -0.239
   63    HD3  PRO  12           2HD      PRO  12 -12.216  -2.901  -1.097
   64    H    TYR  13           H        TYR  13  -8.783  -1.133  -0.574
   65    HA   TYR  13           HA       TYR  13  -6.537   0.017  -2.054
   66    HB2  TYR  13           1HB      TYR  13  -7.731   0.942   0.564
   67    HB3  TYR  13           2HB      TYR  13  -6.605   1.829  -0.457
   68    HD1  TYR  13           HD1      TYR  13  -7.568   1.907  -3.050
   69    HD2  TYR  13           HD2      TYR  13  -9.874   1.767   0.523
   70    HE1  TYR  13           HE1      TYR  13  -9.456   2.945  -4.236
   71    HE2  TYR  13           HE2      TYR  13 -11.770   2.803  -0.654
   72    HH   TYR  13           HH       TYR  13 -11.695   3.367  -4.120
   73    H    LYS  14           H        LYS  14  -4.857  -1.387  -1.829
   74    HA   LYS  14           HA       LYS  14  -3.868  -1.791   0.913
   75    HB2  LYS  14           1HB      LYS  14  -4.675  -3.930   0.339
   76    HB3  LYS  14           2HB      LYS  14  -4.089  -3.802  -1.314
   77    HG2  LYS  14           1HG      LYS  14  -2.675  -5.329  -0.191
   78    HG3  LYS  14           2HG      LYS  14  -1.758  -3.835  -0.391
   79    HD2  LYS  14           1HD      LYS  14  -1.301  -4.260   1.804
   80    HD3  LYS  14           2HD      LYS  14  -2.783  -3.321   1.998
   81    HE2  LYS  14           1HE      LYS  14  -2.977  -6.277   1.671
   82    HE3  LYS  14           2HE      LYS  14  -2.460  -5.626   3.226
   83    HZ1  LYS  14           3HZ      LYS  14  -4.543  -4.139   2.945
   84    HZ2  LYS  14           1HZ      LYS  14  -4.725  -5.735   3.475
   85    HZ3  LYS  14           2HZ      LYS  14  -5.050  -5.337   1.864
   86    H    CYS  15           H        CYS  15  -2.297  -0.248   0.864
   87    HA   CYS  15           HA       CYS  15  -0.664   0.427  -1.284
   88    HB2  CYS  15           1HB      CYS  15  -0.839   1.819   0.713
   89    HB3  CYS  15           2HB      CYS  15  -0.057   0.569   1.677
   90    H    SER  16           H        SER  16   0.520  -0.977  -2.409
   91    HA   SER  16           HA       SER  16   1.620  -3.358  -1.312
   92    HB2  SER  16           1HB      SER  16   1.101  -3.439  -3.617
   93    HB3  SER  16           2HB      SER  16   1.963  -1.937  -3.949
   94    HG   SER  16           HG       SER  16   3.633  -3.130  -4.347
   95    H    GLU  17           H        GLU  17   2.863  -0.137  -1.915
   96    HA   GLU  17           HA       GLU  17   5.563  -0.434  -1.853
   97    HB2  GLU  17           1HB      GLU  17   4.103   1.639  -0.213
   98    HB3  GLU  17           2HB      GLU  17   5.722   1.766  -0.885
   99    HG2  GLU  17           1HG      GLU  17   4.523   1.453  -3.163
  100    HG3  GLU  17           2HG      GLU  17   3.084   1.935  -2.267
  101    H    CYS  18           H        CYS  18   3.467  -0.263   1.021
  102    HA   CYS  18           HA       CYS  18   5.632  -1.546   2.556
  103    HB2  CYS  18           1HB      CYS  18   4.739  -0.402   4.556
  104    HB3  CYS  18           2HB      CYS  18   5.282   0.737   3.327
  105    H    GLY  19           H        GLY  19   2.162  -1.332   1.985
  106    HA2  GLY  19           1HA      GLY  19   0.951  -3.461   1.897
  107    HA3  GLY  19           2HA      GLY  19   1.881  -3.962   3.301
  108    H    LYS  20           H        LYS  20   0.481  -0.769   2.926
  109    HA   LYS  20           HA       LYS  20  -1.017  -1.152   5.380
  110    HB2  LYS  20           1HB      LYS  20  -0.348   1.206   3.653
  111    HB3  LYS  20           2HB      LYS  20  -1.638   1.328   4.842
  112    HG2  LYS  20           1HG      LYS  20   0.988   0.271   5.737
  113    HG3  LYS  20           2HG      LYS  20   0.849   2.000   5.407
  114    HD2  LYS  20           1HD      LYS  20  -0.867   2.259   7.025
  115    HD3  LYS  20           2HD      LYS  20  -1.070   0.513   7.189
  116    HE2  LYS  20           1HE      LYS  20   1.037   0.291   8.271
  117    HE3  LYS  20           2HE      LYS  20   1.482   1.953   7.883
  118    HZ1  LYS  20           3HZ      LYS  20  -0.015   0.955  10.094
  119    HZ2  LYS  20           1HZ      LYS  20  -0.865   2.166   9.273
  120    HZ3  LYS  20           2HZ      LYS  20   0.686   2.478   9.872
  121    H    ALA  21           H        ALA  21  -3.285  -0.336   5.503
  122    HA   ALA  21           HA       ALA  21  -4.793  -0.731   3.018
  123    HB1  ALA  21           3HB      ALA  21  -6.049  -2.458   3.769
  124    HB2  ALA  21           1HB      ALA  21  -4.603  -2.777   4.728
  125    HB3  ALA  21           2HB      ALA  21  -5.972  -1.930   5.450
  126    H    PHE  22           H        PHE  22  -6.470   0.634   2.766
  127    HA   PHE  22           HA       PHE  22  -7.396   2.157   5.102
  128    HB2  PHE  22           1HB      PHE  22  -6.844   3.376   2.390
  129    HB3  PHE  22           2HB      PHE  22  -7.377   4.223   3.838
  130    HD1  PHE  22           HD1      PHE  22  -4.557   2.411   2.300
  131    HD2  PHE  22           HD2      PHE  22  -5.837   4.934   5.480
  132    HE1  PHE  22           HE1      PHE  22  -2.210   2.812   2.922
  133    HE2  PHE  22           HE2      PHE  22  -3.493   5.340   6.106
  134    HZ   PHE  22           HZ       PHE  22  -1.676   4.280   4.826
  135    H    HIS  23           H        HIS  23  -9.543   2.875   5.019
  136    HA   HIS  23           HA       HIS  23 -11.344   1.176   3.673
  137    HB2  HIS  23           1HB      HIS  23 -11.603   2.683   5.837
  138    HB3  HIS  23           2HB      HIS  23 -12.250   3.839   4.677
  139    HD1  HIS  23           HD1      HIS  23 -13.307   1.210   6.837
  140    HD2  HIS  23           HD2      HIS  23 -14.434   2.524   3.060
  141    HE1  HIS  23           HE1      HIS  23 -15.605   0.265   6.455
  142    H    ARG  24           H        ARG  24 -10.626   4.633   3.182
  143    HA   ARG  24           HA       ARG  24 -11.917   4.462   0.549
  144    HB2  ARG  24           1HB      ARG  24 -11.449   6.679   2.490
  145    HB3  ARG  24           2HB      ARG  24 -11.522   7.075   0.778
  146    HG2  ARG  24           1HG      ARG  24 -13.670   5.575   2.259
  147    HG3  ARG  24           2HG      ARG  24 -13.682   7.316   1.974
  148    HD2  ARG  24           1HD      ARG  24 -13.294   6.523  -0.528
  149    HD3  ARG  24           2HD      ARG  24 -14.088   5.069   0.075
  150    HE   ARG  24           HE       ARG  24 -15.311   7.585  -0.475
  151   HH11  ARG  24          1HH1      ARG  24 -15.470   4.785   1.588
  152   HH12  ARG  24          2HH1      ARG  24 -17.164   4.955   1.907
  153   HH21  ARG  24          1HH2      ARG  24 -17.542   7.819  -0.062
  154   HH22  ARG  24          2HH2      ARG  24 -18.342   6.680   0.967
  155    H    HIS  25           H        HIS  25 -10.883   5.812  -1.187
  156    HA   HIS  25           HA       HIS  25  -8.187   4.969  -1.545
  157    HB2  HIS  25           1HB      HIS  25  -9.449   5.076  -3.522
  158    HB3  HIS  25           2HB      HIS  25 -10.076   6.678  -3.143
  159    HD1  HIS  25           HD1      HIS  25  -8.347   8.688  -3.419
  160    HD2  HIS  25           HD2      HIS  25  -7.154   5.045  -5.021
  161    HE1  HIS  25           HE1      HIS  25  -6.446   9.228  -4.975
  162    H    THR  26           H        THR  26  -9.700   8.150  -1.073
  163    HA   THR  26           HA       THR  26  -7.637   9.871  -1.294
  164    HB   THR  26           HB       THR  26  -8.626  11.252   0.482
  165    HG1  THR  26           HG1      THR  26 -10.266  10.423   1.768
  166   HG21  THR  26          3HG2      THR  26 -11.020  10.087  -0.831
  167   HG22  THR  26          1HG2      THR  26  -9.736  10.691  -1.877
  168   HG23  THR  26          2HG2      THR  26 -10.502  11.768  -0.708
  169    H    HIS  27           H        HIS  27  -8.286   7.872   1.573
  170    HA   HIS  27           HA       HIS  27  -6.123   8.798   3.113
  171    HB2  HIS  27           1HB      HIS  27  -7.821   6.328   3.165
  172    HB3  HIS  27           2HB      HIS  27  -6.411   6.442   4.214
  173    HD1  HIS  27           HD1      HIS  27  -9.265   6.288   5.377
  174    HD2  HIS  27           HD2      HIS  27  -7.213   9.829   4.657
  175    HE1  HIS  27           HE1      HIS  27 -10.310   7.993   6.901
  176    H    LEU  28           H        LEU  28  -6.424   5.836   1.151
  177    HA   LEU  28           HA       LEU  28  -3.903   4.798   1.504
  178    HB2  LEU  28           1HB      LEU  28  -5.417   3.478   0.322
  179    HB3  LEU  28           2HB      LEU  28  -5.788   4.765  -0.823
  180    HG   LEU  28           HG       LEU  28  -3.351   4.452  -1.619
  181   HD11  LEU  28          1HD1      LEU  28  -3.471   2.498   0.438
  182   HD12  LEU  28          2HD1      LEU  28  -2.126   2.895  -0.630
  183   HD13  LEU  28          3HD1      LEU  28  -3.298   1.667  -1.108
  184   HD21  LEU  28          3HD2      LEU  28  -4.989   3.892  -3.153
  185   HD22  LEU  28          1HD2      LEU  28  -5.671   2.633  -2.123
  186   HD23  LEU  28          2HD2      LEU  28  -4.134   2.362  -2.945
  187    H    ASN  29           H        ASN  29  -4.908   7.018  -1.101
  188    HA   ASN  29           HA       ASN  29  -2.379   7.354  -2.245
  189    HB2  ASN  29           1HB      ASN  29  -4.767   8.116  -3.038
  190    HB3  ASN  29           2HB      ASN  29  -4.346   9.613  -2.210
  191   HD21  ASN  29          1HD2      ASN  29  -4.553  10.514  -4.373
  192   HD22  ASN  29          2HD2      ASN  29  -3.193  10.452  -5.437
  193    H    GLU  30           H        GLU  30  -4.087   9.675  -0.135
  194    HA   GLU  30           HA       GLU  30  -2.079  11.475   0.288
  195    HB2  GLU  30           1HB      GLU  30  -4.254  10.490   2.114
  196    HB3  GLU  30           2HB      GLU  30  -3.126  11.733   2.636
  197    HG2  GLU  30           1HG      GLU  30  -3.800  13.020   0.563
  198    HG3  GLU  30           2HG      GLU  30  -5.113  11.857   0.392
  199    H    HIS  31           H        HIS  31  -2.206   8.221   1.366
  200    HA   HIS  31           HA       HIS  31  -0.205   8.583   3.436
  201    HB2  HIS  31           1HB      HIS  31  -1.627   6.897   4.095
  202    HB3  HIS  31           2HB      HIS  31  -1.869   6.311   2.452
  203    HD1  HIS  31           HD1      HIS  31   0.369   5.954   5.412
  204    HD2  HIS  31           HD2      HIS  31   0.036   4.448   1.555
  205    HE1  HIS  31           HE1      HIS  31   1.937   3.991   5.320
  206    H    ARG  32           H        ARG  32  -0.442   6.792   0.362
  207    HA   ARG  32           HA       ARG  32   1.991   5.699   0.084
  208    HB2  ARG  32           1HB      ARG  32   0.316   7.174  -1.926
  209    HB3  ARG  32           2HB      ARG  32   1.856   6.464  -2.394
  210    HG2  ARG  32           1HG      ARG  32   1.110   4.291  -2.001
  211    HG3  ARG  32           2HG      ARG  32  -0.248   4.838  -1.017
  212    HD2  ARG  32           1HD      ARG  32  -1.456   5.565  -2.885
  213    HD3  ARG  32           2HD      ARG  32  -0.028   5.563  -3.918
  214    HE   ARG  32           HE       ARG  32  -1.783   3.387  -3.455
  215   HH11  ARG  32          1HH1      ARG  32   1.575   4.160  -3.952
  216   HH12  ARG  32          2HH1      ARG  32   1.965   2.614  -4.630
  217   HH21  ARG  32          1HH2      ARG  32  -1.282   1.348  -4.346
  218   HH22  ARG  32          2HH2      ARG  32   0.339   1.016  -4.854
  219    H    ARG  33           H        ARG  33   1.316   9.106   0.147
  220    HA   ARG  33           HA       ARG  33   3.528  10.218  -1.044
  221    HB2  ARG  33           1HB      ARG  33   1.944  11.057   1.373
  222    HB3  ARG  33           2HB      ARG  33   3.286  12.025   0.776
  223    HG2  ARG  33           1HG      ARG  33   1.226  12.895  -0.094
  224    HG3  ARG  33           2HG      ARG  33   2.157  12.181  -1.412
  225    HD2  ARG  33           1HD      ARG  33   0.114  10.549   0.037
  226    HD3  ARG  33           2HD      ARG  33  -0.393  11.693  -1.205
  227    HE   ARG  33           HE       ARG  33   0.952   9.184  -1.603
  228   HH11  ARG  33          1HH1      ARG  33   0.312  12.334  -2.940
  229   HH12  ARG  33          2HH1      ARG  33   0.588  11.839  -4.577
  230   HH21  ARG  33          1HH2      ARG  33   1.319   8.521  -3.754
  231   HH22  ARG  33          2HH2      ARG  33   1.160   9.670  -5.039
  232    H    ILE  34           H        ILE  34   3.248   9.046   2.298
  233    HA   ILE  34           HA       ILE  34   5.670   9.748   3.338
  234    HB   ILE  34           HB       ILE  34   5.544   7.853   4.816
  235   HG12  ILE  34          1HG1      ILE  34   3.263   6.673   3.275
  236   HG13  ILE  34          2HG1      ILE  34   4.914   6.310   2.784
  237   HG21  ILE  34          1HG2      ILE  34   3.267   8.099   5.659
  238   HG22  ILE  34          2HG2      ILE  34   3.938   9.656   5.175
  239   HG23  ILE  34          3HG2      ILE  34   2.776   8.835   4.133
  240   HD11  ILE  34          3HD1      ILE  34   4.722   4.612   4.218
  241   HD12  ILE  34          1HD1      ILE  34   5.038   5.834   5.449
  242   HD13  ILE  34          2HD1      ILE  34   3.379   5.360   5.082
  243    H    HIS  35           H        HIS  35   5.087   7.566   0.752
  244    HA   HIS  35           HA       HIS  35   7.716   6.327   0.954
  245    HB2  HIS  35           1HB      HIS  35   5.510   5.950  -1.082
  246    HB3  HIS  35           2HB      HIS  35   7.000   5.014  -1.012
  247    HD1  HIS  35           HD1      HIS  35   7.175   4.271   1.899
  248    HD2  HIS  35           HD2      HIS  35   3.602   4.240  -0.220
  249    HE1  HIS  35           HE1      HIS  35   5.663   2.701   3.154
  250    H    THR  36           H        THR  36   5.994   8.700  -0.963
  251    HA   THR  36           HA       THR  36   8.218   8.996  -2.817
  252    HB   THR  36           HB       THR  36   6.829  10.619  -3.981
  253    HG1  THR  36           HG1      THR  36   5.148  11.533  -3.045
  254   HG21  THR  36          3HG2      THR  36   4.677   9.058  -4.137
  255   HG22  THR  36          1HG2      THR  36   5.735   7.953  -3.260
  256   HG23  THR  36          2HG2      THR  36   6.228   8.587  -4.830
  257    H    GLY  37           H        GLY  37   8.981   9.565  -0.220
  258    HA2  GLY  37           1HA      GLY  37   8.855  12.431   0.196
  259    HA3  GLY  37           2HA      GLY  37   9.695  11.264   1.206
  260    H    TYR  38           H        TYR  38  11.697  10.299   0.217
  261    HA   TYR  38           HA       TYR  38  13.103  12.326  -1.396
  262    HB2  TYR  38           1HB      TYR  38  14.978  12.205  -0.056
  263    HB3  TYR  38           2HB      TYR  38  13.710  11.970   1.141
  264    HD1  TYR  38           HD1      TYR  38  16.147  10.146  -0.987
  265    HD2  TYR  38           HD2      TYR  38  13.650  10.025   2.456
  266    HE1  TYR  38           HE1      TYR  38  17.183   8.019  -0.318
  267    HE2  TYR  38           HE2      TYR  38  14.681   7.898   3.136
  268    HH   TYR  38           HH       TYR  38  17.495   6.787   2.048
  269    H    ARG  39           H        ARG  39  14.402  11.627  -3.042
  270    HA   ARG  39           HA       ARG  39  14.379   8.728  -3.574
  271    HB2  ARG  39           1HB      ARG  39  14.089  11.083  -5.417
  272    HB3  ARG  39           2HB      ARG  39  14.657   9.533  -6.022
  273    HG2  ARG  39           1HG      ARG  39  12.102   9.768  -4.474
  274    HG3  ARG  39           2HG      ARG  39  12.167  10.057  -6.213
  275    HD2  ARG  39           1HD      ARG  39  13.315   7.555  -5.037
  276    HD3  ARG  39           2HD      ARG  39  11.584   7.689  -5.344
  277    HE   ARG  39           HE       ARG  39  13.671   7.378  -7.293
  278   HH11  ARG  39          1HH1      ARG  39  10.434   8.527  -6.726
  279   HH12  ARG  39          2HH1      ARG  39   9.950   8.377  -8.383
  280   HH21  ARG  39          1HH2      ARG  39  13.046   7.175  -9.478
  281   HH22  ARG  39          2HH2      ARG  39  11.436   7.606  -9.947
  282    HA   PRO  40           HA       PRO  40  18.778   8.827  -3.508
  283    HB2  PRO  40           1HB      PRO  40  19.285   6.634  -5.027
  284    HB3  PRO  40           2HB      PRO  40  18.678   6.535  -3.370
  285    HG2  PRO  40           1HG      PRO  40  17.179   6.314  -5.952
  286    HG3  PRO  40           2HG      PRO  40  17.022   5.338  -4.480
  287    HD2  PRO  40           1HD      PRO  40  15.303   7.339  -5.092
  288    HD3  PRO  40           2HD      PRO  40  15.724   6.920  -3.419
  289    H    SER  41           H        SER  41  17.429   8.035  -6.719
  290    HA   SER  41           HA       SER  41  19.645   9.423  -8.002
  291    HB2  SER  41           1HB      SER  41  17.427   7.651  -9.002
  292    HB3  SER  41           2HB      SER  41  18.400   8.609 -10.118
  293    HG   SER  41           HG       SER  41  19.989   7.261  -9.856
  294    H    GLY  42           H        GLY  42  16.141   9.397  -8.671
  295    HA2  GLY  42           1HA      GLY  42  14.665  11.148  -8.963
  296    HA3  GLY  42           2HA      GLY  42  15.899  12.234  -8.341
  297    HA   PRO  43           HA       PRO  43  16.591  11.701 -13.125
  298    HB2  PRO  43           1HB      PRO  43  14.419  10.819 -14.495
  299    HB3  PRO  43           2HB      PRO  43  15.664   9.733 -13.866
  300    HG2  PRO  43           1HG      PRO  43  12.984  10.410 -12.716
  301    HG3  PRO  43           2HG      PRO  43  13.783   8.832 -12.838
  302    HD2  PRO  43           1HD      PRO  43  13.745  10.272 -10.545
  303    HD3  PRO  43           2HD      PRO  43  15.102   9.215 -10.987
  304    H    SER  44           H        SER  44  13.960  12.964 -11.403
  305    HA   SER  44           HA       SER  44  12.395  14.439 -12.976
  306    HB2  SER  44           1HB      SER  44  13.883  15.443 -10.541
  307    HB3  SER  44           2HB      SER  44  12.535  16.298 -11.290
  308    HG   SER  44           HG       SER  44  11.170  14.836 -10.548
  309    H    SER  45           H        SER  45  15.520  15.790 -11.904
  310    HA   SER  45           HA       SER  45  15.488  17.621 -14.168
  311    HB2  SER  45           1HB      SER  45  17.136  18.858 -13.045
  312    HB3  SER  45           2HB      SER  45  16.134  18.234 -11.735
  313    HG   SER  45           HG       SER  45  17.723  16.454 -11.671
  314    H    GLY  46           H        GLY  46  16.625  17.338 -15.977
  315    HA2  GLY  46           1HA      GLY  46  18.830  16.743 -16.929
  316    HA3  GLY  46           2HA      GLY  46  18.746  15.279 -15.960
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1 -17.989 -14.733  -0.832
    2    HA2  GLY   1           1HA      GLY   1 -20.183 -15.998  -1.213
    3    HA3  GLY   1           2HA      GLY   1 -18.860 -16.422  -2.290
    4    H    SER   2           H        SER   2 -18.730 -18.537  -2.572
    5    HA   SER   2           HA       SER   2 -19.694 -20.344  -0.503
    6    HB2  SER   2           1HB      SER   2 -20.470 -20.891  -2.688
    7    HB3  SER   2           2HB      SER   2 -18.851 -20.756  -3.374
    8    HG   SER   2           HG       SER   2 -19.107 -22.891  -3.105
    9    H    SER   3           H        SER   3 -18.328 -20.973   1.022
   10    HA   SER   3           HA       SER   3 -16.402 -21.515   2.120
   11    HB2  SER   3           1HB      SER   3 -16.813 -23.494   0.553
   12    HB3  SER   3           2HB      SER   3 -15.547 -22.812  -0.467
   13    HG   SER   3           HG       SER   3 -14.544 -22.826   1.930
   14    H    GLY   4           H        GLY   4 -16.333 -18.944   1.064
   15    HA2  GLY   4           1HA      GLY   4 -13.712 -18.621  -0.185
   16    HA3  GLY   4           2HA      GLY   4 -14.906 -17.356   0.067
   17    H    SER   5           H        SER   5 -12.501 -19.370   1.686
   18    HA   SER   5           HA       SER   5 -12.604 -18.093   4.193
   19    HB2  SER   5           1HB      SER   5 -11.516 -20.194   4.119
   20    HB3  SER   5           2HB      SER   5 -10.463 -19.693   2.796
   21    HG   SER   5           HG       SER   5  -9.103 -19.144   4.287
   22    H    SER   6           H        SER   6 -10.325 -17.653   1.487
   23    HA   SER   6           HA       SER   6  -8.910 -15.512   2.627
   24    HB2  SER   6           1HB      SER   6  -8.179 -16.899   0.654
   25    HB3  SER   6           2HB      SER   6  -9.325 -15.990  -0.331
   26    HG   SER   6           HG       SER   6  -6.925 -15.164   0.840
   27    H    GLY   7           H        GLY   7  -8.915 -13.256   1.967
   28    HA2  GLY   7           1HA      GLY   7  -9.992 -11.358   1.005
   29    HA3  GLY   7           2HA      GLY   7 -11.483 -12.285   0.922
   30    H    SER   8           H        SER   8  -9.220 -11.608   3.588
   31    HA   SER   8           HA       SER   8 -11.402 -10.247   5.006
   32    HB2  SER   8           1HB      SER   8 -10.750 -11.417   7.099
   33    HB3  SER   8           2HB      SER   8 -11.364 -12.523   5.871
   34    HG   SER   8           HG       SER   8  -8.634 -12.094   5.831
   35    H    GLY   9           H        GLY   9 -10.794  -8.335   5.773
   36    HA2  GLY   9           1HA      GLY   9  -9.448  -6.753   6.820
   37    HA3  GLY   9           2HA      GLY   9  -8.136  -7.922   6.839
   38    H    GLU  10           H        GLU  10  -8.347  -8.454   3.962
   39    HA   GLU  10           HA       GLU  10  -6.569  -6.420   3.063
   40    HB2  GLU  10           1HB      GLU  10  -7.858  -8.802   1.765
   41    HB3  GLU  10           2HB      GLU  10  -6.940  -7.648   0.808
   42    HG2  GLU  10           1HG      GLU  10  -4.997  -8.041   2.300
   43    HG3  GLU  10           2HG      GLU  10  -5.928  -9.301   3.107
   44    H    LYS  11           H        LYS  11  -7.031  -4.528   2.172
   45    HA   LYS  11           HA       LYS  11  -9.758  -4.081   1.164
   46    HB2  LYS  11           1HB      LYS  11  -7.704  -2.226   2.348
   47    HB3  LYS  11           2HB      LYS  11  -9.075  -1.617   1.431
   48    HG2  LYS  11           1HG      LYS  11  -9.498  -3.475   3.735
   49    HG3  LYS  11           2HG      LYS  11  -9.233  -1.750   4.002
   50    HD2  LYS  11           1HD      LYS  11 -11.176  -1.162   2.810
   51    HD3  LYS  11           2HD      LYS  11 -11.318  -2.767   2.089
   52    HE2  LYS  11           1HE      LYS  11 -11.829  -3.710   4.283
   53    HE3  LYS  11           2HE      LYS  11 -11.663  -2.115   5.015
   54    HZ1  LYS  11           3HZ      LYS  11 -13.993  -3.046   4.329
   55    HZ2  LYS  11           1HZ      LYS  11 -13.562  -2.444   2.807
   56    HZ3  LYS  11           2HZ      LYS  11 -13.629  -1.405   4.140
   57    HA   PRO  12           HA       PRO  12  -8.337  -3.479  -2.946
   58    HB2  PRO  12           1HB      PRO  12 -10.054  -1.567  -3.824
   59    HB3  PRO  12           2HB      PRO  12 -10.542  -3.244  -3.548
   60    HG2  PRO  12           1HG      PRO  12 -10.904  -0.851  -1.785
   61    HG3  PRO  12           2HG      PRO  12 -12.053  -2.148  -2.161
   62    HD2  PRO  12           1HD      PRO  12 -10.636  -2.081   0.145
   63    HD3  PRO  12           2HD      PRO  12 -11.104  -3.600  -0.644
   64    H    TYR  13           H        TYR  13  -8.625  -0.672  -0.860
   65    HA   TYR  13           HA       TYR  13  -6.796   0.842  -2.579
   66    HB2  TYR  13           1HB      TYR  13  -8.162   1.888  -0.106
   67    HB3  TYR  13           2HB      TYR  13  -7.503   2.801  -1.459
   68    HD1  TYR  13           HD1      TYR  13  -8.723   2.917  -3.591
   69    HD2  TYR  13           HD2      TYR  13 -10.364   0.931  -0.206
   70    HE1  TYR  13           HE1      TYR  13 -10.942   2.959  -4.650
   71    HE2  TYR  13           HE2      TYR  13 -12.588   0.966  -1.255
   72    HH   TYR  13           HH       TYR  13 -13.497   1.095  -3.638
   73    H    LYS  14           H        LYS  14  -6.015  -1.443  -0.856
   74    HA   LYS  14           HA       LYS  14  -4.509  -0.303   1.322
   75    HB2  LYS  14           1HB      LYS  14  -4.077  -2.461   1.976
   76    HB3  LYS  14           2HB      LYS  14  -5.549  -2.715   1.047
   77    HG2  LYS  14           1HG      LYS  14  -4.301  -3.489  -0.842
   78    HG3  LYS  14           2HG      LYS  14  -2.775  -3.056  -0.068
   79    HD2  LYS  14           1HD      LYS  14  -3.701  -4.676   1.815
   80    HD3  LYS  14           2HD      LYS  14  -4.592  -5.352   0.449
   81    HE2  LYS  14           1HE      LYS  14  -1.672  -4.840   0.152
   82    HE3  LYS  14           2HE      LYS  14  -2.197  -6.237   1.092
   83    HZ1  LYS  14           3HZ      LYS  14  -2.492  -7.317  -0.801
   84    HZ2  LYS  14           1HZ      LYS  14  -2.077  -5.948  -1.704
   85    HZ3  LYS  14           2HZ      LYS  14  -3.687  -6.210  -1.257
   86    H    CYS  15           H        CYS  15  -2.269  -0.135   1.477
   87    HA   CYS  15           HA       CYS  15  -0.928   0.482  -0.978
   88    HB2  CYS  15           1HB      CYS  15  -0.409   1.862   0.891
   89    HB3  CYS  15           2HB      CYS  15  -0.052   0.471   1.908
   90    H    SER  16           H        SER  16   1.010  -0.474  -1.758
   91    HA   SER  16           HA       SER  16   1.263  -3.319  -1.040
   92    HB2  SER  16           1HB      SER  16   2.005  -1.995  -3.659
   93    HB3  SER  16           2HB      SER  16   2.030  -3.724  -3.310
   94    HG   SER  16           HG       SER  16  -0.213  -3.669  -3.096
   95    H    GLU  17           H        GLU  17   2.979  -0.325  -1.591
   96    HA   GLU  17           HA       GLU  17   5.601  -1.183  -1.714
   97    HB2  GLU  17           1HB      GLU  17   4.418   1.273  -0.421
   98    HB3  GLU  17           2HB      GLU  17   6.149   1.020  -0.589
   99    HG2  GLU  17           1HG      GLU  17   5.536   2.382  -2.391
  100    HG3  GLU  17           2HG      GLU  17   5.738   0.768  -3.070
  101    H    CYS  18           H        CYS  18   3.595  -0.626   1.153
  102    HA   CYS  18           HA       CYS  18   5.652  -1.995   2.760
  103    HB2  CYS  18           1HB      CYS  18   4.849  -0.739   4.698
  104    HB3  CYS  18           2HB      CYS  18   5.349   0.358   3.415
  105    H    GLY  19           H        GLY  19   2.201  -1.615   2.140
  106    HA2  GLY  19           1HA      GLY  19   0.925  -3.729   2.079
  107    HA3  GLY  19           2HA      GLY  19   1.762  -4.171   3.560
  108    H    LYS  20           H        LYS  20   0.826  -0.888   3.280
  109    HA   LYS  20           HA       LYS  20  -0.834  -1.019   5.570
  110    HB2  LYS  20           1HB      LYS  20   0.514   0.976   4.459
  111    HB3  LYS  20           2HB      LYS  20  -1.031   1.277   3.674
  112    HG2  LYS  20           1HG      LYS  20  -1.298   2.578   5.510
  113    HG3  LYS  20           2HG      LYS  20  -1.917   1.057   6.159
  114    HD2  LYS  20           1HD      LYS  20   0.995   1.662   6.397
  115    HD3  LYS  20           2HD      LYS  20  -0.140   2.459   7.488
  116    HE2  LYS  20           1HE      LYS  20  -1.040   0.182   8.048
  117    HE3  LYS  20           2HE      LYS  20   0.301  -0.500   7.130
  118    HZ1  LYS  20           3HZ      LYS  20   1.723  -0.095   8.783
  119    HZ2  LYS  20           1HZ      LYS  20   0.359   0.106   9.763
  120    HZ3  LYS  20           2HZ      LYS  20   1.113   1.455   9.077
  121    H    ALA  21           H        ALA  21  -3.100  -0.348   5.676
  122    HA   ALA  21           HA       ALA  21  -4.641  -0.972   3.253
  123    HB1  ALA  21           3HB      ALA  21  -4.775  -3.011   4.395
  124    HB2  ALA  21           1HB      ALA  21  -4.948  -2.224   5.963
  125    HB3  ALA  21           2HB      ALA  21  -6.275  -2.178   4.802
  126    H    PHE  22           H        PHE  22  -6.513   0.181   2.985
  127    HA   PHE  22           HA       PHE  22  -7.367   1.966   5.145
  128    HB2  PHE  22           1HB      PHE  22  -6.885   2.904   2.309
  129    HB3  PHE  22           2HB      PHE  22  -7.465   3.885   3.651
  130    HD1  PHE  22           HD2      PHE  22  -5.936   4.339   5.578
  131    HD2  PHE  22           HD1      PHE  22  -4.590   2.546   1.960
  132    HE1  PHE  22           HE2      PHE  22  -3.616   4.918   6.158
  133    HE2  PHE  22           HE1      PHE  22  -2.268   3.122   2.534
  134    HZ   PHE  22           HZ       PHE  22  -1.779   4.311   4.634
  135    H    HIS  23           H        HIS  23  -9.402   3.261   4.201
  136    HA   HIS  23           HA       HIS  23 -11.191   1.190   3.118
  137    HB2  HIS  23           1HB      HIS  23 -12.091   3.660   4.587
  138    HB3  HIS  23           2HB      HIS  23 -12.975   2.160   4.325
  139    HD1  HIS  23           HD1      HIS  23 -11.240   0.041   5.429
  140    HD2  HIS  23           HD2      HIS  23 -11.518   3.781   7.217
  141    HE1  HIS  23           HE1      HIS  23 -10.527  -0.300   7.816
  142    H    ARG  24           H        ARG  24 -10.474   4.663   2.975
  143    HA   ARG  24           HA       ARG  24 -11.893   4.784   0.399
  144    HB2  ARG  24           1HB      ARG  24 -11.153   7.033   2.281
  145    HB3  ARG  24           2HB      ARG  24 -12.021   7.213   0.762
  146    HG2  ARG  24           1HG      ARG  24 -13.012   5.610   3.108
  147    HG3  ARG  24           2HG      ARG  24 -13.477   7.276   2.759
  148    HD2  ARG  24           1HD      ARG  24 -14.455   6.610   0.659
  149    HD3  ARG  24           2HD      ARG  24 -13.874   4.959   0.873
  150    HE   ARG  24           HE       ARG  24 -15.642   4.550   2.274
  151   HH11  ARG  24          1HH1      ARG  24 -15.328   7.983   1.783
  152   HH12  ARG  24          2HH1      ARG  24 -16.823   8.364   2.571
  153   HH21  ARG  24          1HH2      ARG  24 -17.612   5.040   3.314
  154   HH22  ARG  24          2HH2      ARG  24 -18.121   6.690   3.442
  155    H    HIS  25           H        HIS  25 -10.851   5.429  -1.420
  156    HA   HIS  25           HA       HIS  25  -8.175   5.037  -1.788
  157    HB2  HIS  25           1HB      HIS  25 -10.016   5.442  -3.535
  158    HB3  HIS  25           2HB      HIS  25  -9.652   7.154  -3.341
  159    HD1  HIS  25           HD1      HIS  25  -9.205   5.751  -6.039
  160    HD2  HIS  25           HD2      HIS  25  -6.268   6.215  -3.138
  161    HE1  HIS  25           HE1      HIS  25  -7.017   5.604  -7.268
  162    H    THR  26           H        THR  26  -9.768   8.130  -1.079
  163    HA   THR  26           HA       THR  26  -7.753   9.923  -1.263
  164    HB   THR  26           HB       THR  26  -9.750   9.730   0.999
  165    HG1  THR  26           HG1      THR  26 -10.671  11.495  -0.406
  166   HG21  THR  26          3HG2      THR  26  -8.903  11.586   1.901
  167   HG22  THR  26          1HG2      THR  26  -8.863  12.398   0.336
  168   HG23  THR  26          2HG2      THR  26  -7.508  11.389   0.841
  169    H    HIS  27           H        HIS  27  -8.413   8.094   1.733
  170    HA   HIS  27           HA       HIS  27  -6.168   8.899   3.152
  171    HB2  HIS  27           1HB      HIS  27  -7.739   6.323   3.262
  172    HB3  HIS  27           2HB      HIS  27  -6.466   6.722   4.413
  173    HD1  HIS  27           HD1      HIS  27  -8.417   6.583   6.226
  174    HD2  HIS  27           HD2      HIS  27  -8.685   9.720   3.515
  175    HE1  HIS  27           HE1      HIS  27 -10.056   8.203   7.232
  176    H    LEU  28           H        LEU  28  -6.557   6.169   0.931
  177    HA   LEU  28           HA       LEU  28  -4.058   4.980   1.312
  178    HB2  LEU  28           1HB      LEU  28  -5.598   3.716   0.116
  179    HB3  LEU  28           2HB      LEU  28  -5.995   5.049  -0.967
  180    HG   LEU  28           HG       LEU  28  -3.738   4.781  -2.003
  181   HD11  LEU  28          1HD1      LEU  28  -3.591   2.653   0.053
  182   HD12  LEU  28          2HD1      LEU  28  -2.325   3.690  -0.601
  183   HD13  LEU  28          3HD1      LEU  28  -2.898   2.306  -1.530
  184   HD21  LEU  28          3HD2      LEU  28  -4.550   3.299  -3.511
  185   HD22  LEU  28          1HD2      LEU  28  -6.035   3.547  -2.593
  186   HD23  LEU  28          2HD2      LEU  28  -5.029   2.133  -2.276
  187    H    ASN  29           H        ASN  29  -5.053   7.287  -1.221
  188    HA   ASN  29           HA       ASN  29  -2.542   7.604  -2.398
  189    HB2  ASN  29           1HB      ASN  29  -4.705   8.386  -3.369
  190    HB3  ASN  29           2HB      ASN  29  -4.713   9.701  -2.197
  191   HD21  ASN  29          1HD2      ASN  29  -4.511  11.395  -3.546
  192   HD22  ASN  29          2HD2      ASN  29  -3.148  11.667  -4.573
  193    H    GLU  30           H        GLU  30  -3.994   9.183   0.386
  194    HA   GLU  30           HA       GLU  30  -2.096  11.245   0.689
  195    HB2  GLU  30           1HB      GLU  30  -3.975   9.886   2.609
  196    HB3  GLU  30           2HB      GLU  30  -2.884  11.161   3.133
  197    HG2  GLU  30           1HG      GLU  30  -3.903  12.608   1.341
  198    HG3  GLU  30           2HG      GLU  30  -5.124  11.352   1.143
  199    H    HIS  31           H        HIS  31  -2.311   8.021   2.171
  200    HA   HIS  31           HA       HIS  31  -0.030   8.193   3.774
  201    HB2  HIS  31           1HB      HIS  31  -1.344   6.357   4.279
  202    HB3  HIS  31           2HB      HIS  31  -1.589   5.934   2.587
  203    HD1  HIS  31           HD1      HIS  31   1.050   5.730   5.288
  204    HD2  HIS  31           HD2      HIS  31   0.123   4.034   1.610
  205    HE1  HIS  31           HE1      HIS  31   2.681   3.839   4.990
  206    H    ARG  32           H        ARG  32  -0.405   7.164   0.410
  207    HA   ARG  32           HA       ARG  32   2.115   6.170  -0.101
  208    HB2  ARG  32           1HB      ARG  32   0.146   7.659  -1.811
  209    HB3  ARG  32           2HB      ARG  32   1.705   7.172  -2.463
  210    HG2  ARG  32           1HG      ARG  32   1.221   4.883  -2.188
  211    HG3  ARG  32           2HG      ARG  32  -0.173   5.226  -1.161
  212    HD2  ARG  32           1HD      ARG  32  -1.489   5.886  -2.944
  213    HD3  ARG  32           2HD      ARG  32  -0.099   6.265  -3.960
  214    HE   ARG  32           HE       ARG  32  -1.453   3.782  -3.806
  215   HH11  ARG  32          1HH1      ARG  32   1.720   5.169  -4.164
  216   HH12  ARG  32          2HH1      ARG  32   2.356   3.814  -5.038
  217   HH21  ARG  32          1HH2      ARG  32  -0.627   1.993  -4.956
  218   HH22  ARG  32          2HH2      ARG  32   1.020   2.009  -5.488
  219    H    ARG  33           H        ARG  33   1.246   9.353   0.730
  220    HA   ARG  33           HA       ARG  33   3.090  10.936  -0.582
  221    HB2  ARG  33           1HB      ARG  33   1.870  11.097   2.158
  222    HB3  ARG  33           2HB      ARG  33   3.050  12.290   1.632
  223    HG2  ARG  33           1HG      ARG  33   1.599  12.788  -0.318
  224    HG3  ARG  33           2HG      ARG  33   0.393  11.689   0.355
  225    HD2  ARG  33           1HD      ARG  33  -0.309  13.777   1.100
  226    HD3  ARG  33           2HD      ARG  33   0.578  13.129   2.479
  227    HE   ARG  33           HE       ARG  33   2.117  14.803   2.229
  228   HH11  ARG  33          1HH1      ARG  33   0.208  14.569  -0.673
  229   HH12  ARG  33          2HH1      ARG  33   0.873  16.004  -1.382
  230   HH21  ARG  33          1HH2      ARG  33   2.999  16.694   1.306
  231   HH22  ARG  33          2HH2      ARG  33   2.461  17.211  -0.255
  232    H    ILE  34           H        ILE  34   3.543   8.853   2.219
  233    HA   ILE  34           HA       ILE  34   6.221   9.729   2.739
  234    HB   ILE  34           HB       ILE  34   6.346   7.933   4.339
  235   HG12  ILE  34          1HG1      ILE  34   3.623   6.924   3.648
  236   HG13  ILE  34          2HG1      ILE  34   4.979   6.402   2.654
  237   HG21  ILE  34          1HG2      ILE  34   4.033   8.356   5.509
  238   HG22  ILE  34          2HG2      ILE  34   5.218   9.651   5.351
  239   HG23  ILE  34          3HG2      ILE  34   3.856   9.561   4.234
  240   HD11  ILE  34          3HD1      ILE  34   4.419   5.856   5.531
  241   HD12  ILE  34          1HD1      ILE  34   4.847   4.738   4.236
  242   HD13  ILE  34          2HD1      ILE  34   6.074   5.802   4.924
  243    H    HIS  35           H        HIS  35   4.755   7.443   0.622
  244    HA   HIS  35           HA       HIS  35   7.192   5.924   0.214
  245    HB2  HIS  35           1HB      HIS  35   4.415   5.779  -0.938
  246    HB3  HIS  35           2HB      HIS  35   5.743   4.855  -1.635
  247    HD1  HIS  35           HD1      HIS  35   7.118   3.958   0.991
  248    HD2  HIS  35           HD2      HIS  35   3.027   3.776   0.289
  249    HE1  HIS  35           HE1      HIS  35   6.247   2.189   2.552
  250    H    THR  36           H        THR  36   5.513   8.598  -1.206
  251    HA   THR  36           HA       THR  36   7.204   8.513  -3.597
  252    HB   THR  36           HB       THR  36   4.697   8.926  -3.754
  253    HG1  THR  36           HG1      THR  36   6.060  11.112  -4.876
  254   HG21  THR  36          3HG2      THR  36   3.898  11.170  -3.327
  255   HG22  THR  36          1HG2      THR  36   5.499  11.674  -2.790
  256   HG23  THR  36          2HG2      THR  36   4.579  10.504  -1.844
  257    H    GLY  37           H        GLY  37   6.712  10.275  -0.639
  258    HA2  GLY  37           1HA      GLY  37   8.778  12.213  -1.478
  259    HA3  GLY  37           2HA      GLY  37   7.526  12.558  -0.293
  260    H    TYR  38           H        TYR  38  10.706  11.581  -0.749
  261    HA   TYR  38           HA       TYR  38  11.067  11.229   2.101
  262    HB2  TYR  38           1HB      TYR  38  10.722   8.957   1.728
  263    HB3  TYR  38           2HB      TYR  38  11.454   9.004   0.128
  264    HD1  TYR  38           HD1      TYR  38  12.410   9.565   3.701
  265    HD2  TYR  38           HD2      TYR  38  13.551   8.075  -0.118
  266    HE1  TYR  38           HE1      TYR  38  14.529   8.760   4.655
  267    HE2  TYR  38           HE2      TYR  38  15.673   7.265   0.826
  268    HH   TYR  38           HH       TYR  38  16.723   8.130   3.996
  269    H    ARG  39           H        ARG  39  12.990  12.000   2.763
  270    HA   ARG  39           HA       ARG  39  15.126  12.363   0.784
  271    HB2  ARG  39           1HB      ARG  39  15.513  14.638   1.454
  272    HB3  ARG  39           2HB      ARG  39  13.821  14.478   1.001
  273    HG2  ARG  39           1HG      ARG  39  14.693  14.257   3.858
  274    HG3  ARG  39           2HG      ARG  39  14.393  15.823   3.100
  275    HD2  ARG  39           1HD      ARG  39  12.137  14.748   2.386
  276    HD3  ARG  39           2HD      ARG  39  12.480  13.596   3.677
  277    HE   ARG  39           HE       ARG  39  11.952  15.214   5.201
  278   HH11  ARG  39          1HH1      ARG  39  12.563  16.722   2.123
  279   HH12  ARG  39          2HH1      ARG  39  12.062  18.295   2.647
  280   HH21  ARG  39          1HH2      ARG  39  11.289  17.281   5.903
  281   HH22  ARG  39          2HH2      ARG  39  11.338  18.612   4.797
  282    HA   PRO  40           HA       PRO  40  17.688  10.763   3.985
  283    HB2  PRO  40           1HB      PRO  40  20.088  11.703   3.131
  284    HB3  PRO  40           2HB      PRO  40  19.242  10.369   2.339
  285    HG2  PRO  40           1HG      PRO  40  19.356  13.261   1.573
  286    HG3  PRO  40           2HG      PRO  40  19.479  11.824   0.540
  287    HD2  PRO  40           1HD      PRO  40  17.195  13.260   0.773
  288    HD3  PRO  40           2HD      PRO  40  17.196  11.507   0.496
  289    H    SER  41           H        SER  41  18.191  11.419   5.985
  290    HA   SER  41           HA       SER  41  18.300  14.286   6.522
  291    HB2  SER  41           1HB      SER  41  16.867  12.500   7.808
  292    HB3  SER  41           2HB      SER  41  18.374  12.199   8.673
  293    HG   SER  41           HG       SER  41  16.681  14.381   8.761
  294    H    GLY  42           H        GLY  42  20.420  14.651   5.693
  295    HA2  GLY  42           1HA      GLY  42  22.494  13.971   7.650
  296    HA3  GLY  42           2HA      GLY  42  22.782  13.557   5.966
  297    HA   PRO  43           HA       PRO  43  24.316  17.565   5.096
  298    HB2  PRO  43           1HB      PRO  43  23.184  18.192   2.709
  299    HB3  PRO  43           2HB      PRO  43  24.448  16.967   2.881
  300    HG2  PRO  43           1HG      PRO  43  21.483  16.613   2.665
  301    HG3  PRO  43           2HG      PRO  43  22.780  15.692   1.882
  302    HD2  PRO  43           1HD      PRO  43  21.475  14.792   4.077
  303    HD3  PRO  43           2HD      PRO  43  23.181  14.418   3.760
  304    H    SER  44           H        SER  44  20.812  17.251   4.795
  305    HA   SER  44           HA       SER  44  20.416  19.706   6.244
  306    HB2  SER  44           1HB      SER  44  19.107  20.848   4.530
  307    HB3  SER  44           2HB      SER  44  20.737  20.540   3.932
  308    HG   SER  44           HG       SER  44  19.526  18.463   3.159
  309    H    SER  45           H        SER  45  18.784  19.342   7.581
  310    HA   SER  45           HA       SER  45  16.640  17.511   6.721
  311    HB2  SER  45           1HB      SER  45  16.428  16.849   9.120
  312    HB3  SER  45           2HB      SER  45  17.979  16.403   8.410
  313    HG   SER  45           HG       SER  45  18.828  18.344   9.373
  314    H    GLY  46           H        GLY  46  17.322  19.966   9.227
  315    HA2  GLY  46           1HA      GLY  46  14.695  20.679   9.771
  316    HA3  GLY  46           2HA      GLY  46  16.077  21.746   9.968
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1  -9.985 -29.595  15.863
    2    HA2  GLY   1           1HA      GLY   1  -7.376 -29.114  17.135
    3    HA3  GLY   1           2HA      GLY   1  -7.572 -28.777  15.422
    4    H    SER   2           H        SER   2  -7.102 -26.581  15.717
    5    HA   SER   2           HA       SER   2  -9.330 -25.048  16.868
    6    HB2  SER   2           1HB      SER   2  -7.056 -25.165  18.227
    7    HB3  SER   2           2HB      SER   2  -6.565 -23.932  17.065
    8    HG   SER   2           HG       SER   2  -8.701 -22.937  17.723
    9    H    SER   3           H        SER   3  -9.519 -22.858  16.009
   10    HA   SER   3           HA       SER   3  -8.144 -22.363  13.482
   11    HB2  SER   3           1HB      SER   3 -10.311 -23.650  13.062
   12    HB3  SER   3           2HB      SER   3 -11.155 -22.206  13.620
   13    HG   SER   3           HG       SER   3  -9.221 -22.119  11.559
   14    H    GLY   4           H        GLY   4  -8.817 -20.158  12.586
   15    HA2  GLY   4           1HA      GLY   4  -9.341 -18.303  14.826
   16    HA3  GLY   4           2HA      GLY   4  -8.062 -18.006  13.658
   17    H    SER   5           H        SER   5 -10.058 -16.144  14.156
   18    HA   SER   5           HA       SER   5 -11.643 -16.265  11.673
   19    HB2  SER   5           1HB      SER   5 -13.294 -14.806  12.804
   20    HB3  SER   5           2HB      SER   5 -13.090 -16.346  13.639
   21    HG   SER   5           HG       SER   5 -13.089 -14.430  15.007
   22    H    SER   6           H        SER   6 -10.969 -14.891  10.181
   23    HA   SER   6           HA       SER   6  -9.131 -12.782  10.772
   24    HB2  SER   6           1HB      SER   6 -10.590 -13.497   8.218
   25    HB3  SER   6           2HB      SER   6  -9.326 -12.273   8.336
   26    HG   SER   6           HG       SER   6  -8.747 -14.805   9.339
   27    H    GLY   7           H        GLY   7 -12.434 -12.789   9.415
   28    HA2  GLY   7           1HA      GLY   7 -13.944 -11.166  10.656
   29    HA3  GLY   7           2HA      GLY   7 -12.690  -9.987  10.305
   30    H    SER   8           H        SER   8 -14.653  -8.913   9.349
   31    HA   SER   8           HA       SER   8 -14.945  -9.758   6.542
   32    HB2  SER   8           1HB      SER   8 -17.064  -8.601   8.366
   33    HB3  SER   8           2HB      SER   8 -17.258  -8.798   6.624
   34    HG   SER   8           HG       SER   8 -16.525 -11.115   7.301
   35    H    GLY   9           H        GLY   9 -15.614  -7.944   5.087
   36    HA2  GLY   9           1HA      GLY   9 -15.615  -5.284   5.529
   37    HA3  GLY   9           2HA      GLY   9 -13.902  -5.668   5.604
   38    H    GLU  10           H        GLU  10 -13.903  -4.113   3.761
   39    HA   GLU  10           HA       GLU  10 -14.620  -5.449   1.236
   40    HB2  GLU  10           1HB      GLU  10 -15.705  -3.236   1.712
   41    HB3  GLU  10           2HB      GLU  10 -14.107  -2.503   1.667
   42    HG2  GLU  10           1HG      GLU  10 -14.907  -2.103  -0.455
   43    HG3  GLU  10           2HG      GLU  10 -13.939  -3.559  -0.679
   44    H    LYS  11           H        LYS  11 -12.182  -3.212   2.570
   45    HA   LYS  11           HA       LYS  11  -9.979  -2.901   2.080
   46    HB2  LYS  11           1HB      LYS  11  -9.954  -5.167   3.147
   47    HB3  LYS  11           2HB      LYS  11 -10.016  -5.874   1.537
   48    HG2  LYS  11           1HG      LYS  11  -7.871  -5.100   0.994
   49    HG3  LYS  11           2HG      LYS  11  -7.846  -3.969   2.348
   50    HD2  LYS  11           1HD      LYS  11  -6.533  -5.647   3.193
   51    HD3  LYS  11           2HD      LYS  11  -8.118  -6.176   3.761
   52    HE2  LYS  11           1HE      LYS  11  -6.756  -7.131   1.244
   53    HE3  LYS  11           2HE      LYS  11  -6.808  -8.012   2.771
   54    HZ1  LYS  11           3HZ      LYS  11  -8.866  -7.673   0.761
   55    HZ2  LYS  11           1HZ      LYS  11  -9.400  -7.533   2.360
   56    HZ3  LYS  11           2HZ      LYS  11  -8.614  -8.941   1.852
   57    HA   PRO  12           HA       PRO  12 -10.920  -3.219  -2.539
   58    HB2  PRO  12           1HB      PRO  12 -11.335  -0.569  -2.962
   59    HB3  PRO  12           2HB      PRO  12 -12.632  -1.687  -2.520
   60    HG2  PRO  12           1HG      PRO  12 -11.092   0.208  -0.788
   61    HG3  PRO  12           2HG      PRO  12 -12.833  -0.133  -0.802
   62    HD2  PRO  12           1HD      PRO  12 -11.151  -1.211   1.027
   63    HD3  PRO  12           2HD      PRO  12 -12.591  -2.064   0.434
   64    H    TYR  13           H        TYR  13  -9.234  -0.617  -0.782
   65    HA   TYR  13           HA       TYR  13  -7.098  -0.727  -2.802
   66    HB2  TYR  13           1HB      TYR  13  -7.437   1.472  -0.776
   67    HB3  TYR  13           2HB      TYR  13  -6.570   1.515  -2.307
   68    HD1  TYR  13           HD1      TYR  13  -7.770   1.797  -4.411
   69    HD2  TYR  13           HD2      TYR  13  -9.839   1.767  -0.694
   70    HE1  TYR  13           HE1      TYR  13  -9.754   2.744  -5.515
   71    HE2  TYR  13           HE2      TYR  13 -11.829   2.713  -1.787
   72    HH   TYR  13           HH       TYR  13 -12.627   2.607  -4.567
   73    H    LYS  14           H        LYS  14  -5.021  -1.149  -2.227
   74    HA   LYS  14           HA       LYS  14  -4.287  -1.302   0.584
   75    HB2  LYS  14           1HB      LYS  14  -5.251  -3.546  -0.150
   76    HB3  LYS  14           2HB      LYS  14  -3.845  -3.695  -1.196
   77    HG2  LYS  14           1HG      LYS  14  -2.552  -3.198   1.046
   78    HG3  LYS  14           2HG      LYS  14  -4.035  -3.832   1.763
   79    HD2  LYS  14           1HD      LYS  14  -3.804  -5.894   0.548
   80    HD3  LYS  14           2HD      LYS  14  -2.431  -5.256  -0.359
   81    HE2  LYS  14           1HE      LYS  14  -2.487  -5.646   2.632
   82    HE3  LYS  14           2HE      LYS  14  -1.783  -6.786   1.486
   83    HZ1  LYS  14           3HZ      LYS  14  -0.445  -4.721   0.727
   84    HZ2  LYS  14           1HZ      LYS  14   0.030  -5.553   2.122
   85    HZ3  LYS  14           2HZ      LYS  14  -0.840  -4.108   2.254
   86    H    CYS  15           H        CYS  15  -2.282  -0.572   0.876
   87    HA   CYS  15           HA       CYS  15  -0.703   0.275  -1.333
   88    HB2  CYS  15           1HB      CYS  15  -0.687   1.504   0.775
   89    HB3  CYS  15           2HB      CYS  15  -0.031   0.102   1.612
   90    H    SER  16           H        SER  16   1.461  -0.385  -1.840
   91    HA   SER  16           HA       SER  16   1.941  -3.234  -1.261
   92    HB2  SER  16           1HB      SER  16   2.485  -1.592  -3.731
   93    HB3  SER  16           2HB      SER  16   3.275  -3.143  -3.451
   94    HG   SER  16           HG       SER  16   0.859  -3.739  -3.029
   95    H    GLU  17           H        GLU  17   3.363  -0.041  -1.489
   96    HA   GLU  17           HA       GLU  17   6.055  -0.590  -1.297
   97    HB2  GLU  17           1HB      GLU  17   4.430   1.636  -0.072
   98    HB3  GLU  17           2HB      GLU  17   6.185   1.588   0.009
   99    HG2  GLU  17           1HG      GLU  17   4.516   1.694  -2.492
  100    HG3  GLU  17           2HG      GLU  17   5.459   3.012  -1.800
  101    H    CYS  18           H        CYS  18   3.796  -0.118   1.421
  102    HA   CYS  18           HA       CYS  18   5.748  -1.446   3.176
  103    HB2  CYS  18           1HB      CYS  18   4.498  -0.403   5.042
  104    HB3  CYS  18           2HB      CYS  18   5.146   0.788   3.919
  105    H    GLY  19           H        GLY  19   2.306  -1.356   2.326
  106    HA2  GLY  19           1HA      GLY  19   1.201  -3.518   1.995
  107    HA3  GLY  19           2HA      GLY  19   2.085  -4.101   3.397
  108    H    LYS  20           H        LYS  20   0.433  -0.998   3.089
  109    HA   LYS  20           HA       LYS  20  -1.158  -1.677   5.443
  110    HB2  LYS  20           1HB      LYS  20  -0.318   0.862   4.121
  111    HB3  LYS  20           2HB      LYS  20  -1.801   0.870   5.067
  112    HG2  LYS  20           1HG      LYS  20  -0.381  -0.176   6.930
  113    HG3  LYS  20           2HG      LYS  20   1.005   0.357   5.976
  114    HD2  LYS  20           1HD      LYS  20   0.061   2.661   6.011
  115    HD3  LYS  20           2HD      LYS  20  -1.199   2.082   7.103
  116    HE2  LYS  20           1HE      LYS  20   0.383   2.976   8.549
  117    HE3  LYS  20           2HE      LYS  20   0.759   1.254   8.562
  118    HZ1  LYS  20           3HZ      LYS  20   2.754   1.622   7.676
  119    HZ2  LYS  20           1HZ      LYS  20   2.524   3.252   8.068
  120    HZ3  LYS  20           2HZ      LYS  20   2.157   2.696   6.513
  121    H    ALA  21           H        ALA  21  -3.404  -0.371   5.325
  122    HA   ALA  21           HA       ALA  21  -4.700  -0.742   2.744
  123    HB1  ALA  21           3HB      ALA  21  -5.086  -2.529   5.049
  124    HB2  ALA  21           1HB      ALA  21  -6.563  -1.961   4.271
  125    HB3  ALA  21           2HB      ALA  21  -5.344  -2.819   3.329
  126    H    PHE  22           H        PHE  22  -6.528   0.501   2.468
  127    HA   PHE  22           HA       PHE  22  -7.478   2.063   4.759
  128    HB2  PHE  22           1HB      PHE  22  -6.707   3.256   2.088
  129    HB3  PHE  22           2HB      PHE  22  -7.443   4.129   3.428
  130    HD1  PHE  22           HD2      PHE  22  -6.163   4.431   5.543
  131    HD2  PHE  22           HD1      PHE  22  -4.387   2.851   2.012
  132    HE1  PHE  22           HE2      PHE  22  -3.929   4.920   6.451
  133    HE2  PHE  22           HE1      PHE  22  -2.151   3.337   2.915
  134    HZ   PHE  22           HZ       PHE  22  -1.919   4.373   5.137
  135    H    HIS  23           H        HIS  23  -9.621   2.047   4.882
  136    HA   HIS  23           HA       HIS  23 -11.270   0.676   3.111
  137    HB2  HIS  23           1HB      HIS  23 -13.083   2.234   4.292
  138    HB3  HIS  23           2HB      HIS  23 -12.298   0.907   5.143
  139    HD1  HIS  23           HD1      HIS  23 -12.205   1.819   7.470
  140    HD2  HIS  23           HD2      HIS  23 -10.739   4.500   4.655
  141    HE1  HIS  23           HE1      HIS  23 -11.219   3.715   8.796
  142    H    ARG  24           H        ARG  24 -10.070   3.902   2.973
  143    HA   ARG  24           HA       ARG  24 -11.745   4.401   0.603
  144    HB2  ARG  24           1HB      ARG  24 -11.013   6.266   2.845
  145    HB3  ARG  24           2HB      ARG  24 -11.434   6.883   1.253
  146    HG2  ARG  24           1HG      ARG  24 -13.479   6.961   2.229
  147    HG3  ARG  24           2HG      ARG  24 -13.534   5.313   1.600
  148    HD2  ARG  24           1HD      ARG  24 -14.262   5.099   3.807
  149    HD3  ARG  24           2HD      ARG  24 -12.566   4.622   3.870
  150    HE   ARG  24           HE       ARG  24 -12.102   6.505   5.120
  151   HH11  ARG  24          1HH1      ARG  24 -15.356   6.651   3.892
  152   HH12  ARG  24          2HH1      ARG  24 -15.811   7.994   4.888
  153   HH21  ARG  24          1HH2      ARG  24 -12.688   8.273   6.437
  154   HH22  ARG  24          2HH2      ARG  24 -14.292   8.916   6.334
  155    H    HIS  25           H        HIS  25 -10.746   5.289  -1.168
  156    HA   HIS  25           HA       HIS  25  -8.022   4.806  -1.549
  157    HB2  HIS  25           1HB      HIS  25  -9.738   4.999  -3.358
  158    HB3  HIS  25           2HB      HIS  25  -9.733   6.744  -3.118
  159    HD1  HIS  25           HD1      HIS  25  -8.617   4.673  -5.546
  160    HD2  HIS  25           HD2      HIS  25  -6.571   7.365  -3.131
  161    HE1  HIS  25           HE1      HIS  25  -6.502   5.222  -6.791
  162    H    THR  26           H        THR  26  -9.675   7.950  -1.223
  163    HA   THR  26           HA       THR  26  -7.721   9.752  -1.360
  164    HB   THR  26           HB       THR  26  -9.699   9.656   0.927
  165    HG1  THR  26           HG1      THR  26 -10.172  11.339  -1.197
  166   HG21  THR  26          3HG2      THR  26  -8.129  11.304   1.508
  167   HG22  THR  26          1HG2      THR  26  -9.428  12.197   0.719
  168   HG23  THR  26          2HG2      THR  26  -7.943  11.840  -0.162
  169    H    HIS  27           H        HIS  27  -8.356   7.949   1.654
  170    HA   HIS  27           HA       HIS  27  -6.249   8.912   3.161
  171    HB2  HIS  27           1HB      HIS  27  -7.666   6.258   3.154
  172    HB3  HIS  27           2HB      HIS  27  -6.360   6.591   4.287
  173    HD1  HIS  27           HD1      HIS  27  -9.174   6.051   5.341
  174    HD2  HIS  27           HD2      HIS  27  -7.714   9.849   4.505
  175    HE1  HIS  27           HE1      HIS  27 -10.563   7.625   6.726
  176    H    LEU  28           H        LEU  28  -6.282   6.105   0.983
  177    HA   LEU  28           HA       LEU  28  -3.666   5.244   1.417
  178    HB2  LEU  28           1HB      LEU  28  -5.046   3.783   0.238
  179    HB3  LEU  28           2HB      LEU  28  -5.547   5.029  -0.903
  180    HG   LEU  28           HG       LEU  28  -3.027   4.939  -1.630
  181   HD11  LEU  28          1HD1      LEU  28  -3.403   2.479  -0.008
  182   HD12  LEU  28          2HD1      LEU  28  -1.968   3.479  -0.236
  183   HD13  LEU  28          3HD1      LEU  28  -2.473   2.360  -1.502
  184   HD21  LEU  28          3HD2      LEU  28  -4.930   4.410  -3.060
  185   HD22  LEU  28          1HD2      LEU  28  -5.023   2.796  -2.355
  186   HD23  LEU  28          2HD2      LEU  28  -3.614   3.261  -3.309
  187    H    ASN  29           H        ASN  29  -4.837   7.197  -1.334
  188    HA   ASN  29           HA       ASN  29  -2.518   7.813  -2.579
  189    HB2  ASN  29           1HB      ASN  29  -4.790   8.617  -3.242
  190    HB3  ASN  29           2HB      ASN  29  -4.672   9.855  -1.995
  191   HD21  ASN  29          1HD2      ASN  29  -4.214  11.751  -2.818
  192   HD22  ASN  29          2HD2      ASN  29  -3.147  12.063  -4.141
  193    H    GLU  30           H        GLU  30  -3.835   9.608   0.202
  194    HA   GLU  30           HA       GLU  30  -1.776  11.465   0.463
  195    HB2  GLU  30           1HB      GLU  30  -4.078  11.214   1.707
  196    HB3  GLU  30           2HB      GLU  30  -3.114  10.348   2.895
  197    HG2  GLU  30           1HG      GLU  30  -1.587  12.414   2.853
  198    HG3  GLU  30           2HG      GLU  30  -2.947  13.218   2.070
  199    H    HIS  31           H        HIS  31  -2.191   8.415   2.268
  200    HA   HIS  31           HA       HIS  31   0.142   8.429   3.717
  201    HB2  HIS  31           1HB      HIS  31  -1.232   6.665   4.280
  202    HB3  HIS  31           2HB      HIS  31  -1.571   6.254   2.602
  203    HD1  HIS  31           HD1      HIS  31   1.067   5.814   5.256
  204    HD2  HIS  31           HD2      HIS  31   0.073   4.331   1.504
  205    HE1  HIS  31           HE1      HIS  31   2.589   3.846   4.885
  206    H    ARG  32           H        ARG  32  -0.322   7.078   0.455
  207    HA   ARG  32           HA       ARG  32   2.131   6.048  -0.082
  208    HB2  ARG  32           1HB      ARG  32   0.431   7.729  -1.932
  209    HB3  ARG  32           2HB      ARG  32   1.772   6.717  -2.454
  210    HG2  ARG  32           1HG      ARG  32   0.494   4.797  -1.324
  211    HG3  ARG  32           2HG      ARG  32  -0.888   5.895  -1.357
  212    HD2  ARG  32           1HD      ARG  32  -0.775   6.063  -3.744
  213    HD3  ARG  32           2HD      ARG  32   0.743   5.168  -3.783
  214    HE   ARG  32           HE       ARG  32  -1.504   3.747  -2.642
  215   HH11  ARG  32          1HH1      ARG  32   0.369   4.433  -5.495
  216   HH12  ARG  32          2HH1      ARG  32  -0.133   2.999  -6.328
  217   HH21  ARG  32          1HH2      ARG  32  -2.171   1.855  -3.728
  218   HH22  ARG  32          2HH2      ARG  32  -1.578   1.534  -5.322
  219    H    ARG  33           H        ARG  33   1.310   9.415   0.261
  220    HA   ARG  33           HA       ARG  33   3.412  10.676  -1.003
  221    HB2  ARG  33           1HB      ARG  33   2.075  11.407   1.608
  222    HB3  ARG  33           2HB      ARG  33   3.131  12.479   0.697
  223    HG2  ARG  33           1HG      ARG  33   1.596  12.568  -1.124
  224    HG3  ARG  33           2HG      ARG  33   0.600  11.296  -0.414
  225    HD2  ARG  33           1HD      ARG  33  -0.377  13.524  -0.086
  226    HD3  ARG  33           2HD      ARG  33   0.025  12.744   1.443
  227    HE   ARG  33           HE       ARG  33   1.610  14.367   1.830
  228   HH11  ARG  33          1HH1      ARG  33   0.473  14.583  -1.453
  229   HH12  ARG  33          2HH1      ARG  33   1.244  16.105  -1.758
  230   HH21  ARG  33          1HH2      ARG  33   2.630  16.370   1.442
  231   HH22  ARG  33          2HH2      ARG  33   2.471  17.120  -0.111
  232    H    ILE  34           H        ILE  34   3.340   9.204   2.212
  233    HA   ILE  34           HA       ILE  34   5.859  10.033   3.097
  234    HB   ILE  34           HB       ILE  34   5.752   8.304   4.733
  235   HG12  ILE  34          1HG1      ILE  34   3.690   6.642   4.391
  236   HG13  ILE  34          2HG1      ILE  34   4.046   6.958   2.696
  237   HG21  ILE  34          1HG2      ILE  34   4.217   9.745   5.535
  238   HG22  ILE  34          2HG2      ILE  34   3.294   9.762   4.034
  239   HG23  ILE  34          3HG2      ILE  34   3.094   8.434   5.176
  240   HD11  ILE  34          3HD1      ILE  34   6.281   6.203   4.501
  241   HD12  ILE  34          1HD1      ILE  34   5.152   4.957   3.971
  242   HD13  ILE  34          2HD1      ILE  34   6.059   5.889   2.780
  243    H    HIS  35           H        HIS  35   4.933   7.570   0.836
  244    HA   HIS  35           HA       HIS  35   7.467   6.200   0.897
  245    HB2  HIS  35           1HB      HIS  35   5.043   6.006  -0.885
  246    HB3  HIS  35           2HB      HIS  35   6.511   5.084  -1.197
  247    HD1  HIS  35           HD1      HIS  35   7.271   3.947   1.422
  248    HD2  HIS  35           HD2      HIS  35   3.295   4.317   0.275
  249    HE1  HIS  35           HE1      HIS  35   6.011   2.276   2.816
  250    H    THR  36           H        THR  36   5.944   8.709  -1.013
  251    HA   THR  36           HA       THR  36   8.207   8.777  -2.862
  252    HB   THR  36           HB       THR  36   5.779   8.967  -3.641
  253    HG1  THR  36           HG1      THR  36   7.300  11.194  -4.477
  254   HG21  THR  36          3HG2      THR  36   4.652  11.029  -3.444
  255   HG22  THR  36          1HG2      THR  36   6.086  11.848  -2.828
  256   HG23  THR  36          2HG2      THR  36   5.241  10.673  -1.821
  257    H    GLY  37           H        GLY  37   9.449  10.661  -3.209
  258    HA2  GLY  37           1HA      GLY  37   9.600  13.104  -2.504
  259    HA3  GLY  37           2HA      GLY  37   9.498  12.461  -0.871
  260    H    TYR  38           H        TYR  38  11.546  13.225  -3.475
  261    HA   TYR  38           HA       TYR  38  13.739  11.540  -2.920
  262    HB2  TYR  38           1HB      TYR  38  15.000  12.942  -4.365
  263    HB3  TYR  38           2HB      TYR  38  13.362  12.932  -5.009
  264    HD1  TYR  38           HD1      TYR  38  15.789  14.933  -3.057
  265    HD2  TYR  38           HD2      TYR  38  12.117  14.937  -5.205
  266    HE1  TYR  38           HE1      TYR  38  15.753  17.391  -2.978
  267    HE2  TYR  38           HE2      TYR  38  12.070  17.395  -5.133
  268    HH   TYR  38           HH       TYR  38  14.591  19.266  -4.557
  269    H    ARG  39           H        ARG  39  15.644  11.913  -1.771
  270    HA   ARG  39           HA       ARG  39  15.325  13.729   0.495
  271    HB2  ARG  39           1HB      ARG  39  17.275  12.478   1.433
  272    HB3  ARG  39           2HB      ARG  39  15.873  11.471   1.096
  273    HG2  ARG  39           1HG      ARG  39  16.884  10.525  -0.810
  274    HG3  ARG  39           2HG      ARG  39  18.160  11.744  -0.830
  275    HD2  ARG  39           1HD      ARG  39  18.803  10.830   1.476
  276    HD3  ARG  39           2HD      ARG  39  17.779   9.453   1.071
  277    HE   ARG  39           HE       ARG  39  19.786  10.115  -0.903
  278   HH11  ARG  39          1HH1      ARG  39  18.981   8.231   1.912
  279   HH12  ARG  39          2HH1      ARG  39  20.191   7.028   1.613
  280   HH21  ARG  39          1HH2      ARG  39  21.382   8.537  -1.307
  281   HH22  ARG  39          2HH2      ARG  39  21.557   7.203  -0.217
  282    HA   PRO  40           HA       PRO  40  18.197  16.684  -1.047
  283    HB2  PRO  40           1HB      PRO  40  19.019  17.768   1.302
  284    HB3  PRO  40           2HB      PRO  40  17.424  18.078   0.606
  285    HG2  PRO  40           1HG      PRO  40  18.207  16.163   2.769
  286    HG3  PRO  40           2HG      PRO  40  16.804  17.244   2.687
  287    HD2  PRO  40           1HD      PRO  40  16.642  14.601   2.121
  288    HD3  PRO  40           2HD      PRO  40  15.624  15.813   1.317
  289    H    SER  41           H        SER  41  20.229  16.485  -1.741
  290    HA   SER  41           HA       SER  41  21.950  14.441  -0.977
  291    HB2  SER  41           1HB      SER  41  22.760  17.072  -2.236
  292    HB3  SER  41           2HB      SER  41  23.641  15.546  -2.321
  293    HG   SER  41           HG       SER  41  22.516  15.253  -4.071
  294    H    GLY  42           H        GLY  42  21.942  17.857  -0.005
  295    HA2  GLY  42           1HA      GLY  42  24.201  18.169   1.414
  296    HA3  GLY  42           2HA      GLY  42  22.659  18.771   2.003
  297    HA   PRO  43           HA       PRO  43  24.533  15.272   4.686
  298    HB2  PRO  43           1HB      PRO  43  25.761  16.765   6.592
  299    HB3  PRO  43           2HB      PRO  43  26.588  16.195   5.137
  300    HG2  PRO  43           1HG      PRO  43  25.402  18.883   5.711
  301    HG3  PRO  43           2HG      PRO  43  26.946  18.484   4.936
  302    HD2  PRO  43           1HD      PRO  43  24.748  19.197   3.524
  303    HD3  PRO  43           2HD      PRO  43  25.957  18.056   2.899
  304    H    SER  44           H        SER  44  22.496  14.773   5.408
  305    HA   SER  44           HA       SER  44  21.417  16.476   7.558
  306    HB2  SER  44           1HB      SER  44  19.888  16.625   5.731
  307    HB3  SER  44           2HB      SER  44  19.956  14.886   5.444
  308    HG   SER  44           HG       SER  44  18.988  16.029   7.850
  309    H    SER  45           H        SER  45  20.263  15.370   9.256
  310    HA   SER  45           HA       SER  45  21.462  12.770   9.835
  311    HB2  SER  45           1HB      SER  45  20.531  13.190  12.146
  312    HB3  SER  45           2HB      SER  45  21.721  14.371  11.600
  313    HG   SER  45           HG       SER  45  20.047  15.794  11.138
  314    H    GLY  46           H        GLY  46  20.245  11.327   8.646
  315    HA2  GLY  46           1HA      GLY  46  17.886  10.345   9.809
  316    HA3  GLY  46           2HA      GLY  46  17.442  11.339   8.429
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1  -7.840 -22.681  15.400
    2    HA2  GLY   1           1HA      GLY   1  -7.138 -19.965  15.479
    3    HA3  GLY   1           2HA      GLY   1  -7.016 -20.512  13.814
    4    H    SER   2           H        SER   2  -8.738 -19.806  12.746
    5    HA   SER   2           HA       SER   2 -11.351 -20.710  13.421
    6    HB2  SER   2           1HB      SER   2 -12.429 -18.627  13.921
    7    HB3  SER   2           2HB      SER   2 -11.048 -18.770  15.009
    8    HG   SER   2           HG       SER   2 -10.302 -17.001  14.180
    9    H    SER   3           H        SER   3 -13.012 -19.776  11.887
   10    HA   SER   3           HA       SER   3 -11.975 -18.586   9.463
   11    HB2  SER   3           1HB      SER   3 -12.742 -21.471   9.641
   12    HB3  SER   3           2HB      SER   3 -13.126 -20.582   8.167
   13    HG   SER   3           HG       SER   3 -10.675 -19.939   8.685
   14    H    GLY   4           H        GLY   4 -13.759 -18.294   7.822
   15    HA2  GLY   4           1HA      GLY   4 -16.472 -18.598   8.492
   16    HA3  GLY   4           2HA      GLY   4 -15.948 -17.005   9.016
   17    H    SER   5           H        SER   5 -17.934 -17.329   7.116
   18    HA   SER   5           HA       SER   5 -16.580 -16.392   4.671
   19    HB2  SER   5           1HB      SER   5 -17.669 -18.589   4.341
   20    HB3  SER   5           2HB      SER   5 -19.209 -17.887   4.837
   21    HG   SER   5           HG       SER   5 -19.047 -16.473   3.044
   22    H    SER   6           H        SER   6 -16.714 -14.220   5.001
   23    HA   SER   6           HA       SER   6 -19.387 -13.060   4.861
   24    HB2  SER   6           1HB      SER   6 -18.873 -13.082   7.261
   25    HB3  SER   6           2HB      SER   6 -17.352 -12.244   6.952
   26    HG   SER   6           HG       SER   6 -19.708 -11.081   6.005
   27    H    GLY   7           H        GLY   7 -19.427 -11.607   3.284
   28    HA2  GLY   7           1HA      GLY   7 -16.948 -10.669   2.117
   29    HA3  GLY   7           2HA      GLY   7 -18.570 -10.372   1.508
   30    H    SER   8           H        SER   8 -17.211  -9.674   4.709
   31    HA   SER   8           HA       SER   8 -18.146  -6.926   4.454
   32    HB2  SER   8           1HB      SER   8 -16.948  -8.357   6.838
   33    HB3  SER   8           2HB      SER   8 -17.691  -6.758   6.857
   34    HG   SER   8           HG       SER   8 -19.358  -7.983   7.403
   35    H    GLY   9           H        GLY   9 -15.148  -8.537   5.541
   36    HA2  GLY   9           1HA      GLY   9 -13.528  -6.280   5.620
   37    HA3  GLY   9           2HA      GLY   9 -12.948  -7.915   5.344
   38    H    GLU  10           H        GLU  10 -13.849  -4.899   3.876
   39    HA   GLU  10           HA       GLU  10 -12.775  -5.881   1.313
   40    HB2  GLU  10           1HB      GLU  10 -15.165  -4.215   1.917
   41    HB3  GLU  10           2HB      GLU  10 -14.243  -3.814   0.475
   42    HG2  GLU  10           1HG      GLU  10 -15.467  -6.490   1.107
   43    HG3  GLU  10           2HG      GLU  10 -16.084  -5.307  -0.045
   44    H    LYS  11           H        LYS  11 -10.765  -5.112   1.176
   45    HA   LYS  11           HA       LYS  11 -10.370  -2.227   1.551
   46    HB2  LYS  11           1HB      LYS  11  -8.895  -4.466   2.850
   47    HB3  LYS  11           2HB      LYS  11  -7.969  -3.056   2.350
   48    HG2  LYS  11           1HG      LYS  11  -8.988  -1.674   3.868
   49    HG3  LYS  11           2HG      LYS  11 -10.451  -2.659   3.946
   50    HD2  LYS  11           1HD      LYS  11  -9.009  -4.437   5.054
   51    HD3  LYS  11           2HD      LYS  11  -7.777  -3.184   5.222
   52    HE2  LYS  11           1HE      LYS  11 -10.594  -2.860   6.231
   53    HE3  LYS  11           2HE      LYS  11  -9.298  -3.540   7.214
   54    HZ1  LYS  11           3HZ      LYS  11  -9.770  -0.794   6.420
   55    HZ2  LYS  11           1HZ      LYS  11  -8.156  -1.296   6.334
   56    HZ3  LYS  11           2HZ      LYS  11  -8.999  -1.408   7.795
   57    HA   PRO  12           HA       PRO  12  -8.780  -3.788  -2.542
   58    HB2  PRO  12           1HB      PRO  12 -10.022  -1.886  -4.029
   59    HB3  PRO  12           2HB      PRO  12 -10.793  -3.412  -3.583
   60    HG2  PRO  12           1HG      PRO  12 -11.084  -0.707  -2.334
   61    HG3  PRO  12           2HG      PRO  12 -12.335  -1.908  -2.707
   62    HD2  PRO  12           1HD      PRO  12 -11.329  -1.578  -0.215
   63    HD3  PRO  12           2HD      PRO  12 -11.879  -3.153  -0.821
   64    H    TYR  13           H        TYR  13  -8.676  -0.910  -0.702
   65    HA   TYR  13           HA       TYR  13  -6.787   0.414  -2.481
   66    HB2  TYR  13           1HB      TYR  13  -7.562   1.394   0.253
   67    HB3  TYR  13           2HB      TYR  13  -7.039   2.328  -1.144
   68    HD1  TYR  13           HD2      TYR  13  -9.851   0.297   0.179
   69    HD2  TYR  13           HD1      TYR  13  -8.609   3.231  -2.641
   70    HE1  TYR  13           HE2      TYR  13 -12.201   0.710  -0.418
   71    HE2  TYR  13           HE1      TYR  13 -10.956   3.653  -3.245
   72    HH   TYR  13           HH       TYR  13 -13.603   2.158  -1.482
   73    H    LYS  14           H        LYS  14  -5.895  -2.047  -1.502
   74    HA   LYS  14           HA       LYS  14  -4.256  -1.774   0.802
   75    HB2  LYS  14           1HB      LYS  14  -4.964  -3.966   0.056
   76    HB3  LYS  14           2HB      LYS  14  -4.159  -3.741  -1.491
   77    HG2  LYS  14           1HG      LYS  14  -2.687  -5.095  -0.340
   78    HG3  LYS  14           2HG      LYS  14  -2.014  -3.484  -0.076
   79    HD2  LYS  14           1HD      LYS  14  -3.055  -3.379   2.114
   80    HD3  LYS  14           2HD      LYS  14  -3.826  -4.944   1.847
   81    HE2  LYS  14           1HE      LYS  14  -0.842  -4.531   1.827
   82    HE3  LYS  14           2HE      LYS  14  -1.750  -4.988   3.267
   83    HZ1  LYS  14           3HZ      LYS  14  -2.437  -6.684   1.115
   84    HZ2  LYS  14           1HZ      LYS  14  -1.747  -7.087   2.606
   85    HZ3  LYS  14           2HZ      LYS  14  -0.756  -6.666   1.302
   86    H    CYS  15           H        CYS  15  -2.115  -1.279   1.016
   87    HA   CYS  15           HA       CYS  15  -0.903   0.129  -1.232
   88    HB2  CYS  15           1HB      CYS  15  -0.890   1.341   0.839
   89    HB3  CYS  15           2HB      CYS  15  -0.196  -0.029   1.700
   90    H    SER  16           H        SER  16   0.437  -0.901  -2.542
   91    HA   SER  16           HA       SER  16   1.731  -3.361  -1.655
   92    HB2  SER  16           1HB      SER  16   2.268  -3.701  -4.021
   93    HB3  SER  16           2HB      SER  16   0.551  -3.353  -3.824
   94    HG   SER  16           HG       SER  16   2.236  -1.184  -4.260
   95    H    GLU  17           H        GLU  17   2.701  -0.995  -0.477
   96    HA   GLU  17           HA       GLU  17   5.407  -0.882  -1.638
   97    HB2  GLU  17           1HB      GLU  17   3.960   1.372  -0.237
   98    HB3  GLU  17           2HB      GLU  17   5.590   1.437  -0.891
   99    HG2  GLU  17           1HG      GLU  17   4.373   2.477  -2.535
  100    HG3  GLU  17           2HG      GLU  17   4.449   0.821  -3.132
  101    H    CYS  18           H        CYS  18   3.468  -0.561   1.312
  102    HA   CYS  18           HA       CYS  18   5.810  -1.481   2.847
  103    HB2  CYS  18           1HB      CYS  18   4.894  -0.188   4.773
  104    HB3  CYS  18           2HB      CYS  18   5.393   0.825   3.423
  105    H    GLY  19           H        GLY  19   2.254  -1.336   2.808
  106    HA2  GLY  19           1HA      GLY  19   1.235  -3.648   2.921
  107    HA3  GLY  19           2HA      GLY  19   2.235  -3.854   4.352
  108    H    LYS  20           H        LYS  20   0.124  -1.229   3.184
  109    HA   LYS  20           HA       LYS  20  -1.444  -1.502   5.656
  110    HB2  LYS  20           1HB      LYS  20  -0.101   0.942   4.564
  111    HB3  LYS  20           2HB      LYS  20  -1.609   1.112   5.453
  112    HG2  LYS  20           1HG      LYS  20  -0.670   0.281   7.430
  113    HG3  LYS  20           2HG      LYS  20   0.729  -0.387   6.585
  114    HD2  LYS  20           1HD      LYS  20   1.479   1.892   6.055
  115    HD3  LYS  20           2HD      LYS  20   0.092   2.544   6.931
  116    HE2  LYS  20           1HE      LYS  20   2.230   0.793   8.140
  117    HE3  LYS  20           2HE      LYS  20   2.187   2.552   8.256
  118    HZ1  LYS  20           3HZ      LYS  20   0.287   0.603   9.421
  119    HZ2  LYS  20           1HZ      LYS  20  -0.079   2.249   9.285
  120    HZ3  LYS  20           2HZ      LYS  20   1.234   1.751  10.227
  121    H    ALA  21           H        ALA  21  -3.536  -1.730   5.247
  122    HA   ALA  21           HA       ALA  21  -4.550  -0.952   2.606
  123    HB1  ALA  21           3HB      ALA  21  -5.078  -3.159   4.420
  124    HB2  ALA  21           1HB      ALA  21  -6.555  -2.385   3.843
  125    HB3  ALA  21           2HB      ALA  21  -5.382  -3.019   2.688
  126    H    PHE  22           H        PHE  22  -6.416   0.282   2.364
  127    HA   PHE  22           HA       PHE  22  -7.414   1.606   4.796
  128    HB2  PHE  22           1HB      PHE  22  -7.028   3.014   2.154
  129    HB3  PHE  22           2HB      PHE  22  -7.431   3.735   3.709
  130    HD1  PHE  22           HD1      PHE  22  -4.756   2.081   1.782
  131    HD2  PHE  22           HD2      PHE  22  -5.750   4.328   5.257
  132    HE1  PHE  22           HE1      PHE  22  -2.364   2.456   2.220
  133    HE2  PHE  22           HE2      PHE  22  -3.360   4.707   5.701
  134    HZ   PHE  22           HZ       PHE  22  -1.663   3.771   4.181
  135    H    HIS  23           H        HIS  23  -9.494   2.899   4.211
  136    HA   HIS  23           HA       HIS  23 -11.249   1.036   2.780
  137    HB2  HIS  23           1HB      HIS  23 -13.064   1.946   4.050
  138    HB3  HIS  23           2HB      HIS  23 -11.742   1.641   5.172
  139    HD1  HIS  23           HD1      HIS  23 -13.987   4.267   3.992
  140    HD2  HIS  23           HD2      HIS  23 -10.331   4.064   5.954
  141    HE1  HIS  23           HE1      HIS  23 -13.636   6.545   4.997
  142    H    ARG  24           H        ARG  24 -10.413   4.466   2.997
  143    HA   ARG  24           HA       ARG  24 -11.900   4.927   0.497
  144    HB2  ARG  24           1HB      ARG  24 -11.279   6.680   2.844
  145    HB3  ARG  24           2HB      ARG  24 -11.536   7.410   1.265
  146    HG2  ARG  24           1HG      ARG  24 -13.532   5.484   2.377
  147    HG3  ARG  24           2HG      ARG  24 -13.525   7.171   2.895
  148    HD2  ARG  24           1HD      ARG  24 -14.964   7.314   1.128
  149    HD3  ARG  24           2HD      ARG  24 -13.438   7.609   0.297
  150    HE   ARG  24           HE       ARG  24 -13.664   5.592  -0.782
  151   HH11  ARG  24          1HH1      ARG  24 -15.978   5.799   1.811
  152   HH12  ARG  24          2HH1      ARG  24 -16.846   4.382   1.324
  153   HH21  ARG  24          1HH2      ARG  24 -14.799   3.724  -1.433
  154   HH22  ARG  24          2HH2      ARG  24 -16.174   3.201  -0.521
  155    H    HIS  25           H        HIS  25 -10.923   6.087  -1.183
  156    HA   HIS  25           HA       HIS  25  -8.242   5.535  -1.694
  157    HB2  HIS  25           1HB      HIS  25 -10.311   7.272  -2.933
  158    HB3  HIS  25           2HB      HIS  25  -8.635   7.584  -3.377
  159    HD1  HIS  25           HD1      HIS  25 -11.357   5.893  -4.684
  160    HD2  HIS  25           HD2      HIS  25  -7.423   4.756  -3.981
  161    HE1  HIS  25           HE1      HIS  25 -10.944   3.928  -6.198
  162    H    THR  26           H        THR  26  -9.706   8.673  -0.840
  163    HA   THR  26           HA       THR  26  -7.648  10.369  -0.780
  164    HB   THR  26           HB       THR  26  -8.588  11.245   1.477
  165    HG1  THR  26           HG1      THR  26 -10.076   8.946   1.032
  166   HG21  THR  26          3HG2      THR  26  -9.391  12.558  -0.171
  167   HG22  THR  26          1HG2      THR  26 -10.884  11.654   0.079
  168   HG23  THR  26          2HG2      THR  26  -9.777  11.187  -1.212
  169    H    HIS  27           H        HIS  27  -8.201   7.863   1.660
  170    HA   HIS  27           HA       HIS  27  -6.016   8.576   3.318
  171    HB2  HIS  27           1HB      HIS  27  -7.720   6.121   3.032
  172    HB3  HIS  27           2HB      HIS  27  -6.302   6.098   4.075
  173    HD1  HIS  27           HD1      HIS  27  -8.976   5.692   5.387
  174    HD2  HIS  27           HD2      HIS  27  -7.291   9.450   4.835
  175    HE1  HIS  27           HE1      HIS  27 -10.062   7.175   7.103
  176    H    LEU  28           H        LEU  28  -6.368   5.742   1.173
  177    HA   LEU  28           HA       LEU  28  -3.817   4.783   1.247
  178    HB2  LEU  28           1HB      LEU  28  -5.561   3.639   0.055
  179    HB3  LEU  28           2HB      LEU  28  -5.680   4.952  -1.114
  180    HG   LEU  28           HG       LEU  28  -3.381   4.388  -1.888
  181   HD11  LEU  28          1HD1      LEU  28  -2.094   2.985  -0.756
  182   HD12  LEU  28          2HD1      LEU  28  -3.298   1.706  -0.915
  183   HD13  LEU  28          3HD1      LEU  28  -3.369   2.818   0.452
  184   HD21  LEU  28          3HD2      LEU  28  -4.796   1.843  -2.224
  185   HD22  LEU  28          1HD2      LEU  28  -4.246   3.008  -3.429
  186   HD23  LEU  28          2HD2      LEU  28  -5.767   3.274  -2.575
  187    H    ASN  29           H        ASN  29  -5.031   7.338  -0.903
  188    HA   ASN  29           HA       ASN  29  -2.634   7.788  -2.290
  189    HB2  ASN  29           1HB      ASN  29  -5.026   8.655  -2.782
  190    HB3  ASN  29           2HB      ASN  29  -4.605   9.982  -1.703
  191   HD21  ASN  29          1HD2      ASN  29  -4.366  11.659  -3.021
  192   HD22  ASN  29          2HD2      ASN  29  -3.305  11.714  -4.384
  193    H    GLU  30           H        GLU  30  -4.048   9.889   0.226
  194    HA   GLU  30           HA       GLU  30  -1.930  11.544   0.680
  195    HB2  GLU  30           1HB      GLU  30  -4.031  10.449   2.518
  196    HB3  GLU  30           2HB      GLU  30  -2.770  11.497   3.152
  197    HG2  GLU  30           1HG      GLU  30  -3.522  13.010   1.112
  198    HG3  GLU  30           2HG      GLU  30  -5.028  12.122   1.340
  199    H    HIS  31           H        HIS  31  -2.292   8.227   1.719
  200    HA   HIS  31           HA       HIS  31  -0.099   8.242   3.549
  201    HB2  HIS  31           1HB      HIS  31  -1.608   6.528   3.989
  202    HB3  HIS  31           2HB      HIS  31  -1.795   6.118   2.286
  203    HD1  HIS  31           HD1      HIS  31   0.570   5.644   5.179
  204    HD2  HIS  31           HD2      HIS  31  -0.067   4.185   1.341
  205    HE1  HIS  31           HE1      HIS  31   2.100   3.661   4.951
  206    H    ARG  32           H        ARG  32  -0.517   7.104   0.209
  207    HA   ARG  32           HA       ARG  32   1.942   5.992  -0.268
  208    HB2  ARG  32           1HB      ARG  32   0.088   7.565  -2.032
  209    HB3  ARG  32           2HB      ARG  32   1.615   6.955  -2.654
  210    HG2  ARG  32           1HG      ARG  32   0.966   4.695  -2.221
  211    HG3  ARG  32           2HG      ARG  32  -0.487   5.227  -1.372
  212    HD2  ARG  32           1HD      ARG  32  -1.237   4.596  -3.501
  213    HD3  ARG  32           2HD      ARG  32  -1.147   6.356  -3.560
  214    HE   ARG  32           HE       ARG  32   1.243   5.073  -4.486
  215   HH11  ARG  32          1HH1      ARG  32  -1.952   6.123  -5.383
  216   HH12  ARG  32          2HH1      ARG  32  -1.574   6.263  -7.068
  217   HH21  ARG  32          1HH2      ARG  32   1.753   5.254  -6.701
  218   HH22  ARG  32          2HH2      ARG  32   0.534   5.769  -7.817
  219    H    ARG  33           H        ARG  33   1.237   9.265   0.422
  220    HA   ARG  33           HA       ARG  33   3.222  10.669  -0.891
  221    HB2  ARG  33           1HB      ARG  33   2.041  11.056   1.858
  222    HB3  ARG  33           2HB      ARG  33   3.163  12.200   1.135
  223    HG2  ARG  33           1HG      ARG  33   1.434  12.117  -0.851
  224    HG3  ARG  33           2HG      ARG  33   0.340  11.607   0.436
  225    HD2  ARG  33           1HD      ARG  33   0.096  13.913   0.440
  226    HD3  ARG  33           2HD      ARG  33   1.279  13.644   1.719
  227    HE   ARG  33           HE       ARG  33   2.883  14.680   0.427
  228   HH11  ARG  33          1HH1      ARG  33   0.005  14.130  -1.453
  229   HH12  ARG  33          2HH1      ARG  33   0.521  15.124  -2.775
  230   HH21  ARG  33          1HH2      ARG  33   3.574  15.992  -1.307
  231   HH22  ARG  33          2HH2      ARG  33   2.551  16.182  -2.691
  232    H    ILE  34           H        ILE  34   3.431   9.065   2.280
  233    HA   ILE  34           HA       ILE  34   6.060   9.701   2.894
  234    HB   ILE  34           HB       ILE  34   6.073   7.825   4.399
  235   HG12  ILE  34          1HG1      ILE  34   3.454   6.798   3.409
  236   HG13  ILE  34          2HG1      ILE  34   4.903   6.369   2.506
  237   HG21  ILE  34          1HG2      ILE  34   3.488   8.149   5.183
  238   HG22  ILE  34          2HG2      ILE  34   4.800   9.269   5.548
  239   HG23  ILE  34          3HG2      ILE  34   3.735   9.575   4.175
  240   HD11  ILE  34          3HD1      ILE  34   3.961   4.893   4.497
  241   HD12  ILE  34          1HD1      ILE  34   5.684   5.018   4.142
  242   HD13  ILE  34          2HD1      ILE  34   4.977   5.986   5.436
  243    H    HIS  35           H        HIS  35   4.855   7.632   0.455
  244    HA   HIS  35           HA       HIS  35   7.369   6.174   0.190
  245    HB2  HIS  35           1HB      HIS  35   4.699   5.950  -1.195
  246    HB3  HIS  35           2HB      HIS  35   6.119   5.061  -1.738
  247    HD1  HIS  35           HD1      HIS  35   7.278   3.690   0.475
  248    HD2  HIS  35           HD2      HIS  35   3.191   4.437   0.441
  249    HE1  HIS  35           HE1      HIS  35   6.279   2.035   2.083
  250    H    THR  36           H        THR  36   5.677   8.850  -1.180
  251    HA   THR  36           HA       THR  36   7.638   9.000  -3.373
  252    HB   THR  36           HB       THR  36   6.008  10.634  -4.407
  253    HG1  THR  36           HG1      THR  36   3.948   9.529  -2.900
  254   HG21  THR  36          3HG2      THR  36   4.868   7.876  -3.968
  255   HG22  THR  36          1HG2      THR  36   6.221   8.214  -5.047
  256   HG23  THR  36          2HG2      THR  36   4.639   8.924  -5.368
  257    H    GLY  37           H        GLY  37   9.074  10.616  -3.383
  258    HA2  GLY  37           1HA      GLY  37   8.627  12.851  -1.500
  259    HA3  GLY  37           2HA      GLY  37  10.209  12.145  -1.800
  260    H    TYR  38           H        TYR  38  11.048  12.328  -4.036
  261    HA   TYR  38           HA       TYR  38   9.944  14.565  -5.558
  262    HB2  TYR  38           1HB      TYR  38  11.634  15.490  -3.967
  263    HB3  TYR  38           2HB      TYR  38  12.849  14.463  -4.720
  264    HD1  TYR  38           HD1      TYR  38  10.562  17.310  -5.308
  265    HD2  TYR  38           HD2      TYR  38  13.886  15.087  -6.761
  266    HE1  TYR  38           HE1      TYR  38  10.991  19.059  -6.984
  267    HE2  TYR  38           HE2      TYR  38  14.325  16.830  -8.440
  268    HH   TYR  38           HH       TYR  38  13.714  19.516  -8.508
  269    H    ARG  39           H        ARG  39  10.624  14.641  -7.741
  270    HA   ARG  39           HA       ARG  39  12.017  12.222  -8.680
  271    HB2  ARG  39           1HB      ARG  39   9.576  13.551  -9.865
  272    HB3  ARG  39           2HB      ARG  39  10.518  12.320 -10.694
  273    HG2  ARG  39           1HG      ARG  39   9.256  11.865  -8.007
  274    HG3  ARG  39           2HG      ARG  39   8.428  11.533  -9.529
  275    HD2  ARG  39           1HD      ARG  39   9.924   9.837 -10.110
  276    HD3  ARG  39           2HD      ARG  39  11.139  10.391  -8.958
  277    HE   ARG  39           HE       ARG  39  10.069   9.215  -7.295
  278   HH11  ARG  39          1HH1      ARG  39   8.063   9.332 -10.138
  279   HH12  ARG  39          2HH1      ARG  39   6.929   8.165  -9.545
  280   HH21  ARG  39          1HH2      ARG  39   8.583   7.676  -6.503
  281   HH22  ARG  39          2HH2      ARG  39   7.225   7.224  -7.477
  282    HA   PRO  40           HA       PRO  40  14.707  14.998 -10.789
  283    HB2  PRO  40           1HB      PRO  40  15.689  13.291 -12.658
  284    HB3  PRO  40           2HB      PRO  40  16.157  13.224 -10.955
  285    HG2  PRO  40           1HG      PRO  40  14.159  11.559 -12.437
  286    HG3  PRO  40           2HG      PRO  40  15.371  11.055 -11.245
  287    HD2  PRO  40           1HD      PRO  40  12.760  11.396 -10.613
  288    HD3  PRO  40           2HD      PRO  40  14.071  11.713  -9.458
  289    H    SER  41           H        SER  41  11.858  13.830 -12.046
  290    HA   SER  41           HA       SER  41  12.261  15.067 -14.677
  291    HB2  SER  41           1HB      SER  41  11.312  12.738 -14.530
  292    HB3  SER  41           2HB      SER  41   9.892  13.431 -13.747
  293    HG   SER  41           HG       SER  41  10.855  13.980 -16.359
  294    H    GLY  42           H        GLY  42  12.118  17.241 -14.128
  295    HA2  GLY  42           1HA      GLY  42   9.416  18.112 -13.316
  296    HA3  GLY  42           2HA      GLY  42  10.855  18.859 -12.639
  297    HA   PRO  43           HA       PRO  43   9.390  21.062 -16.556
  298    HB2  PRO  43           1HB      PRO  43   8.656  23.393 -15.375
  299    HB3  PRO  43           2HB      PRO  43   7.542  22.041 -15.606
  300    HG2  PRO  43           1HG      PRO  43   9.064  22.844 -13.157
  301    HG3  PRO  43           2HG      PRO  43   7.379  22.312 -13.302
  302    HD2  PRO  43           1HD      PRO  43   9.362  20.662 -12.477
  303    HD3  PRO  43           2HD      PRO  43   7.960  20.083 -13.399
  304    H    SER  44           H        SER  44  11.682  21.310 -14.131
  305    HA   SER  44           HA       SER  44  12.909  23.782 -14.897
  306    HB2  SER  44           1HB      SER  44  13.963  21.463 -13.260
  307    HB3  SER  44           2HB      SER  44  14.783  23.013 -13.449
  308    HG   SER  44           HG       SER  44  12.577  22.346 -11.926
  309    H    SER  45           H        SER  45  13.245  23.652 -17.124
  310    HA   SER  45           HA       SER  45  14.433  21.568 -18.522
  311    HB2  SER  45           1HB      SER  45  14.615  24.537 -19.086
  312    HB3  SER  45           2HB      SER  45  14.989  23.257 -20.239
  313    HG   SER  45           HG       SER  45  12.837  24.107 -20.435
  314    H    GLY  46           H        GLY  46  15.996  24.473 -17.166
  315    HA2  GLY  46           1HA      GLY  46  18.589  23.096 -17.447
  316    HA3  GLY  46           2HA      GLY  46  18.379  24.839 -17.368