*HEADER    TRANSCRIPTION                           28-MAR-07   2ENH              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 556-          
*TITLE    2 588) OF HUMAN ZINC FINGER PROTEIN 28 HOMOLOG                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 28 HOMOLOG;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2;                                                   
*COMPND   5 SYNONYM: ZFP-28, KRUEPPEL-LIKE ZINC FINGER FACTOR X6;                
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: ZFP28;                                                         
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P061225-32;                               
*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    N.TOCHIO, T.TOMIZAWA, 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 2ENH    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   181 ZN   ZN   2.19  5.00E+00
15 CYSS CB   181 ZN   ZN   3.25  5.00E+00
18 CYSS SG   181 ZN   ZN   2.19  5.00E+00
18 CYSS CB   181 ZN   ZN   3.25  5.00E+00
31 HIS NE2   181 ZN   ZN   1.90  5.00E+00
35 HIS NE2   181 ZN   ZN   1.90  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   181 ZN   ZN   2.39  5.00E+00
15 CYSS CB   181 ZN   ZN   3.51  5.00E+00
18 CYSS SG   181 ZN   ZN   2.39  5.00E+00
18 CYSS CB   181 ZN   ZN   3.51  5.00E+00
31 HIS NE2   181 ZN   ZN   2.10  5.00E+00
35 HIS NE2   181 ZN   ZN   2.10  5.00E+00
15 CYSS SG  18 CYSS SG   3.96  5.00E+00
15 CYSS SG  31 HIS NE2   3.72  5.00E+00
15 CYSS SG  35 HIS NE2   3.72  5.00E+00
18 CYSS SG  31 HIS NE2   3.72  5.00E+00
18 CYSS SG  35 HIS NE2   3.72  5.00E+00
31 HIS NE2  35 HIS NE2   3.60  5.00E+00
 15 CYSS HA     16 ASP  HN      3.13 #SUP  0.96  #QF  0.90
 16 ASP  HN     16 ASP  QB      3.56 #SUP  0.98  #QF  0.98
 16 ASP  HN     28 LEU  QD1     4.49 #SUP  0.95  #QF  0.95
 15 CYSS HN     20 LYS  HN      4.65 #SUP  1.00
 15 CYSS HB3    20 LYS  HN      3.65 #SUP  0.99  #QF  0.99
 15 CYSS HB2    20 LYS  HN      4.19 #SUP  1.00
 20 LYS  HN     20 LYS  HB3     3.80 #SUP  0.79  #QF  0.79
 11 LYS  HN     11 LYS  QD      5.14 #SUP  1.00
 16 ASP  HN     17 VAL  HN      3.67 #SUP  0.99  #QF  0.99
 17 VAL  HN     18 CYSS HN      3.28 #SUP  0.99  #QF  0.98
 10 GLU  HA     11 LYS  HN      3.45 #SUP  0.81  #QF  0.81
 11 LYS  HN     12 PRO  QD      4.98 #SUP  1.00
 16 ASP  QB     17 VAL  HN      4.19 #SUP  0.99  #QF  0.99
 17 VAL  HN     17 VAL  HB      3.20 #SUP  0.89  #QF  0.89
 17 VAL  HN     17 VAL  QG1     4.08 #SUP  1.00
 17 VAL  HN     17 VAL  QG2     4.08 #SUP  1.00
 16 ASP  HN     32 GLN  HE22    5.18 #SUP  0.99  #QF  0.99
 16 ASP  HN     32 GLN  HE21    5.18 #SUP  0.87  #QF  0.87
 27 SER  HN     27 SER  HB2     4.16 #SUP  1.00  #QF  0.96
 25 HIS  HA     27 SER  HN      5.14 #SUP  0.74  #QF  0.58
 26 ALA  QB     27 SER  HN      4.02 #SUP  0.99  #QF  0.98
 10 GLU  HN     10 GLU  QG      4.54 #SUP  0.76  #QF  0.76
 29 THR  HN     30 GLN  HN      3.49 #SUP  0.96  #QF  0.96
 28 LEU  HN     30 GLN  HN      4.43 #SUP  0.90  #QF  0.90
 26 ALA  HA     30 GLN  HN      4.66 #SUP  1.00  #QF  0.96
 30 GLN  HN     30 GLN  HG2     4.86 #SUP  0.94  #QF  0.79
 30 GLN  HN     30 GLN  HB2     3.51 #SUP  0.96  #QF  0.71
 30 GLN  HN     30 GLN  HB3     3.51 #SUP  0.96  #QF  0.71
 29 THR  QG2    30 GLN  HN      4.32 #SUP  1.00
 26 ALA  QB     30 GLN  HN      4.87 #SUP  0.82  #QF  0.82
 31 HIS  HN     32 GLN  HN      3.45 #SUP  0.98  #QF  0.98
 22 PHE  QE     31 HIS  HN      5.50 #SUP  0.99  #QF  0.25
 31 HIS  HN     31 HIS  HD2     5.50 #SUP  0.99  #QF  0.25
 31 HIS  HN     31 HIS  HB2     3.25 #SUP  0.98  #QF  0.98
 31 HIS  HN     31 HIS  HB3     3.25 #SUP  0.99  #QF  0.99
 15 CYSS HN     22 PHE  QD      4.77 #SUP  0.98  #QF  0.98
 15 CYSS HN     20 LYS  HB3     4.98 #SUP  0.89  #QF  0.89
 15 CYSS HN     19 ARG  HN      4.56 #SUP  0.99  #QF  0.99
 13 TYR  HN     13 TYR  QD      3.66 #SUP  1.00
 15 CYSS HN     22 PHE  QE      4.27 #SUP  0.98  #QF  0.98
 15 CYSS HN     21 ALA  HA      4.23 #SUP  1.00
 14 GLU  HA     15 CYSS HN      2.96 #SUP  0.93  #QF  0.93
 12 PRO  HA     13 TYR  HN      3.49 #SUP  1.00
 15 CYSS HN     19 ARG  HA      4.67 #SUP  1.00
 12 PRO  QD     13 TYR  HN      3.79 #SUP  1.00
 15 CYSS HN     15 CYSS HB3     3.27 #SUP  1.00
 15 CYSS HN     15 CYSS HB2     3.37 #SUP  1.00
 13 TYR  HN     13 TYR  HB2     3.37 #SUP  0.99  #QF  0.99
 14 GLU  QG     15 CYSS HN      4.11 #SUP  0.99  #QF  0.99
 14 GLU  QB     15 CYSS HN      3.99 #SUP  1.00
 15 CYSS HN     20 LYS  HB2     4.98 #SUP  0.96  #QF  0.94
 15 CYSS HN     21 ALA  QB      5.50 #SUP  0.96  #QF  0.94
 15 CYSS HN     28 LEU  QD1     4.09 #SUP  1.00
 32 GLN  HN     33 ARG  HN      3.56 #SUP  0.99  #QF  0.99
 31 HIS  HN     33 ARG  HN      4.86 #SUP  0.97  #QF  0.97
 30 GLN  HA     33 ARG  HN      4.23 #SUP  0.98  #QF  0.98
 33 ARG  HN     33 ARG  QD      4.50 #SUP  1.00
 32 GLN  HB2    33 ARG  HN      4.22 #SUP  0.99  #QF  0.99
 33 ARG  HN     33 ARG  HG3     3.79 #SUP  1.00
 33 ARG  HN     34 VAL  QG2     5.03 #SUP  0.98  #QF  0.98
 32 GLN  HG2    33 ARG  HN      5.50 #SUP  0.99  #QF  0.83
 32 GLN  HG3    33 ARG  HN      5.50 #SUP  0.99  #QF  0.83
 17 VAL  HN     19 ARG  HN      4.31 #SUP  0.75  #QF  0.75
 15 CYSS HA     19 ARG  HN      5.25 #SUP  0.96  #QF  0.76
 19 ARG  HN     19 ARG  HA      2.80 #SUP  0.99  #QF  0.99
 15 CYSS HB3    19 ARG  HN      3.65 #SUP  0.94  #QF  0.94
 15 CYSS HB2    19 ARG  HN      4.31 #SUP  0.95  #QF  0.95
 19 ARG  HN     19 ARG  HG2     4.60 #SUP  1.00
 19 ARG  HN     19 ARG  HG3     4.60 #SUP  1.00
 17 VAL  HB     19 ARG  HN      4.81 #SUP  0.77  #QF  0.70
 13 TYR  HN     22 PHE  HN      4.50 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  QD      3.38 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  QE      4.98 #SUP  0.99  #QF  0.99
 21 ALA  HA     22 PHE  HN      2.97 #SUP  0.95  #QF  0.95
 14 GLU  HA     22 PHE  HN      4.00 #SUP  0.92  #QF  0.92
 22 PHE  HN     22 PHE  HB3     4.00 #SUP  1.00
 13 TYR  HB2    22 PHE  HN      4.18 #SUP  0.96  #QF  0.96
 22 PHE  HN     22 PHE  HB2     3.55 #SUP  0.99  #QF  0.99
 21 ALA  QB     22 PHE  HN      3.46 #SUP  0.96  #QF  0.96
 22 PHE  HN     28 LEU  QD2     5.48 #SUP  0.87  #QF  0.31
 22 PHE  HN     28 LEU  QD1     5.50 #SUP  0.87  #QF  0.31
 24 HIS  HN     27 SER  HN      4.57 #SUP  0.76  #QF  0.76
 24 HIS  HN     27 SER  HB2     4.76 #SUP  0.95  #QF  0.95
 24 HIS  HN     27 SER  HB3     4.76 #SUP  0.81  #QF  0.71
 22 PHE  HB3    24 HIS  HN      3.70 #SUP  0.96  #QF  0.96
 24 HIS  HN     24 HIS  HB2     4.02 #SUP  0.99  #QF  0.99
 24 HIS  HN     24 HIS  HB3     4.02 #SUP  0.95  #QF  0.95
 22 PHE  HB2    24 HIS  HN      4.34 #SUP  1.00
 34 VAL  HN     35 HIS  HN      3.40 #SUP  0.94  #QF  0.94
 35 HIS  HN     35 HIS  HD2     4.33 #SUP  1.00
 32 GLN  HA     35 HIS  HN      4.21 #SUP  0.84  #QF  0.84
 35 HIS  HN     35 HIS  HB2     3.86 #SUP  1.00
 35 HIS  HN     35 HIS  HB3     3.86 #SUP  0.97  #QF  0.97
 34 VAL  HB     35 HIS  HN      4.19 #SUP  1.00
 34 VAL  QG1    35 HIS  HN      4.27 #SUP  0.99  #QF  0.99
 34 VAL  QG2    35 HIS  HN      4.27 #SUP  0.99  #QF  0.99
 18 CYSS HN     19 ARG  HA      4.76 #SUP  0.86  #QF  0.86
 15 CYSS HB3    18 CYSS HN      3.94 #SUP  0.76  #QF  0.32
 17 VAL  HB     18 CYSS HN      3.20 #SUP  0.98  #QF  0.98
 33 ARG  HN     34 VAL  HN      3.38 #SUP  1.00  #QF  0.97
 20 LYS  HA     21 ALA  HN      2.80 #SUP  0.98  #QF  0.98
 32 GLN  HA     34 VAL  HN      4.52 #SUP  0.93  #QF  0.93
 33 ARG  HB2    34 VAL  HN      3.40 #SUP  0.83  #QF  0.83
 33 ARG  HB3    34 VAL  HN      4.09 #SUP  1.00
 20 LYS  HG3    21 ALA  HN      4.93 #SUP  0.86  #QF  0.70
 21 ALA  HN     21 ALA  QB      3.02 #SUP  0.93  #QF  0.93
 20 LYS  HG2    21 ALA  HN      4.93 #SUP  0.93  #QF  0.93
 34 VAL  HN     34 VAL  QG1     3.48 #SUP  0.90  #QF  0.90
 34 VAL  HN     34 VAL  QG2     3.48 #SUP  1.00
 22 PHE  HB3    28 LEU  HN      4.57 #SUP  0.99  #QF  0.99
 13 TYR  HB3    28 LEU  HN      5.44 #SUP  0.93  #QF  0.80
 22 PHE  HB2    28 LEU  HN      4.49 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HB3     3.24 #SUP  1.00
 26 ALA  QB     28 LEU  HN      5.08 #SUP  1.00  #QF  0.72
 28 LEU  HN     28 LEU  HB2     3.42 #SUP  1.00
 28 LEU  HN     28 LEU  QD2     4.59 #SUP  1.00  #QF  0.99
 28 LEU  HN     28 LEU  QD1     4.92 #SUP  1.00  #QF  0.99
 14 GLU  HN     15 CYSS HN      5.00 #SUP  0.99  #QF  0.99
 13 TYR  HN     14 GLU  HN      4.63 #SUP  0.99  #QF  0.99
 13 TYR  HA     14 GLU  HN      2.94 #SUP  0.81  #QF  0.81
 13 TYR  HB3    14 GLU  HN      4.22 #SUP  0.90  #QF  0.90
 13 TYR  HB2    14 GLU  HN      4.61 #SUP  1.00
 14 GLU  HN     14 GLU  QG      4.25 #SUP  0.99  #QF  0.99
 14 GLU  HN     14 GLU  QB      3.31 #SUP  0.96  #QF  0.96
 14 GLU  HN     28 LEU  QD2     4.09 #SUP  0.98  #QF  0.93
 38 GLU  HA     39 LYS  HN      3.29 #SUP  0.93  #QF  0.93
 31 HIS  HD2    32 GLN  HN      4.28 #SUP  1.00
 32 GLN  HN     32 GLN  HG2     4.27 #SUP  0.97  #QF  0.89
 32 GLN  HN     32 GLN  HG3     4.27 #SUP  0.97  #QF  0.89
 32 GLN  HN     32 GLN  HB2     3.33 #SUP  0.99  #QF  0.99
 35 HIS  HN     36 SER  HN      4.60 #SUP  1.00
 36 SER  HN     36 SER  QB      4.16 #SUP  0.94  #QF  0.94
 28 LEU  HN     29 THR  HN      3.32 #SUP  0.99  #QF  0.99
 29 THR  HN     29 THR  HB      3.18 #SUP  0.97  #QF  0.97
 28 LEU  HB3    29 THR  HN      3.45 #SUP  0.99  #QF  0.99
 28 LEU  HG     29 THR  HN      4.01 #SUP  1.00
 28 LEU  HB2    29 THR  HN      4.01 #SUP  1.00
 28 LEU  QD2    29 THR  HN      4.82 #SUP  1.00  #QF  0.67
 28 LEU  QD1    29 THR  HN      5.01 #SUP  1.00  #QF  0.95
 28 LEU  QD1    32 GLN  HN      5.29 #SUP  1.00  #QF  0.95
 22 PHE  QE     28 LEU  QD1     3.49 #SUP  0.99  #QF  0.92
 15 CYSS HB2    28 LEU  QD1     3.48 #SUP  0.97  #QF  0.97
 28 LEU  HB3    28 LEU  QD1     3.96 #SUP  1.00
 28 LEU  HB2    28 LEU  QD1     3.74 #SUP  0.91  #QF  0.91
 17 VAL  HB     35 HIS  HE1     4.96 #SUP  0.86  #QF  0.86
 34 VAL  QG1    35 HIS  HE1     5.38 #SUP  0.65  #QF  0.65
 34 VAL  QG2    35 HIS  HE1     5.38 #SUP  0.73  #QF  0.73
 14 GLU  HA     21 ALA  QB      4.37 #SUP  1.00
 20 LYS  HA     21 ALA  QB      4.13 #SUP  0.88  #QF  0.88
 11 LYS  QE     21 ALA  QB      4.71 #SUP  0.77  #QF  0.77
 14 GLU  QG     21 ALA  QB      4.07 #SUP  0.98  #QF  0.98
 14 GLU  QB     21 ALA  QB      4.34 #SUP  1.00
 29 THR  HN     29 THR  QG2     3.81 #SUP  1.00
 26 ALA  HA     29 THR  QG2     3.48 #SUP  1.00  #QF  0.28
 31 HIS  HE1    34 VAL  QG1     4.61 #SUP  0.71  #QF  0.71
 17 VAL  QG1    18 CYSS HN      3.99 #SUP  1.00
 17 VAL  QG1    35 HIS  HD2     4.74 #SUP  1.00
 17 VAL  QG1    35 HIS  HB2     5.90 #SUP  0.99  #QF  0.99
 29 THR  HB     30 GLN  HN      4.20 #SUP  0.99  #QF  0.99
 26 ALA  QB     29 THR  HB      4.78 #SUP  0.60  #QF  0.36
 28 LEU  HG     29 THR  HB      5.19 #SUP  0.60  #QF  0.36
 17 VAL  QG2    18 CYSS HN      3.99 #SUP  0.97  #QF  0.97
 13 TYR  QD     22 PHE  HB2     5.14 #SUP  0.97  #QF  0.55
 21 ALA  HA     22 PHE  HB2     5.03 #SUP  0.99  #QF  0.99
 22 PHE  HB3    27 SER  HB2     4.19 #SUP  0.99  #QF  0.99
 22 PHE  HB2    27 SER  HB2     4.63 #SUP  0.99  #QF  0.99
 17 VAL  QG2    35 HIS  HB2     5.90 #SUP  0.66  #QF  0.66
 13 TYR  HB3    22 PHE  HB3     5.50 #SUP  0.93  #QF  0.85
 13 TYR  HB2    22 PHE  HB3     4.94 #SUP  0.99  #QF  0.99
 13 TYR  HB2    22 PHE  HB2     3.95 #SUP  1.00
 22 PHE  HB2    28 LEU  HB3     4.75 #SUP  1.00
 22 PHE  HB3    28 LEU  HB2     4.53 #SUP  0.98  #QF  0.98
 22 PHE  HB2    28 LEU  HB2     4.14 #SUP  1.00
 22 PHE  HB2    28 LEU  QD2     4.99 #SUP  0.99  #QF  0.59
 22 PHE  HB2    28 LEU  QD1     5.19 #SUP  0.99  #QF  0.59
 33 ARG  HB3    33 ARG  QD      3.49 #SUP  1.00  #QF  0.85
 33 ARG  HN     34 VAL  QG1     5.03 #SUP  1.00  #QF  0.65
 31 HIS  HE1    34 VAL  QG2     4.61 #SUP  0.97  #QF  0.97
 19 ARG  HN     19 ARG  HD3     4.57 #SUP  1.00  #QF  0.21
 19 ARG  HN     19 ARG  HD2     4.57 #SUP  1.00
 16 ASP  HA     19 ARG  HD3     5.15 #SUP  0.92  #QF  0.92
 16 ASP  HA     19 ARG  HD2     5.15 #SUP  0.87  #QF  0.87
 19 ARG  HA     19 ARG  HD3     4.08 #SUP  1.00
 19 ARG  HA     19 ARG  HD2     4.08 #SUP  1.00
 29 THR  HA     32 GLN  HG2     4.83 #SUP  0.81  #QF  0.41
 29 THR  HA     32 GLN  HG3     4.83 #SUP  0.81  #QF  0.41
 29 THR  HA     32 GLN  HB2     3.82 #SUP  0.94  #QF  0.94
 28 LEU  HG     29 THR  HA      4.21 #SUP  0.99  #QF  0.99
 29 THR  HA     29 THR  QG2     3.23 #SUP  0.99  #QF  0.99
 11 LYS  HA     11 LYS  QE      5.07 #SUP  0.93  #QF  0.93
 39 LYS  QG     39 LYS  QE      3.96 #SUP  1.00  #QF  0.72
 24 HIS  HE1    26 ALA  QB      4.37 #SUP  0.90  #QF  0.90
 25 HIS  HA     26 ALA  QB      5.50 #SUP  1.00
 24 HIS  HB3    26 ALA  QB      4.97 #SUP  0.99  #QF  0.99
 17 VAL  HA     17 VAL  QG1     3.13 #SUP  1.00
 17 VAL  HA     17 VAL  QG2     3.13 #SUP  0.99  #QF  0.99
 34 VAL  HA     34 VAL  QG1     3.52 #SUP  0.99  #QF  0.99
 34 VAL  HA     34 VAL  QG2     3.52 #SUP  1.00
 28 LEU  HB3    28 LEU  QD2     3.40 #SUP  1.00
 12 PRO  HA     13 TYR  QD      5.16 #SUP  0.99  #QF  0.99
 22 PHE  QD     27 SER  HB2     4.08 #SUP  0.96  #QF  0.96
 27 SER  HN     27 SER  HB3     4.16 #SUP  1.00  #QF  0.99
 22 PHE  HB3    27 SER  HB3     4.19 #SUP  1.00
 22 PHE  HB2    27 SER  HB3     4.63 #SUP  1.00
 13 TYR  QD     14 GLU  HN      4.70 #SUP  1.00
 13 TYR  HN     13 TYR  HB3     3.99 #SUP  1.00
 13 TYR  HA     13 TYR  QD      3.65 #SUP  0.99  #QF  0.99
 12 PRO  QD     13 TYR  QD      3.99 #SUP  1.00
 13 TYR  HB3    22 PHE  HB2     4.29 #SUP  1.00
 13 TYR  HB3    28 LEU  HB3     4.36 #SUP  1.00
 13 TYR  HB2    28 LEU  HB3     4.88 #SUP  1.00
 13 TYR  HB3    28 LEU  HG      4.92 #SUP  1.00
 13 TYR  HB3    28 LEU  HB2     4.08 #SUP  0.99  #QF  0.99
 13 TYR  HB2    28 LEU  HB2     4.21 #SUP  1.00
 13 TYR  HB3    28 LEU  QD2     3.42 #SUP  1.00
 13 TYR  HB2    28 LEU  QD2     3.71 #SUP  1.00
  8 THR  HA      8 THR  QG2     3.74 #SUP  0.89  #QF  0.89
 21 ALA  HA     22 PHE  QD      3.96 #SUP  0.99  #QF  0.99
 14 GLU  HA     22 PHE  QD      4.54 #SUP  0.96  #QF  0.96
 22 PHE  QD     27 SER  HB3     4.08 #SUP  0.60  #QF  0.60
 15 CYSS HB2    22 PHE  QD      4.98 #SUP  0.97  #QF  0.86
 22 PHE  QD     28 LEU  HB2     3.96 #SUP  0.88  #QF  0.88
 22 PHE  QD     28 LEU  QD1     3.46 #SUP  0.99  #QF  0.99
 27 SER  HA     30 GLN  HN      4.43 #SUP  0.86  #QF  0.82
 27 SER  HA     31 HIS  HN      4.73 #SUP  0.86  #QF  0.82
 25 HIS  HA     29 THR  HN      4.89 #SUP  0.98  #QF  0.98
 13 TYR  QD     25 HIS  HA      4.08 #SUP  0.85  #QF  0.24
 25 HIS  HA     28 LEU  HN      4.47 #SUP  0.85  #QF  0.24
 14 GLU  QG     21 ALA  HA      4.84 #SUP  0.99  #QF  0.99
 14 GLU  HA     14 GLU  QG      4.12 #SUP  1.00
 14 GLU  QG     19 ARG  HA      4.07 #SUP  0.71  #QF  0.71
 25 HIS  HA     28 LEU  HB3     3.66 #SUP  0.89  #QF  0.89
 25 HIS  HA     28 LEU  HB2     4.15 #SUP  0.97  #QF  0.97
 25 HIS  HA     28 LEU  QD2     4.17 #SUP  0.95  #QF  0.95
 15 CYSS HB3    22 PHE  QE      4.57 #SUP  1.00  #QF  0.88
 22 PHE  QE     31 HIS  HB2     4.31 #SUP  0.60  #QF  0.60
 20 LYS  HB3    22 PHE  QE      4.06 #SUP  0.91  #QF  0.88
 20 LYS  HB2    22 PHE  QE      4.06 #SUP  1.00
 15 CYSS HA     17 VAL  HN      4.64 #SUP  0.86  #QF  0.86
 15 CYSS HA     22 PHE  QE      5.16 #SUP  1.00  #QF  0.72
 15 CYSS HA     31 HIS  HD2     5.50 #SUP  1.00  #QF  0.72
 15 CYSS HA     28 LEU  QD1     3.39 #SUP  1.00
 31 HIS  HD2    32 GLN  HA      3.84 #SUP  0.97  #QF  0.97
 32 GLN  HA     35 HIS  HD2     3.41 #SUP  0.97  #QF  0.97
 31 HIS  HA     34 VAL  HN      4.68 #SUP  0.97  #QF  0.97
 31 HIS  HA     33 ARG  HN      4.80 #SUP  0.99  #QF  0.99
 31 HIS  HD2    32 GLN  HG2     4.89 #SUP  0.70  #QF  0.49
 31 HIS  HD2    32 GLN  HG3     4.89 #SUP  0.70  #QF  0.49
 31 HIS  HA     31 HIS  HD2     4.71 #SUP  0.99  #QF  0.99
 31 HIS  HA     33 ARG  HB2     4.89 #SUP  0.63  #QF  0.63
 28 LEU  QD1    32 GLN  HG3     4.73 #SUP  0.98  #QF  0.35
 31 HIS  HA     34 VAL  QG1     4.39 #SUP  0.98  #QF  0.98
 31 HIS  HA     34 VAL  QG2     4.39 #SUP  0.88  #QF  0.88
 30 GLN  HA     32 GLN  HN      4.83 #SUP  0.96  #QF  0.96
 30 GLN  HA     33 ARG  QD      3.96 #SUP  0.99  #QF  0.99
 30 GLN  HA     30 GLN  HG2     4.19 #SUP  0.96  #QF  0.76
 29 THR  QG2    30 GLN  HA      4.62 #SUP  0.91  #QF  0.91
 33 ARG  HA     33 ARG  QD      4.23 #SUP  1.00
 33 ARG  HA     33 ARG  HG3     4.14 #SUP  1.00
 28 LEU  HA     32 GLN  HN      4.96 #SUP  1.00  #QF  0.98
 28 LEU  HA     31 HIS  HN      4.17 #SUP  0.76  #QF  0.76
 22 PHE  QD     28 LEU  HA      4.12 #SUP  1.00
 22 PHE  QE     28 LEU  HA      4.39 #SUP  0.97  #QF  0.86
 28 LEU  HA     31 HIS  HD2     4.80 #SUP  0.97  #QF  0.86
 28 LEU  HA     28 LEU  HG      4.07 #SUP  1.00
 28 LEU  HA     28 LEU  QD1     3.21 #SUP  1.00
 15 CYSS HB3    19 ARG  HA      4.40 #SUP  1.00
 22 PHE  HZ     31 HIS  HB2     4.42 #SUP  0.99  #QF  0.99
 15 CYSS HB2    22 PHE  HZ      4.44 #SUP  0.96  #QF  0.36
 20 LYS  HB3    22 PHE  HZ      4.27 #SUP  0.79  #QF  0.66
 20 LYS  HB2    22 PHE  HZ      4.27 #SUP  1.00
 20 LYS  HN     20 LYS  HB2     3.80 #SUP  0.77  #QF  0.77
 30 GLN  HG2    31 HIS  HN      5.50 #SUP  1.00
 30 GLN  HN     30 GLN  HG3     4.86 #SUP  0.99  #QF  0.99
 30 GLN  HG3    31 HIS  HN      5.50 #SUP  0.99  #QF  0.99
 30 GLN  HA     30 GLN  HG3     4.19 #SUP  1.00
 24 HIS  HB2    26 ALA  QB      4.97 #SUP  0.98  #QF  0.98
 14 GLU  QB     21 ALA  HA      4.57 #SUP  1.00
 14 GLU  QB     19 ARG  HA      4.64 #SUP  0.99  #QF  0.99
 10 GLU  HA     10 GLU  QG      4.00 #SUP  0.58  #QF  0.58
 14 GLU  QB     14 GLU  QG      2.60 #SUP  0.89  #QF  0.89
 18 CYSS HN     35 HIS  HD2     5.39 #SUP  0.97  #QF  0.97
 11 LYS  HB2    12 PRO  QD      4.54 #SUP  1.00
 32 GLN  HG2    35 HIS  HD2     5.50 #SUP  0.90  #QF  0.78
 32 GLN  HG3    35 HIS  HD2     5.50 #SUP  0.90  #QF  0.78
 17 VAL  HB     35 HIS  HD2     4.12 #SUP  0.98  #QF  0.98
 17 VAL  QG2    35 HIS  HD2     4.74 #SUP  1.00
 16 ASP  HA     19 ARG  HN      4.80 #SUP  0.92  #QF  0.92
 15 CYSS HB3    31 HIS  HD2     4.80 #SUP  1.00
 15 CYSS HB2    31 HIS  HD2     3.36 #SUP  0.85  #QF  0.85
 16 ASP  HA     16 ASP  QB      2.96 #SUP  0.98  #QF  0.98
 28 LEU  QD1    31 HIS  HD2     3.55 #SUP  0.95  #QF  0.95
 18 CYSS HN     18 CYSS HB2     3.79 #SUP  0.71  #QF  0.51
 18 CYSS HN     18 CYSS HB3     3.79 #SUP  0.79  #QF  0.79
 26 ALA  HA     29 THR  HN      4.23 #SUP  0.79  #QF  0.79
 34 VAL  HN     34 VAL  HB      3.67 #SUP  1.00
 13 TYR  QE     25 HIS  HB2     4.78 #SUP  1.00  #QF  0.64
 13 TYR  QE     25 HIS  HB3     4.78 #SUP  1.00  #QF  0.54
 11 LYS  HA     11 LYS  QD      4.33 #SUP  1.00  #QF  0.99
 11 LYS  HA     11 LYS  HG2     4.22 #SUP  0.98  #QF  0.98
 33 ARG  HN     33 ARG  HB2     3.83 #SUP  1.00
 33 ARG  HN     33 ARG  HB3     3.71 #SUP  1.00
 33 ARG  HB2    33 ARG  QD      3.95 #SUP  1.00
 15 CYSS HB2    18 CYSS HN      4.56 #SUP  0.95  #QF  0.27
 15 CYSS HB2    22 PHE  QE      3.37 #SUP  0.99  #QF  0.81
 14 GLU  HA     15 CYSS HB3     5.21 #SUP  1.00
 14 GLU  HA     15 CYSS HB2     4.50 #SUP  0.95  #QF  0.95
 15 CYSS HB3    20 LYS  HB3     4.56 #SUP  0.79  #QF  0.79
 15 CYSS HB3    20 LYS  HB2     4.56 #SUP  0.98  #QF  0.98
 15 CYSS HB3    28 LEU  QD1     4.34 #SUP  1.00
 20 LYS  HD2    22 PHE  HZ      4.80 #SUP  0.98  #QF  0.98
 11 LYS  QD     21 ALA  QB      4.21 #SUP  0.90  #QF  0.79
 20 LYS  HD2    21 ALA  HN      5.50 #SUP  0.85  #QF  0.52
 20 LYS  HD3    21 ALA  HN      5.50 #SUP  0.82  #QF  0.82
 20 LYS  HD3    22 PHE  HZ      4.80 #SUP  0.98  #QF  0.98
 20 LYS  HA     20 LYS  HD2     4.81 #SUP  1.00
 20 LYS  HA     20 LYS  HD3     4.81 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  HB3     3.90 #SUP  1.00
 31 HIS  HN     32 GLN  HB2     5.50 #SUP  0.94  #QF  0.35
 32 GLN  HB3    33 ARG  HN      4.67 #SUP  0.99  #QF  0.99
 22 PHE  QE     31 HIS  HB3     4.31 #SUP  1.00  #QF  0.97
 32 GLN  HB3    35 HIS  HD2     5.08 #SUP  0.96  #QF  0.96
 22 PHE  HZ     31 HIS  HB3     4.42 #SUP  0.98  #QF  0.98
 29 THR  HA     32 GLN  HB3     5.00 #SUP  0.98  #QF  0.98
 17 VAL  QG1    35 HIS  HB3     5.90 #SUP  1.00
 33 ARG  HN     33 ARG  HG2     3.79 #SUP  1.00
 28 LEU  HN     28 LEU  HG      5.32 #SUP  1.00
 33 ARG  HA     33 ARG  HG2     4.14 #SUP  1.00
 28 LEU  HG     32 GLN  HG2     4.90 #SUP  0.78  #QF  0.54
 28 LEU  HG     32 GLN  HG3     4.90 #SUP  0.78  #QF  0.54
 39 LYS  HA     40 PRO  HD2     3.42 #SUP  0.97  #QF  0.97
 39 LYS  HA     40 PRO  HD3     3.42 #SUP  0.98  #QF  0.98
 14 GLU  HA     21 ALA  HA      3.39 #SUP  0.94  #QF  0.94
 11 LYS  HA     12 PRO  QD      2.87 #SUP  0.92  #QF  0.92
 11 LYS  HB3    12 PRO  QD      4.54 #SUP  0.90  #QF  0.84
 11 LYS  HG3    12 PRO  QD      4.47 #SUP  0.99  #QF  0.27
 11 LYS  HG2    12 PRO  QD      4.47 #SUP  0.88  #QF  0.88
 13 TYR  QD     28 LEU  QD2     3.74 #SUP  0.98  #QF  0.98
 22 PHE  QE     28 LEU  QD2     5.50 #SUP  1.00
 13 TYR  HA     28 LEU  QD2     4.22 #SUP  1.00
 15 CYSS HA     28 LEU  QD2     4.58 #SUP  0.71  #QF  0.71
 28 LEU  HA     28 LEU  QD2     4.32 #SUP  0.82  #QF  0.82
 28 LEU  HB2    28 LEU  QD2     3.75 #SUP  0.89  #QF  0.89
 11 LYS  HA     11 LYS  HG3     4.22 #SUP  0.99  #QF  0.99
 13 TYR  QE     25 HIS  HA      4.47 #SUP  0.85  #QF  0.76
 25 HIS  HA     25 HIS  HD2     4.87 #SUP  0.85  #QF  0.76
 13 TYR  QE     28 LEU  QD2     5.04 #SUP  0.98  #QF  0.98
 13 TYR  HN     13 TYR  QE      4.97 #SUP  0.88  #QF  0.88
 13 TYR  HA     13 TYR  QE      5.05 #SUP  0.88  #QF  0.88
 12 PRO  QD     13 TYR  QE      4.40 #SUP  0.87  #QF  0.87
 12 PRO  HG3    13 TYR  QE      4.92 #SUP  0.86  #QF  0.86
 12 PRO  HG2    13 TYR  QE      4.92 #SUP  0.87  #QF  0.87
 28 LEU  QD1    32 GLN  HG2     4.73 #SUP  0.88  #QF  0.75
 10 GLU  HN     10 GLU  QB      3.62 
 11 LYS  HN     11 LYS  QB      3.68 
 11 LYS  HN     11 LYS  QG      4.45 
 11 LYS  HA     11 LYS  QG      3.59 
 11 LYS  QB     11 LYS  QE      4.80 
 11 LYS  QB     12 PRO  QD      3.86 
 11 LYS  QB     13 TYR  HN      4.68 
 11 LYS  QB     21 ALA  QB      3.49 
 11 LYS  QG     11 LYS  QE      3.52 
 11 LYS  QG     12 PRO  QD      3.84 
 12 PRO  QB     13 TYR  HN      3.93 
 12 PRO  QB     13 TYR  QD      4.70 
 12 PRO  QB     13 TYR  QE      4.63 
 12 PRO  QG     13 TYR  HN      4.74 
 12 PRO  QG     13 TYR  QD      4.22 
 12 PRO  QG     13 TYR  QE      4.04 
 13 TYR  QE     25 HIS  QB      4.09 
 15 CYSS HN     20 LYS  QB      4.35 
 15 CYSS HA     32 GLN  QE2     4.76 
 15 CYSS HB2    20 LYS  QB      4.60 
 16 ASP  HN     32 GLN  QE2     4.48 
 16 ASP  HA     19 ARG  QD      4.49 
 16 ASP  QB     17 VAL  QQG     4.11 
 17 VAL  HN     17 VAL  QQG     3.10 
 17 VAL  QQG    18 CYSS HN      3.47 
 17 VAL  QQG    18 CYSS HA      4.63 
 17 VAL  QQG    18 CYSS QB      4.17 
 17 VAL  QQG    35 HIS  QB      3.53 
 17 VAL  QG2    35 HIS  HB3     5.90 
 17 VAL  QQG    35 HIS  HD2     3.89 
 17 VAL  QQG    35 HIS  HE1     4.45 
 18 CYSS HN     18 CYSS QB      3.28 
 18 CYSS QB     35 HIS  HE1     3.44 
 19 ARG  HN     19 ARG  QG      3.74 
 19 ARG  HN     20 LYS  QB      5.18 
 19 ARG  HA     19 ARG  QG      3.57 
 20 LYS  HN     20 LYS  QB      3.14 
 20 LYS  HN     20 LYS  QG      5.06 
 20 LYS  HN     20 LYS  QD      5.34 
 20 LYS  HA     20 LYS  QG      3.57 
 20 LYS  HA     20 LYS  QD      4.23 
 20 LYS  QB     20 LYS  QD      3.24 
 20 LYS  QB     20 LYS  QE      5.18 
 20 LYS  QB     22 PHE  QE      3.56 
 20 LYS  QB     22 PHE  HZ      3.70 
 20 LYS  QB     31 HIS  HE1     5.13 
 20 LYS  QG     21 ALA  HN      4.07 
 20 LYS  QG     22 PHE  QE      4.83 
 20 LYS  QG     22 PHE  HZ      5.04 
 20 LYS  QD     21 ALA  HN      4.79 
 20 LYS  QD     22 PHE  QE      4.78 
 20 LYS  QD     22 PHE  HZ      4.12 
 20 LYS  QD     31 HIS  HE1     4.26 
 22 PHE  HB2    27 SER  QB      3.99 
 22 PHE  HB3    24 HIS  QB      5.34 
 22 PHE  HB3    27 SER  QB      3.59 
 22 PHE  QD     27 SER  QB      3.47 
 22 PHE  QD     31 HIS  QB      5.20 
 22 PHE  QE     31 HIS  QB      3.67 
 22 PHE  HZ     31 HIS  QB      3.78 
 23 SER  QB     24 HIS  HN      4.13 
 24 HIS  HN     24 HIS  QB      3.42 
 24 HIS  HN     27 SER  QB      3.91 
 24 HIS  QB     26 ALA  QB      4.36 
 24 HIS  QB     27 SER  HN      3.82 
 24 HIS  QB     27 SER  QB      4.08 
 24 HIS  QB     28 LEU  HN      5.34 
 25 HIS  HA     27 SER  QB      5.34 
 27 SER  HN     27 SER  QB      3.42 
 27 SER  HA     30 GLN  QB      3.45 
 27 SER  QB     28 LEU  HN      3.48 
 28 LEU  HA     31 HIS  QB      3.83 
 28 LEU  HG     32 GLN  QG      4.24 
 28 LEU  HG     32 GLN  QE2     5.34 
 28 LEU  QD1    31 HIS  QB      4.13 
 28 LEU  QD1    32 GLN  QG      4.10 
 28 LEU  QD1    32 GLN  QE2     3.91 
 29 THR  HA     32 GLN  QG      4.23 
 30 GLN  HN     30 GLN  QB      3.02 
 30 GLN  HA     33 ARG  QG      3.87 
 30 GLN  QB     31 HIS  HN      3.40 
 30 GLN  QG     31 HIS  HN      4.81 
 31 HIS  HN     31 HIS  QB      2.80 
 31 HIS  HA     34 VAL  QQG     3.81 
 31 HIS  QB     31 HIS  HD2     3.48 
 31 HIS  QB     32 GLN  HN      3.43 
 31 HIS  HD2    32 GLN  QG      4.09 
 31 HIS  HE1    34 VAL  QQG     3.71 
 32 GLN  HN     32 GLN  QG      3.66 
 32 GLN  HA     32 GLN  QG      3.27 
 32 GLN  QG     35 HIS  HD2     4.74 
 33 ARG  HN     34 VAL  QQG     4.38 
 33 ARG  HA     33 ARG  QG      3.37 
 34 VAL  HA     34 VAL  QQG     3.02 
 34 VAL  QQG    35 HIS  HN      3.69 
 34 VAL  QQG    35 HIS  HD2     5.03 
 34 VAL  QQG    35 HIS  HE1     4.49 
 35 HIS  HN     35 HIS  QB      3.20 
 35 HIS  QB     35 HIS  HD2     3.36 
 38 GLU  HN     38 GLU  QB      3.60 
 38 GLU  HN     38 GLU  QG      4.45 
 38 GLU  HA     38 GLU  QG      3.68 
 38 GLU  QB     39 LYS  HN      4.30 
 39 LYS  HN     39 LYS  QB      3.60 
 39 LYS  HA     40 PRO  QD      2.99 
 39 LYS  QB     40 PRO  QD      3.82 
     25   HIS  PHI   -88.00     -28.00
     25   HIS  PSI   -71.00     -11.00
     26   ALA  PHI   -90.00     -30.00
     26   ALA  PSI   -69.00      -9.00
     27   SER  PHI   -97.00     -37.00
     27   SER  PSI   -67.00      -7.00
     28   LEU  PHI   -91.00     -31.00
     28   LEU  PSI   -73.00     -13.00
     29   THR  PHI   -94.00     -34.00
     29   THR  PSI   -74.00     -14.00
     30   GLN  PHI   -95.00     -35.00
     30   GLN  PSI   -66.00      -6.00
     31   HIS  PHI   -94.00     -34.00
     31   HIS  PSI   -73.00     -13.00
     32   GLN  PHI   -94.00     -34.00
     32   GLN  PSI   -72.00     -12.00
     33   ARG  PHI   -93.00     -33.00
     33   ARG  PSI   -69.00      -9.00


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1 -11.127 -30.022  -5.626
    2    HA2  GLY   1           1HA      GLY   1 -12.342 -27.420  -5.950
    3    HA3  GLY   1           2HA      GLY   1 -12.307 -28.382  -4.480
    4    H    SER   2           H        SER   2 -11.897 -26.204  -3.545
    5    HA   SER   2           HA       SER   2  -9.279 -25.065  -3.990
    6    HB2  SER   2           1HB      SER   2  -9.964 -23.459  -2.206
    7    HB3  SER   2           2HB      SER   2 -11.117 -23.549  -3.538
    8    HG   SER   2           HG       SER   2 -11.336 -24.851  -1.024
    9    H    SER   3           H        SER   3  -7.824 -26.654  -3.357
   10    HA   SER   3           HA       SER   3  -7.740 -27.172  -0.457
   11    HB2  SER   3           1HB      SER   3  -7.338 -29.035  -2.764
   12    HB3  SER   3           2HB      SER   3  -6.428 -29.309  -1.278
   13    HG   SER   3           HG       SER   3  -8.219 -30.350  -0.795
   14    H    GLY   4           H        GLY   4  -5.762 -27.076  -3.419
   15    HA2  GLY   4           1HA      GLY   4  -3.438 -26.346  -1.770
   16    HA3  GLY   4           2HA      GLY   4  -3.369 -26.963  -3.414
   17    H    SER   5           H        SER   5  -3.083 -24.245  -1.535
   18    HA   SER   5           HA       SER   5  -3.248 -22.529  -3.904
   19    HB2  SER   5           1HB      SER   5  -4.290 -20.728  -2.516
   20    HB3  SER   5           2HB      SER   5  -5.340 -22.125  -2.756
   21    HG   SER   5           HG       SER   5  -3.788 -21.534  -0.453
   22    H    SER   6           H        SER   6  -1.689 -20.980  -4.030
   23    HA   SER   6           HA       SER   6   0.449 -21.150  -2.054
   24    HB2  SER   6           1HB      SER   6   1.830 -20.025  -3.702
   25    HB3  SER   6           2HB      SER   6   0.963 -21.345  -4.487
   26    HG   SER   6           HG       SER   6  -0.222 -19.943  -5.584
   27    H    GLY   7           H        GLY   7  -1.822 -19.871  -1.096
   28    HA2  GLY   7           1HA      GLY   7  -2.639 -17.849  -0.302
   29    HA3  GLY   7           2HA      GLY   7  -0.967 -17.688   0.213
   30    H    THR   8           H        THR   8  -2.430 -17.566  -3.024
   31    HA   THR   8           HA       THR   8  -0.899 -15.733  -4.234
   32    HB   THR   8           HB       THR   8  -2.861 -14.954  -5.524
   33    HG1  THR   8           HG1      THR   8  -4.866 -15.327  -4.835
   34   HG21  THR   8          3HG2      THR   8  -2.601 -16.838  -6.681
   35   HG22  THR   8          1HG2      THR   8  -3.656 -17.685  -5.551
   36   HG23  THR   8          2HG2      THR   8  -1.918 -17.621  -5.257
   37    H    GLY   9           H        GLY   9  -3.527 -14.945  -1.981
   38    HA2  GLY   9           1HA      GLY   9  -2.203 -12.532  -1.172
   39    HA3  GLY   9           2HA      GLY   9  -3.616 -12.214  -2.168
   40    H    GLU  10           H        GLU  10  -2.876 -11.850   0.790
   41    HA   GLU  10           HA       GLU  10  -5.228 -13.215   1.922
   42    HB2  GLU  10           1HB      GLU  10  -4.158 -12.896   4.124
   43    HB3  GLU  10           2HB      GLU  10  -3.170 -13.858   3.034
   44    HG2  GLU  10           1HG      GLU  10  -1.863 -11.802   2.515
   45    HG3  GLU  10           2HG      GLU  10  -2.777 -10.970   3.771
   46    H    LYS  11           H        LYS  11  -3.980 -10.222   0.982
   47    HA   LYS  11           HA       LYS  11  -6.260  -8.857   2.181
   48    HB2  LYS  11           1HB      LYS  11  -3.382  -8.130   2.674
   49    HB3  LYS  11           2HB      LYS  11  -4.659  -6.926   2.777
   50    HG2  LYS  11           1HG      LYS  11  -4.655  -9.479   4.366
   51    HG3  LYS  11           2HG      LYS  11  -3.981  -7.957   4.952
   52    HD2  LYS  11           1HD      LYS  11  -6.214  -6.907   4.559
   53    HD3  LYS  11           2HD      LYS  11  -6.844  -8.512   4.181
   54    HE2  LYS  11           1HE      LYS  11  -6.118  -9.267   6.431
   55    HE3  LYS  11           2HE      LYS  11  -5.634  -7.611   6.793
   56    HZ1  LYS  11           3HZ      LYS  11  -7.706  -7.391   7.549
   57    HZ2  LYS  11           1HZ      LYS  11  -8.255  -8.791   6.775
   58    HZ3  LYS  11           2HZ      LYS  11  -8.182  -7.330   5.927
   59    HA   PRO  12           HA       PRO  12  -6.421  -6.893  -1.748
   60    HB2  PRO  12           1HB      PRO  12  -7.761  -4.626  -1.088
   61    HB3  PRO  12           2HB      PRO  12  -8.537  -6.212  -1.167
   62    HG2  PRO  12           1HG      PRO  12  -7.539  -4.709   1.222
   63    HG3  PRO  12           2HG      PRO  12  -9.047  -5.620   1.024
   64    HD2  PRO  12           1HD      PRO  12  -6.892  -6.632   2.315
   65    HD3  PRO  12           2HD      PRO  12  -8.017  -7.649   1.391
   66    H    TYR  13           H        TYR  13  -4.740  -5.556   0.902
   67    HA   TYR  13           HA       TYR  13  -3.260  -3.794  -0.918
   68    HB2  TYR  13           1HB      TYR  13  -3.988  -2.969   1.893
   69    HB3  TYR  13           2HB      TYR  13  -3.231  -1.985   0.646
   70    HD1  TYR  13           HD2      TYR  13  -4.583  -1.293  -1.352
   71    HD2  TYR  13           HD1      TYR  13  -6.344  -3.150   2.047
   72    HE1  TYR  13           HE2      TYR  13  -6.794  -0.485  -2.063
   73    HE2  TYR  13           HE1      TYR  13  -8.560  -2.349   1.344
   74    HH   TYR  13           HH       TYR  13  -9.705  -1.168  -0.144
   75    H    GLU  14           H        GLU  14  -1.196  -4.354  -0.909
   76    HA   GLU  14           HA       GLU  14   0.075  -5.119   1.615
   77    HB2  GLU  14           1HB      GLU  14  -0.564  -7.214   0.489
   78    HB3  GLU  14           2HB      GLU  14   0.323  -6.711  -0.944
   79    HG2  GLU  14           1HG      GLU  14   2.393  -6.948   0.109
   80    HG3  GLU  14           2HG      GLU  14   1.672  -6.970   1.717
   81    H    CYS  15           H        CYS  15   1.977  -4.147   1.895
   82    HA   CYS  15           HA       CYS  15   2.964  -2.273   0.031
   83    HB2  CYS  15           1HB      CYS  15   3.262  -2.352   2.598
   84    HB3  CYS  15           2HB      CYS  15   4.621  -3.420   2.265
   85    H    ASP  16           H        ASP  16   4.351  -2.463  -1.607
   86    HA   ASP  16           HA       ASP  16   5.417  -5.079  -2.247
   87    HB2  ASP  16           1HB      ASP  16   5.319  -2.445  -3.704
   88    HB3  ASP  16           2HB      ASP  16   6.274  -3.796  -4.308
   89    H    VAL  17           H        VAL  17   6.468  -3.422   0.029
   90    HA   VAL  17           HA       VAL  17   9.297  -3.441  -0.795
   91    HB   VAL  17           HB       VAL  17   7.994  -1.521   1.142
   92   HG11  VAL  17          1HG1      VAL  17  10.783  -2.305   0.692
   93   HG12  VAL  17          2HG1      VAL  17  10.498  -0.564   0.674
   94   HG13  VAL  17          3HG1      VAL  17  10.033  -1.521   2.082
   95   HG21  VAL  17          3HG2      VAL  17   8.175   0.133  -0.452
   96   HG22  VAL  17          1HG2      VAL  17   9.442  -0.713  -1.340
   97   HG23  VAL  17          2HG2      VAL  17   7.770  -1.263  -1.451
   98    H    CYS  18           H        CYS  18   7.191  -3.467   2.085
   99    HA   CYS  18           HA       CYS  18   9.092  -5.325   3.351
  100    HB2  CYS  18           1HB      CYS  18   8.039  -4.599   5.502
  101    HB3  CYS  18           2HB      CYS  18   8.868  -3.306   4.641
  102    H    ARG  19           H        ARG  19   6.256  -5.321   1.721
  103    HA   ARG  19           HA       ARG  19   4.544  -6.798   1.482
  104    HB2  ARG  19           1HB      ARG  19   6.498  -8.476   3.044
  105    HB3  ARG  19           2HB      ARG  19   4.940  -9.107   2.530
  106    HG2  ARG  19           1HG      ARG  19   6.474  -9.800   0.898
  107    HG3  ARG  19           2HG      ARG  19   5.602  -8.445   0.178
  108    HD2  ARG  19           1HD      ARG  19   7.936  -8.191  -0.306
  109    HD3  ARG  19           2HD      ARG  19   7.470  -6.956   0.863
  110    HE   ARG  19           HE       ARG  19   8.844  -7.944   2.420
  111   HH11  ARG  19          1HH1      ARG  19   8.466 -10.054  -0.323
  112   HH12  ARG  19          2HH1      ARG  19   9.711 -11.148   0.182
  113   HH21  ARG  19          1HH2      ARG  19  10.485  -9.377   3.095
  114   HH22  ARG  19          2HH2      ARG  19  10.859 -10.762   2.127
  115    H    LYS  20           H        LYS  20   4.078  -4.887   3.345
  116    HA   LYS  20           HA       LYS  20   3.150  -6.106   5.804
  117    HB2  LYS  20           1HB      LYS  20   3.398  -3.337   4.746
  118    HB3  LYS  20           2HB      LYS  20   2.174  -3.623   5.976
  119    HG2  LYS  20           1HG      LYS  20   4.915  -4.649   6.471
  120    HG3  LYS  20           2HG      LYS  20   4.634  -2.911   6.598
  121    HD2  LYS  20           1HD      LYS  20   4.175  -3.546   8.749
  122    HD3  LYS  20           2HD      LYS  20   2.567  -3.701   8.038
  123    HE2  LYS  20           1HE      LYS  20   2.758  -6.045   7.871
  124    HE3  LYS  20           2HE      LYS  20   4.498  -6.002   8.154
  125    HZ1  LYS  20           3HZ      LYS  20   3.609  -6.695  10.168
  126    HZ2  LYS  20           1HZ      LYS  20   2.308  -5.616  10.096
  127    HZ3  LYS  20           2HZ      LYS  20   3.866  -5.041  10.417
  128    H    ALA  21           H        ALA  21   0.876  -5.498   6.548
  129    HA   ALA  21           HA       ALA  21  -1.037  -5.696   4.319
  130    HB1  ALA  21           3HB      ALA  21  -1.196  -7.864   4.987
  131    HB2  ALA  21           1HB      ALA  21  -0.696  -7.509   6.641
  132    HB3  ALA  21           2HB      ALA  21  -2.342  -7.149   6.120
  133    H    PHE  22           H        PHE  22  -2.649  -4.270   4.415
  134    HA   PHE  22           HA       PHE  22  -3.232  -2.991   7.004
  135    HB2  PHE  22           1HB      PHE  22  -3.204  -1.672   4.280
  136    HB3  PHE  22           2HB      PHE  22  -3.670  -0.892   5.788
  137    HD1  PHE  22           HD2      PHE  22  -2.005  -0.302   7.451
  138    HD2  PHE  22           HD1      PHE  22  -0.897  -2.130   3.770
  139    HE1  PHE  22           HE2      PHE  22   0.338   0.339   7.842
  140    HE2  PHE  22           HE1      PHE  22   1.448  -1.492   4.156
  141    HZ   PHE  22           HZ       PHE  22   2.068  -0.255   6.193
  142    H    SER  23           H        SER  23  -5.413  -2.002   7.108
  143    HA   SER  23           HA       SER  23  -7.358  -3.843   5.972
  144    HB2  SER  23           1HB      SER  23  -8.951  -2.644   7.515
  145    HB3  SER  23           2HB      SER  23  -7.596  -3.429   8.326
  146    HG   SER  23           HG       SER  23  -7.875  -0.672   7.716
  147    H    HIS  24           H        HIS  24  -6.742  -0.349   6.073
  148    HA   HIS  24           HA       HIS  24  -8.775   0.062   4.005
  149    HB2  HIS  24           1HB      HIS  24  -8.892   1.548   5.938
  150    HB3  HIS  24           2HB      HIS  24  -7.225   2.053   5.676
  151    HD1  HIS  24           HD1      HIS  24 -10.113   1.845   3.205
  152    HD2  HIS  24           HD2      HIS  24  -7.432   4.598   4.786
  153    HE1  HIS  24           HE1      HIS  24 -10.545   3.991   1.968
  154    H    HIS  25           H        HIS  25  -8.286   1.339   2.123
  155    HA   HIS  25           HA       HIS  25  -5.915   0.533   0.822
  156    HB2  HIS  25           1HB      HIS  25  -7.988   1.028  -0.396
  157    HB3  HIS  25           2HB      HIS  25  -7.864   2.722   0.068
  158    HD1  HIS  25           HD1      HIS  25  -7.774   3.401  -2.442
  159    HD2  HIS  25           HD2      HIS  25  -4.624   0.996  -1.192
  160    HE1  HIS  25           HE1      HIS  25  -6.053   3.542  -4.271
  161    H    ALA  26           H        ALA  26  -6.960   3.772   1.893
  162    HA   ALA  26           HA       ALA  26  -4.739   5.235   1.240
  163    HB1  ALA  26           3HB      ALA  26  -7.018   5.753   2.610
  164    HB2  ALA  26           1HB      ALA  26  -5.817   5.871   3.897
  165    HB3  ALA  26           2HB      ALA  26  -5.670   6.879   2.457
  166    H    SER  27           H        SER  27  -5.256   3.416   4.255
  167    HA   SER  27           HA       SER  27  -3.029   4.018   5.682
  168    HB2  SER  27           1HB      SER  27  -4.450   1.389   5.318
  169    HB3  SER  27           2HB      SER  27  -3.070   1.537   6.405
  170    HG   SER  27           HG       SER  27  -4.206   2.842   7.703
  171    H    LEU  28           H        LEU  28  -3.180   2.148   2.748
  172    HA   LEU  28           HA       LEU  28  -0.494   1.136   2.959
  173    HB2  LEU  28           1HB      LEU  28  -2.207  -0.107   1.755
  174    HB3  LEU  28           2HB      LEU  28  -2.400   1.230   0.624
  175    HG   LEU  28           HG       LEU  28   0.001   0.845  -0.055
  176   HD11  LEU  28          1HD1      LEU  28  -0.253  -1.146   2.042
  177   HD12  LEU  28          2HD1      LEU  28   1.190  -0.493   1.268
  178   HD13  LEU  28          3HD1      LEU  28   0.319  -1.832   0.521
  179   HD21  LEU  28          3HD2      LEU  28  -1.200  -1.685  -0.772
  180   HD22  LEU  28          1HD2      LEU  28  -0.850  -0.277  -1.776
  181   HD23  LEU  28          2HD2      LEU  28  -2.364  -0.363  -0.876
  182    H    THR  29           H        THR  29  -2.100   3.487   0.811
  183    HA   THR  29           HA       THR  29   0.199   4.379  -0.499
  184    HB   THR  29           HB       THR  29  -2.272   4.869  -1.052
  185    HG1  THR  29           HG1      THR  29  -0.151   6.741  -1.278
  186   HG21  THR  29          3HG2      THR  29  -3.418   6.365   0.148
  187   HG22  THR  29          1HG2      THR  29  -2.087   7.521   0.104
  188   HG23  THR  29          2HG2      THR  29  -2.127   6.268   1.345
  189    H    GLN  30           H        GLN  30  -0.957   5.021   2.680
  190    HA   GLN  30           HA       GLN  30   0.606   7.435   3.019
  191    HB2  GLN  30           1HB      GLN  30  -1.640   6.889   4.156
  192    HB3  GLN  30           2HB      GLN  30  -0.695   5.867   5.231
  193    HG2  GLN  30           1HG      GLN  30  -0.962   7.930   6.332
  194    HG3  GLN  30           2HG      GLN  30   0.702   7.888   5.751
  195   HE21  GLN  30          1HE2      GLN  30   1.256   9.145   3.916
  196   HE22  GLN  30          2HE2      GLN  30   0.325  10.535   3.483
  197    H    HIS  31           H        HIS  31   0.680   4.094   4.219
  198    HA   HIS  31           HA       HIS  31   2.937   4.312   5.844
  199    HB2  HIS  31           1HB      HIS  31   1.790   2.321   6.142
  200    HB3  HIS  31           2HB      HIS  31   1.608   2.046   4.412
  201    HD1  HIS  31           HD1      HIS  31   3.882   1.403   7.272
  202    HD2  HIS  31           HD2      HIS  31   3.852   0.854   3.153
  203    HE1  HIS  31           HE1      HIS  31   5.780  -0.175   6.790
  204    H    GLN  32           H        GLN  32   2.684   3.463   2.407
  205    HA   GLN  32           HA       GLN  32   5.155   2.727   1.695
  206    HB2  GLN  32           1HB      GLN  32   3.358   4.726   0.336
  207    HB3  GLN  32           2HB      GLN  32   4.855   4.167  -0.398
  208    HG2  GLN  32           1HG      GLN  32   3.892   1.804  -0.001
  209    HG3  GLN  32           2HG      GLN  32   2.351   2.643   0.174
  210   HE21  GLN  32          1HE2      GLN  32   3.140   0.748  -1.852
  211   HE22  GLN  32          2HE2      GLN  32   3.009   1.562  -3.371
  212    H    ARG  33           H        ARG  33   4.269   5.890   2.860
  213    HA   ARG  33           HA       ARG  33   6.359   7.473   2.061
  214    HB2  ARG  33           1HB      ARG  33   4.721   7.374   4.561
  215    HB3  ARG  33           2HB      ARG  33   6.094   8.471   4.485
  216    HG2  ARG  33           1HG      ARG  33   5.121   9.462   2.429
  217    HG3  ARG  33           2HG      ARG  33   3.703   8.436   2.658
  218    HD2  ARG  33           1HD      ARG  33   3.045   9.559   4.581
  219    HD3  ARG  33           2HD      ARG  33   4.656  10.218   4.864
  220    HE   ARG  33           HE       ARG  33   2.606  11.300   3.132
  221   HH11  ARG  33          1HH1      ARG  33   5.973  11.294   4.017
  222   HH12  ARG  33          2HH1      ARG  33   6.286  12.861   3.346
  223   HH21  ARG  33          1HH2      ARG  33   3.006  13.363   2.245
  224   HH22  ARG  33          2HH2      ARG  33   4.597  14.037   2.339
  225    H    VAL  34           H        VAL  34   6.292   5.435   4.986
  226    HA   VAL  34           HA       VAL  34   8.695   5.877   6.106
  227    HB   VAL  34           HB       VAL  34   8.820   3.461   6.699
  228   HG11  VAL  34          1HG1      VAL  34   6.200   3.550   7.473
  229   HG12  VAL  34          2HG1      VAL  34   7.537   4.340   8.312
  230   HG13  VAL  34          3HG1      VAL  34   6.554   5.249   7.163
  231   HG21  VAL  34          3HG2      VAL  34   6.272   2.659   5.683
  232   HG22  VAL  34          1HG2      VAL  34   7.299   3.171   4.344
  233   HG23  VAL  34          2HG2      VAL  34   7.849   1.907   5.444
  234    H    HIS  35           H        HIS  35   8.157   4.433   2.997
  235    HA   HIS  35           HA       HIS  35  11.001   3.754   2.751
  236    HB2  HIS  35           1HB      HIS  35   8.825   3.115   0.762
  237    HB3  HIS  35           2HB      HIS  35  10.418   2.377   0.898
  238    HD1  HIS  35           HD1      HIS  35  10.670   1.277   3.550
  239    HD2  HIS  35           HD2      HIS  35   6.957   1.416   1.690
  240    HE1  HIS  35           HE1      HIS  35   9.267  -0.453   4.718
  241    H    SER  36           H        SER  36  12.325   4.723   1.280
  242    HA   SER  36           HA       SER  36  11.733   7.340   0.449
  243    HB2  SER  36           1HB      SER  36  14.032   6.188   0.820
  244    HB3  SER  36           2HB      SER  36  13.871   5.679  -0.861
  245    HG   SER  36           HG       SER  36  14.531   8.106   0.149
  246    H    GLY  37           H        GLY  37  12.087   4.362  -1.485
  247    HA2  GLY  37           1HA      GLY  37  11.032   3.730  -3.434
  248    HA3  GLY  37           2HA      GLY  37   9.949   5.099  -3.231
  249    H    GLU  38           H        GLU  38  10.875   4.327  -5.727
  250    HA   GLU  38           HA       GLU  38  12.997   6.223  -6.405
  251    HB2  GLU  38           1HB      GLU  38  11.728   3.914  -7.846
  252    HB3  GLU  38           2HB      GLU  38  12.659   5.116  -8.728
  253    HG2  GLU  38           1HG      GLU  38  14.303   3.616  -8.315
  254    HG3  GLU  38           2HG      GLU  38  14.443   4.590  -6.853
  255    H    LYS  39           H        LYS  39  11.676   8.101  -6.046
  256    HA   LYS  39           HA       LYS  39  10.035   8.737  -8.388
  257    HB2  LYS  39           1HB      LYS  39   9.219   9.143  -5.509
  258    HB3  LYS  39           2HB      LYS  39   8.434   9.952  -6.859
  259    HG2  LYS  39           1HG      LYS  39   8.645   6.962  -6.651
  260    HG3  LYS  39           2HG      LYS  39   7.294   7.884  -5.986
  261    HD2  LYS  39           1HD      LYS  39   6.776   8.758  -8.195
  262    HD3  LYS  39           2HD      LYS  39   8.165   7.907  -8.876
  263    HE2  LYS  39           1HE      LYS  39   6.352   6.528  -9.385
  264    HE3  LYS  39           2HE      LYS  39   7.068   5.781  -7.957
  265    HZ1  LYS  39           3HZ      LYS  39   5.240   6.161  -6.762
  266    HZ2  LYS  39           1HZ      LYS  39   4.459   6.432  -8.239
  267    HZ3  LYS  39           2HZ      LYS  39   5.053   7.738  -7.343
  268    HA   PRO  40           HA       PRO  40  12.424  12.434  -8.394
  269    HB2  PRO  40           1HB      PRO  40  10.774  14.016  -9.858
  270    HB3  PRO  40           2HB      PRO  40  11.725  12.705 -10.566
  271    HG2  PRO  40           1HG      PRO  40   8.839  12.736  -9.772
  272    HG3  PRO  40           2HG      PRO  40   9.591  12.061 -11.229
  273    HD2  PRO  40           1HD      PRO  40   8.869  10.526  -9.118
  274    HD3  PRO  40           2HD      PRO  40  10.266  10.142 -10.144
  275    H    SER  41           H        SER  41  12.305  14.736  -7.801
  276    HA   SER  41           HA       SER  41  10.973  15.095  -5.324
  277    HB2  SER  41           1HB      SER  41  13.133  16.168  -5.844
  278    HB3  SER  41           2HB      SER  41  12.341  17.156  -7.072
  279    HG   SER  41           HG       SER  41  12.588  17.686  -4.511
  280    H    GLY  42           H        GLY  42   9.035  15.927  -4.859
  281    HA2  GLY  42           1HA      GLY  42   7.475  17.059  -7.090
  282    HA3  GLY  42           2HA      GLY  42   6.788  16.246  -5.692
  283    HA   PRO  43           HA       PRO  43   6.526  20.860  -5.084
  284    HB2  PRO  43           1HB      PRO  43   3.875  20.889  -4.499
  285    HB3  PRO  43           2HB      PRO  43   4.496  21.003  -6.150
  286    HG2  PRO  43           1HG      PRO  43   3.415  18.622  -4.693
  287    HG3  PRO  43           2HG      PRO  43   3.119  19.141  -6.362
  288    HD2  PRO  43           1HD      PRO  43   4.867  17.170  -5.739
  289    HD3  PRO  43           2HD      PRO  43   5.105  18.254  -7.124
  290    H    SER  44           H        SER  44   7.697  20.800  -3.178
  291    HA   SER  44           HA       SER  44   7.139  19.401  -0.866
  292    HB2  SER  44           1HB      SER  44   8.417  21.220   0.315
  293    HB3  SER  44           2HB      SER  44   9.237  20.555  -1.097
  294    HG   SER  44           HG       SER  44   8.995  22.401  -2.128
  295    H    SER  45           H        SER  45   6.098  19.923   1.088
  296    HA   SER  45           HA       SER  45   3.656  21.414   0.732
  297    HB2  SER  45           1HB      SER  45   4.107  19.188   2.091
  298    HB3  SER  45           2HB      SER  45   4.477  20.320   3.392
  299    HG   SER  45           HG       SER  45   2.384  21.266   2.967
  300    H    GLY  46           H        GLY  46   2.925  23.066   2.236
  301    HA2  GLY  46           1HA      GLY  46   3.871  24.474   4.174
  302    HA3  GLY  46           2HA      GLY  46   5.160  24.813   3.028
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1  10.454 -22.833  -4.834
    2    HA2  GLY   1           1HA      GLY   1  13.253 -22.515  -5.360
    3    HA3  GLY   1           2HA      GLY   1  12.312 -22.623  -6.841
    4    H    SER   2           H        SER   2  10.224 -21.172  -6.683
    5    HA   SER   2           HA       SER   2  10.513 -18.735  -5.205
    6    HB2  SER   2           1HB      SER   2  10.876 -17.234  -7.083
    7    HB3  SER   2           2HB      SER   2  12.195 -18.401  -7.007
    8    HG   SER   2           HG       SER   2  10.580 -19.585  -8.543
    9    H    SER   3           H        SER   3   8.571 -17.821  -4.932
   10    HA   SER   3           HA       SER   3   6.444 -18.408  -6.871
   11    HB2  SER   3           1HB      SER   3   4.870 -18.688  -4.913
   12    HB3  SER   3           2HB      SER   3   6.047 -19.986  -5.112
   13    HG   SER   3           HG       SER   3   5.734 -19.055  -2.919
   14    H    GLY   4           H        GLY   4   4.660 -16.907  -6.827
   15    HA2  GLY   4           1HA      GLY   4   4.614 -14.600  -5.197
   16    HA3  GLY   4           2HA      GLY   4   5.442 -14.229  -6.702
   17    H    SER   5           H        SER   5   2.484 -15.911  -5.632
   18    HA   SER   5           HA       SER   5   1.038 -14.483  -7.766
   19    HB2  SER   5           1HB      SER   5   1.390 -16.957  -8.200
   20    HB3  SER   5           2HB      SER   5   0.358 -17.267  -6.804
   21    HG   SER   5           HG       SER   5  -1.158 -17.158  -8.272
   22    H    SER   6           H        SER   6  -0.246 -13.035  -6.844
   23    HA   SER   6           HA       SER   6  -1.492 -13.674  -4.260
   24    HB2  SER   6           1HB      SER   6  -0.803 -11.078  -5.615
   25    HB3  SER   6           2HB      SER   6  -1.990 -11.131  -4.312
   26    HG   SER   6           HG       SER   6  -0.319 -11.052  -3.049
   27    H    GLY   7           H        GLY   7  -3.149 -14.977  -5.187
   28    HA2  GLY   7           1HA      GLY   7  -4.990 -13.748  -7.068
   29    HA3  GLY   7           2HA      GLY   7  -5.090 -15.379  -6.422
   30    H    THR   8           H        THR   8  -6.781 -15.722  -5.164
   31    HA   THR   8           HA       THR   8  -8.484 -13.665  -4.263
   32    HB   THR   8           HB       THR   8  -9.212 -16.014  -4.689
   33    HG1  THR   8           HG1      THR   8  -9.819 -15.253  -2.021
   34   HG21  THR   8          3HG2      THR   8  -7.142 -16.689  -2.997
   35   HG22  THR   8          1HG2      THR   8  -8.422 -17.771  -3.545
   36   HG23  THR   8          2HG2      THR   8  -8.574 -16.937  -1.998
   37    H    GLY   9           H        GLY   9  -8.927 -12.913  -2.162
   38    HA2  GLY   9           1HA      GLY   9  -7.679 -13.686   0.195
   39    HA3  GLY   9           2HA      GLY   9  -6.634 -12.482  -0.544
   40    H    GLU  10           H        GLU  10  -7.480 -11.754   1.807
   41    HA   GLU  10           HA       GLU  10  -9.884 -10.107   1.415
   42    HB2  GLU  10           1HB      GLU  10 -10.049 -11.560   3.336
   43    HB3  GLU  10           2HB      GLU  10  -8.490 -11.013   3.937
   44    HG2  GLU  10           1HG      GLU  10  -9.331  -8.906   4.528
   45    HG3  GLU  10           2HG      GLU  10 -10.796  -9.132   3.574
   46    H    LYS  11           H        LYS  11  -6.472 -10.004   1.915
   47    HA   LYS  11           HA       LYS  11  -6.584  -7.082   2.266
   48    HB2  LYS  11           1HB      LYS  11  -4.421  -9.065   2.982
   49    HB3  LYS  11           2HB      LYS  11  -4.212  -7.321   3.064
   50    HG2  LYS  11           1HG      LYS  11  -5.673  -7.099   4.850
   51    HG3  LYS  11           2HG      LYS  11  -6.451  -8.651   4.533
   52    HD2  LYS  11           1HD      LYS  11  -4.382  -9.803   5.207
   53    HD3  LYS  11           2HD      LYS  11  -3.644  -8.240   5.565
   54    HE2  LYS  11           1HE      LYS  11  -6.220  -9.086   6.849
   55    HE3  LYS  11           2HE      LYS  11  -4.662  -9.584   7.507
   56    HZ1  LYS  11           3HZ      LYS  11  -5.644  -6.806   7.153
   57    HZ2  LYS  11           1HZ      LYS  11  -4.060  -7.196   7.602
   58    HZ3  LYS  11           2HZ      LYS  11  -5.352  -7.607   8.614
   59    HA   PRO  12           HA       PRO  12  -5.122  -7.711  -2.063
   60    HB2  PRO  12           1HB      PRO  12  -6.431  -5.545  -3.046
   61    HB3  PRO  12           2HB      PRO  12  -7.193  -7.130  -2.870
   62    HG2  PRO  12           1HG      PRO  12  -7.365  -4.737  -1.080
   63    HG3  PRO  12           2HG      PRO  12  -8.654  -5.835  -1.606
   64    HD2  PRO  12           1HD      PRO  12  -7.485  -6.021   0.829
   65    HD3  PRO  12           2HD      PRO  12  -8.095  -7.439  -0.048
   66    H    TYR  13           H        TYR  13  -4.499  -5.640   0.422
   67    HA   TYR  13           HA       TYR  13  -2.758  -3.919  -1.213
   68    HB2  TYR  13           1HB      TYR  13  -3.719  -3.412   1.608
   69    HB3  TYR  13           2HB      TYR  13  -2.829  -2.295   0.580
   70    HD1  TYR  13           HD1      TYR  13  -6.088  -3.840   1.231
   71    HD2  TYR  13           HD2      TYR  13  -3.939  -1.102  -1.216
   72    HE1  TYR  13           HE1      TYR  13  -8.213  -2.938   0.385
   73    HE2  TYR  13           HE2      TYR  13  -6.058  -0.192  -2.069
   74    HH   TYR  13           HH       TYR  13  -8.286  -0.503  -2.172
   75    H    GLU  14           H        GLU  14  -0.627  -4.149  -1.034
   76    HA   GLU  14           HA       GLU  14   0.559  -5.147   1.423
   77    HB2  GLU  14           1HB      GLU  14  -0.054  -7.099  -0.181
   78    HB3  GLU  14           2HB      GLU  14   1.312  -6.532  -1.131
   79    HG2  GLU  14           1HG      GLU  14   2.797  -6.867   0.756
   80    HG3  GLU  14           2HG      GLU  14   1.436  -7.371   1.757
   81    H    CYS  15           H        CYS  15   2.651  -4.483   1.727
   82    HA   CYS  15           HA       CYS  15   3.579  -2.386  -0.035
   83    HB2  CYS  15           1HB      CYS  15   3.646  -2.250   2.486
   84    HB3  CYS  15           2HB      CYS  15   4.934  -3.449   2.446
   85    H    ASP  16           H        ASP  16   5.229  -2.487  -1.443
   86    HA   ASP  16           HA       ASP  16   6.443  -5.093  -1.913
   87    HB2  ASP  16           1HB      ASP  16   6.589  -2.535  -3.522
   88    HB3  ASP  16           2HB      ASP  16   7.255  -4.089  -4.015
   89    H    VAL  17           H        VAL  17   7.203  -3.381   0.386
   90    HA   VAL  17           HA       VAL  17  10.086  -3.256  -0.189
   91    HB   VAL  17           HB       VAL  17   8.543  -1.249   1.462
   92   HG11  VAL  17          1HG1      VAL  17  10.652  -1.534   2.491
   93   HG12  VAL  17          2HG1      VAL  17  11.486  -1.595   0.936
   94   HG13  VAL  17          3HG1      VAL  17  10.784  -0.079   1.505
   95   HG21  VAL  17          3HG2      VAL  17  10.148  -0.532  -0.942
   96   HG22  VAL  17          1HG2      VAL  17   8.547  -1.236  -1.170
   97   HG23  VAL  17          2HG2      VAL  17   8.730   0.260  -0.253
   98    H    CYS  18           H        CYS  18   7.575  -3.457   2.305
   99    HA   CYS  18           HA       CYS  18   9.474  -4.966   3.981
  100    HB2  CYS  18           1HB      CYS  18   8.164  -4.201   5.934
  101    HB3  CYS  18           2HB      CYS  18   8.874  -2.860   5.041
  102    H    ARG  19           H        ARG  19   6.748  -5.195   2.092
  103    HA   ARG  19           HA       ARG  19   5.196  -6.821   1.747
  104    HB2  ARG  19           1HB      ARG  19   7.157  -8.326   3.471
  105    HB3  ARG  19           2HB      ARG  19   5.704  -9.083   2.831
  106    HG2  ARG  19           1HG      ARG  19   7.616  -9.575   1.431
  107    HG3  ARG  19           2HG      ARG  19   6.448  -8.584   0.556
  108    HD2  ARG  19           1HD      ARG  19   7.808  -6.739   0.554
  109    HD3  ARG  19           2HD      ARG  19   8.641  -7.220   2.031
  110    HE   ARG  19           HE       ARG  19   9.464  -9.095   0.311
  111   HH11  ARG  19          1HH1      ARG  19   9.279  -5.630   0.032
  112   HH12  ARG  19          2HH1      ARG  19  10.627  -5.515  -1.051
  113   HH21  ARG  19          1HH2      ARG  19  11.240  -8.956  -1.113
  114   HH22  ARG  19          2HH2      ARG  19  11.741  -7.408  -1.702
  115    H    LYS  20           H        LYS  20   4.457  -4.940   3.560
  116    HA   LYS  20           HA       LYS  20   3.315  -6.359   5.851
  117    HB2  LYS  20           1HB      LYS  20   3.871  -3.504   5.205
  118    HB3  LYS  20           2HB      LYS  20   2.529  -3.851   6.289
  119    HG2  LYS  20           1HG      LYS  20   4.171  -5.232   7.642
  120    HG3  LYS  20           2HG      LYS  20   5.438  -4.484   6.668
  121    HD2  LYS  20           1HD      LYS  20   4.150  -2.274   7.374
  122    HD3  LYS  20           2HD      LYS  20   3.663  -3.290   8.733
  123    HE2  LYS  20           1HE      LYS  20   6.507  -2.798   7.854
  124    HE3  LYS  20           2HE      LYS  20   5.705  -1.989   9.200
  125    HZ1  LYS  20           3HZ      LYS  20   6.633  -3.654  10.364
  126    HZ2  LYS  20           1HZ      LYS  20   6.773  -4.681   9.027
  127    HZ3  LYS  20           2HZ      LYS  20   5.293  -4.539   9.834
  128    H    ALA  21           H        ALA  21   1.131  -6.542   6.209
  129    HA   ALA  21           HA       ALA  21  -0.585  -5.909   3.903
  130    HB1  ALA  21           3HB      ALA  21  -0.194  -8.318   5.152
  131    HB2  ALA  21           1HB      ALA  21  -1.692  -7.742   5.885
  132    HB3  ALA  21           2HB      ALA  21  -1.572  -7.901   4.132
  133    H    PHE  22           H        PHE  22  -2.310  -4.607   4.131
  134    HA   PHE  22           HA       PHE  22  -2.992  -3.707   6.853
  135    HB2  PHE  22           1HB      PHE  22  -3.100  -2.042   4.330
  136    HB3  PHE  22           2HB      PHE  22  -3.447  -1.491   5.966
  137    HD1  PHE  22           HD1      PHE  22  -0.755  -2.793   3.782
  138    HD2  PHE  22           HD2      PHE  22  -1.740  -0.703   7.357
  139    HE1  PHE  22           HE1      PHE  22   1.609  -2.176   4.069
  140    HE2  PHE  22           HE2      PHE  22   0.622  -0.081   7.649
  141    HZ   PHE  22           HZ       PHE  22   2.300  -0.818   6.003
  142    H    SER  23           H        SER  23  -5.202  -2.990   7.157
  143    HA   SER  23           HA       SER  23  -7.061  -4.757   5.867
  144    HB2  SER  23           1HB      SER  23  -7.472  -4.425   8.168
  145    HB3  SER  23           2HB      SER  23  -7.310  -2.675   8.032
  146    HG   SER  23           HG       SER  23  -9.313  -3.888   6.527
  147    H    HIS  24           H        HIS  24  -6.636  -1.232   6.023
  148    HA   HIS  24           HA       HIS  24  -8.533  -0.953   3.796
  149    HB2  HIS  24           1HB      HIS  24  -8.136   1.587   4.512
  150    HB3  HIS  24           2HB      HIS  24  -9.309   0.558   5.328
  151    HD1  HIS  24           HD1      HIS  24  -6.686   2.828   6.067
  152    HD2  HIS  24           HD2      HIS  24  -7.953  -0.778   7.697
  153    HE1  HIS  24           HE1      HIS  24  -5.717   2.761   8.387
  154    H    HIS  25           H        HIS  25  -7.912   1.143   2.446
  155    HA   HIS  25           HA       HIS  25  -5.333   0.524   1.266
  156    HB2  HIS  25           1HB      HIS  25  -6.047   2.073  -0.527
  157    HB3  HIS  25           2HB      HIS  25  -7.229   0.801  -0.231
  158    HD1  HIS  25           HD1      HIS  25  -6.818   4.455  -0.269
  159    HD2  HIS  25           HD2      HIS  25  -9.593   1.703   1.140
  160    HE1  HIS  25           HE1      HIS  25  -8.897   5.784   0.215
  161    H    ALA  26           H        ALA  26  -6.997   3.476   2.380
  162    HA   ALA  26           HA       ALA  26  -5.076   5.355   2.136
  163    HB1  ALA  26           3HB      ALA  26  -7.411   5.477   3.252
  164    HB2  ALA  26           1HB      ALA  26  -6.524   5.182   4.748
  165    HB3  ALA  26           2HB      ALA  26  -6.151   6.599   3.766
  166    H    SER  27           H        SER  27  -4.971   2.610   4.238
  167    HA   SER  27           HA       SER  27  -2.983   3.561   6.033
  168    HB2  SER  27           1HB      SER  27  -2.679   1.104   6.546
  169    HB3  SER  27           2HB      SER  27  -4.328   1.702   6.724
  170    HG   SER  27           HG       SER  27  -4.698   0.004   5.500
  171    H    LEU  28           H        LEU  28  -2.845   1.537   3.117
  172    HA   LEU  28           HA       LEU  28  -0.003   1.276   3.180
  173    HB2  LEU  28           1HB      LEU  28  -1.378  -0.400   2.106
  174    HB3  LEU  28           2HB      LEU  28  -2.000   0.799   0.973
  175    HG   LEU  28           HG       LEU  28   0.331   1.031   0.079
  176   HD11  LEU  28          1HD1      LEU  28   0.789  -1.336   1.883
  177   HD12  LEU  28          2HD1      LEU  28   1.623   0.217   1.912
  178   HD13  LEU  28          3HD1      LEU  28   1.858  -0.884   0.554
  179   HD21  LEU  28          3HD2      LEU  28  -0.246  -1.810  -0.324
  180   HD22  LEU  28          1HD2      LEU  28  -0.170  -0.488  -1.489
  181   HD23  LEU  28          2HD2      LEU  28  -1.638  -0.749  -0.547
  182    H    THR  29           H        THR  29  -2.212   3.095   1.053
  183    HA   THR  29           HA       THR  29  -0.478   4.392  -0.577
  184    HB   THR  29           HB       THR  29  -3.062   4.652  -0.333
  185    HG1  THR  29           HG1      THR  29  -1.817   7.070  -1.031
  186   HG21  THR  29          3HG2      THR  29  -3.061   5.689   1.869
  187   HG22  THR  29          1HG2      THR  29  -3.717   6.805   0.673
  188   HG23  THR  29          2HG2      THR  29  -2.070   7.015   1.265
  189    H    GLN  30           H        GLN  30  -1.139   5.163   2.798
  190    HA   GLN  30           HA       GLN  30   0.571   7.494   2.753
  191    HB2  GLN  30           1HB      GLN  30  -1.335   7.610   4.193
  192    HB3  GLN  30           2HB      GLN  30  -0.922   6.083   4.963
  193    HG2  GLN  30           1HG      GLN  30   1.002   8.349   5.116
  194    HG3  GLN  30           2HG      GLN  30  -0.430   8.359   6.144
  195   HE21  GLN  30          1HE2      GLN  30   2.619   7.877   6.443
  196   HE22  GLN  30          2HE2      GLN  30   2.686   6.506   7.492
  197    H    HIS  31           H        HIS  31   0.597   4.505   4.705
  198    HA   HIS  31           HA       HIS  31   3.021   4.629   5.871
  199    HB2  HIS  31           1HB      HIS  31   1.907   2.687   6.411
  200    HB3  HIS  31           2HB      HIS  31   1.472   2.345   4.739
  201    HD1  HIS  31           HD1      HIS  31   4.197   1.843   7.241
  202    HD2  HIS  31           HD2      HIS  31   3.371   0.883   3.284
  203    HE1  HIS  31           HE1      HIS  31   5.922   0.131   6.590
  204    H    GLN  32           H        GLN  32   2.539   3.203   2.635
  205    HA   GLN  32           HA       GLN  32   4.995   2.544   1.843
  206    HB2  GLN  32           1HB      GLN  32   2.849   4.017   0.359
  207    HB3  GLN  32           2HB      GLN  32   4.382   3.675  -0.433
  208    HG2  GLN  32           1HG      GLN  32   2.835   1.493   0.902
  209    HG3  GLN  32           2HG      GLN  32   2.420   2.033  -0.724
  210   HE21  GLN  32          1HE2      GLN  32   3.176   0.639  -2.138
  211   HE22  GLN  32          2HE2      GLN  32   4.741  -0.091  -2.115
  212    H    ARG  33           H        ARG  33   3.858   5.867   2.173
  213    HA   ARG  33           HA       ARG  33   5.839   7.322   1.008
  214    HB2  ARG  33           1HB      ARG  33   4.430   7.807   3.632
  215    HB3  ARG  33           2HB      ARG  33   5.492   8.993   2.884
  216    HG2  ARG  33           1HG      ARG  33   4.014   8.866   0.849
  217    HG3  ARG  33           2HG      ARG  33   2.890   7.923   1.831
  218    HD2  ARG  33           1HD      ARG  33   2.168  10.190   1.904
  219    HD3  ARG  33           2HD      ARG  33   2.878   9.812   3.473
  220    HE   ARG  33           HE       ARG  33   4.716  11.008   1.608
  221   HH11  ARG  33          1HH1      ARG  33   2.317  11.596   4.061
  222   HH12  ARG  33          2HH1      ARG  33   2.920  13.172   4.457
  223   HH21  ARG  33          1HH2      ARG  33   5.519  13.081   2.121
  224   HH22  ARG  33          2HH2      ARG  33   4.741  14.015   3.353
  225    H    VAL  34           H        VAL  34   5.928   6.161   4.381
  226    HA   VAL  34           HA       VAL  34   8.298   7.006   5.289
  227    HB   VAL  34           HB       VAL  34   8.585   4.898   6.522
  228   HG11  VAL  34          1HG1      VAL  34   7.109   6.204   7.674
  229   HG12  VAL  34          2HG1      VAL  34   5.950   6.262   6.345
  230   HG13  VAL  34          3HG1      VAL  34   6.076   4.814   7.345
  231   HG21  VAL  34          3HG2      VAL  34   7.014   3.864   4.317
  232   HG22  VAL  34          1HG2      VAL  34   8.015   3.007   5.489
  233   HG23  VAL  34          2HG2      VAL  34   6.341   3.401   5.879
  234    H    HIS  35           H        HIS  35   7.859   4.609   2.773
  235    HA   HIS  35           HA       HIS  35  10.709   4.045   2.639
  236    HB2  HIS  35           1HB      HIS  35   8.503   3.049   0.827
  237    HB3  HIS  35           2HB      HIS  35  10.135   2.401   0.962
  238    HD1  HIS  35           HD1      HIS  35  10.371   2.151   4.006
  239    HD2  HIS  35           HD2      HIS  35   7.012   1.016   1.840
  240    HE1  HIS  35           HE1      HIS  35   9.186   0.460   5.441
  241    H    SER  36           H        SER  36  11.895   5.620   1.752
  242    HA   SER  36           HA       SER  36  10.869   7.313  -0.338
  243    HB2  SER  36           1HB      SER  36  13.409   7.153   1.229
  244    HB3  SER  36           2HB      SER  36  13.413   8.042  -0.294
  245    HG   SER  36           HG       SER  36  11.455   8.497   1.691
  246    H    GLY  37           H        GLY  37  10.459   5.977  -2.098
  247    HA2  GLY  37           1HA      GLY  37  12.326   4.109  -3.135
  248    HA3  GLY  37           2HA      GLY  37  10.926   4.749  -3.984
  249    H    GLU  38           H        GLU  38  12.801   4.398  -5.662
  250    HA   GLU  38           HA       GLU  38  14.459   6.813  -5.821
  251    HB2  GLU  38           1HB      GLU  38  15.718   5.611  -7.557
  252    HB3  GLU  38           2HB      GLU  38  15.660   4.706  -6.051
  253    HG2  GLU  38           1HG      GLU  38  15.214   3.033  -7.514
  254    HG3  GLU  38           2HG      GLU  38  13.571   3.587  -7.200
  255    H    LYS  39           H        LYS  39  11.730   7.144  -6.290
  256    HA   LYS  39           HA       LYS  39  11.792   8.334  -8.888
  257    HB2  LYS  39           1HB      LYS  39  10.035   7.088  -9.941
  258    HB3  LYS  39           2HB      LYS  39  11.271   5.948  -9.427
  259    HG2  LYS  39           1HG      LYS  39   9.957   5.170  -7.636
  260    HG3  LYS  39           2HG      LYS  39   8.830   6.522  -7.777
  261    HD2  LYS  39           1HD      LYS  39   7.634   4.846  -8.803
  262    HD3  LYS  39           2HD      LYS  39   8.461   5.563 -10.189
  263    HE2  LYS  39           1HE      LYS  39   8.747   3.249 -10.445
  264    HE3  LYS  39           2HE      LYS  39  10.280   3.825  -9.793
  265    HZ1  LYS  39           3HZ      LYS  39   9.811   1.959  -8.529
  266    HZ2  LYS  39           1HZ      LYS  39   8.155   2.296  -8.433
  267    HZ3  LYS  39           2HZ      LYS  39   9.258   3.216  -7.540
  268    HA   PRO  40           HA       PRO  40   8.975  11.006  -6.814
  269    HB2  PRO  40           1HB      PRO  40   7.934  12.292  -8.966
  270    HB3  PRO  40           2HB      PRO  40   9.569  12.592  -8.366
  271    HG2  PRO  40           1HG      PRO  40   8.674  10.879 -10.653
  272    HG3  PRO  40           2HG      PRO  40  10.045  12.000 -10.564
  273    HD2  PRO  40           1HD      PRO  40  10.334   9.321 -10.295
  274    HD3  PRO  40           2HD      PRO  40  11.375  10.484  -9.448
  275    H    SER  41           H        SER  41   8.021   8.481  -8.846
  276    HA   SER  41           HA       SER  41   6.067   7.366  -9.189
  277    HB2  SER  41           1HB      SER  41   5.271   8.776  -6.629
  278    HB3  SER  41           2HB      SER  41   4.431   7.398  -7.338
  279    HG   SER  41           HG       SER  41   7.180   7.224  -6.783
  280    H    GLY  42           H        GLY  42   6.336   9.730 -10.635
  281    HA2  GLY  42           1HA      GLY  42   4.324  10.278 -12.087
  282    HA3  GLY  42           2HA      GLY  42   3.607  10.854 -10.589
  283    HA   PRO  43           HA       PRO  43   6.174  14.172 -12.857
  284    HB2  PRO  43           1HB      PRO  43   4.134  15.589 -13.953
  285    HB3  PRO  43           2HB      PRO  43   4.950  14.268 -14.798
  286    HG2  PRO  43           1HG      PRO  43   2.350  14.248 -13.315
  287    HG3  PRO  43           2HG      PRO  43   2.755  13.502 -14.872
  288    HD2  PRO  43           1HD      PRO  43   2.655  12.091 -12.563
  289    HD3  PRO  43           2HD      PRO  43   3.775  11.688 -13.881
  290    H    SER  44           H        SER  44   3.261  14.108 -10.929
  291    HA   SER  44           HA       SER  44   2.367  15.578  -9.415
  292    HB2  SER  44           1HB      SER  44   3.975  16.287  -7.689
  293    HB3  SER  44           2HB      SER  44   4.236  14.605  -8.154
  294    HG   SER  44           HG       SER  44   6.181  15.880  -8.019
  295    H    SER  45           H        SER  45   2.595  16.782 -11.905
  296    HA   SER  45           HA       SER  45   3.595  19.484 -11.335
  297    HB2  SER  45           1HB      SER  45   3.071  17.962 -13.865
  298    HB3  SER  45           2HB      SER  45   3.059  19.725 -13.892
  299    HG   SER  45           HG       SER  45   5.152  19.721 -13.723
  300    H    GLY  46           H        GLY  46   2.236  21.123 -10.990
  301    HA2  GLY  46           1HA      GLY  46   0.304  22.385 -10.999
  302    HA3  GLY  46           2HA      GLY  46  -0.371  21.258 -12.165
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1   9.158 -31.561   0.312
    2    HA2  GLY   1           1HA      GLY   1   6.711 -32.117   0.044
    3    HA3  GLY   1           2HA      GLY   1   7.013 -30.436   0.457
    4    H    SER   2           H        SER   2   6.276 -32.659  -2.160
    5    HA   SER   2           HA       SER   2   6.200 -31.140  -4.381
    6    HB2  SER   2           1HB      SER   2   4.026 -33.029  -3.448
    7    HB3  SER   2           2HB      SER   2   4.184 -32.425  -5.098
    8    HG   SER   2           HG       SER   2   5.651 -34.346  -3.763
    9    H    SER   3           H        SER   3   3.761 -31.080  -1.810
   10    HA   SER   3           HA       SER   3   2.368 -28.879  -3.117
   11    HB2  SER   3           1HB      SER   3   0.672 -29.162  -1.410
   12    HB3  SER   3           2HB      SER   3   1.094 -30.748  -2.056
   13    HG   SER   3           HG       SER   3   2.120 -31.246  -0.216
   14    H    GLY   4           H        GLY   4   3.338 -26.959  -2.882
   15    HA2  GLY   4           1HA      GLY   4   3.584 -25.833  -0.245
   16    HA3  GLY   4           2HA      GLY   4   5.137 -26.108  -1.021
   17    H    SER   5           H        SER   5   2.704 -23.902  -0.549
   18    HA   SER   5           HA       SER   5   3.804 -22.159  -2.607
   19    HB2  SER   5           1HB      SER   5   1.655 -23.450  -3.399
   20    HB3  SER   5           2HB      SER   5   0.817 -22.270  -2.391
   21    HG   SER   5           HG       SER   5   2.742 -21.386  -4.230
   22    H    SER   6           H        SER   6   3.545 -19.952  -2.177
   23    HA   SER   6           HA       SER   6   2.580 -19.347   0.541
   24    HB2  SER   6           1HB      SER   6   4.793 -17.997  -1.023
   25    HB3  SER   6           2HB      SER   6   4.239 -17.515   0.580
   26    HG   SER   6           HG       SER   6   6.108 -19.214   0.084
   27    H    GLY   7           H        GLY   7   1.173 -17.691   0.832
   28    HA2  GLY   7           1HA      GLY   7   0.531 -16.017  -1.509
   29    HA3  GLY   7           2HA      GLY   7  -0.748 -16.832  -0.621
   30    H    THR   8           H        THR   8  -0.948 -16.287   1.699
   31    HA   THR   8           HA       THR   8  -1.176 -14.795   3.406
   32    HB   THR   8           HB       THR   8   1.094 -13.232   2.170
   33    HG1  THR   8           HG1      THR   8   1.498 -15.082   4.243
   34   HG21  THR   8          3HG2      THR   8   1.413 -12.941   4.797
   35   HG22  THR   8          1HG2      THR   8  -0.330 -13.208   4.777
   36   HG23  THR   8          2HG2      THR   8   0.369 -11.875   3.857
   37    H    GLY   9           H        GLY   9  -2.728 -14.510   1.039
   38    HA2  GLY   9           1HA      GLY   9  -2.924 -11.611   0.647
   39    HA3  GLY   9           2HA      GLY   9  -3.718 -12.840  -0.327
   40    H    GLU  10           H        GLU  10  -3.825 -11.035   2.670
   41    HA   GLU  10           HA       GLU  10  -6.529 -12.055   3.192
   42    HB2  GLU  10           1HB      GLU  10  -4.578 -10.568   4.954
   43    HB3  GLU  10           2HB      GLU  10  -6.233 -10.928   5.424
   44    HG2  GLU  10           1HG      GLU  10  -5.834 -13.193   5.601
   45    HG3  GLU  10           2HG      GLU  10  -4.424 -13.132   4.544
   46    H    LYS  11           H        LYS  11  -4.757  -9.255   2.228
   47    HA   LYS  11           HA       LYS  11  -7.274  -7.787   1.938
   48    HB2  LYS  11           1HB      LYS  11  -4.777  -6.704   3.249
   49    HB3  LYS  11           2HB      LYS  11  -6.114  -5.697   2.708
   50    HG2  LYS  11           1HG      LYS  11  -6.689  -5.940   4.889
   51    HG3  LYS  11           2HG      LYS  11  -7.506  -7.356   4.224
   52    HD2  LYS  11           1HD      LYS  11  -5.689  -8.784   4.898
   53    HD3  LYS  11           2HD      LYS  11  -4.734  -7.392   5.415
   54    HE2  LYS  11           1HE      LYS  11  -5.656  -8.362   7.375
   55    HE3  LYS  11           2HE      LYS  11  -6.563  -6.883   7.063
   56    HZ1  LYS  11           3HZ      LYS  11  -8.392  -8.108   7.127
   57    HZ2  LYS  11           1HZ      LYS  11  -7.506  -9.545   7.237
   58    HZ3  LYS  11           2HZ      LYS  11  -7.889  -8.902   5.720
   59    HA   PRO  12           HA       PRO  12  -5.694  -6.882  -2.065
   60    HB2  PRO  12           1HB      PRO  12  -7.100  -4.626  -2.614
   61    HB3  PRO  12           2HB      PRO  12  -7.831  -6.235  -2.606
   62    HG2  PRO  12           1HG      PRO  12  -7.871  -4.126  -0.483
   63    HG3  PRO  12           2HG      PRO  12  -9.190  -5.164  -1.052
   64    HD2  PRO  12           1HD      PRO  12  -7.817  -5.671   1.225
   65    HD3  PRO  12           2HD      PRO  12  -8.487  -6.962   0.207
   66    H    TYR  13           H        TYR  13  -5.005  -5.050   0.640
   67    HA   TYR  13           HA       TYR  13  -3.295  -3.204  -0.892
   68    HB2  TYR  13           1HB      TYR  13  -3.967  -2.750   1.990
   69    HB3  TYR  13           2HB      TYR  13  -3.561  -1.577   0.743
   70    HD1  TYR  13           HD2      TYR  13  -5.391  -1.914  -1.368
   71    HD2  TYR  13           HD1      TYR  13  -6.099  -2.436   2.794
   72    HE1  TYR  13           HE2      TYR  13  -7.781  -1.458  -1.724
   73    HE2  TYR  13           HE1      TYR  13  -8.492  -1.983   2.450
   74    HH   TYR  13           HH       TYR  13 -10.121  -1.775   0.893
   75    H    GLU  14           H        GLU  14  -1.323  -4.075  -1.020
   76    HA   GLU  14           HA       GLU  14  -0.028  -4.895   1.484
   77    HB2  GLU  14           1HB      GLU  14  -0.842  -6.812  -0.133
   78    HB3  GLU  14           2HB      GLU  14   0.608  -6.382  -1.029
   79    HG2  GLU  14           1HG      GLU  14   1.473  -7.992   0.306
   80    HG3  GLU  14           2HG      GLU  14   1.715  -6.600   1.359
   81    H    CYS  15           H        CYS  15   2.091  -4.313   1.690
   82    HA   CYS  15           HA       CYS  15   3.055  -2.282  -0.096
   83    HB2  CYS  15           1HB      CYS  15   3.356  -2.571   2.518
   84    HB3  CYS  15           2HB      CYS  15   4.788  -3.470   2.026
   85    H    ASP  16           H        ASP  16   5.498  -2.391  -0.672
   86    HA   ASP  16           HA       ASP  16   5.988  -5.004  -1.941
   87    HB2  ASP  16           1HB      ASP  16   5.579  -3.237  -3.574
   88    HB3  ASP  16           2HB      ASP  16   6.840  -2.246  -2.845
   89    H    VAL  17           H        VAL  17   7.638  -2.181  -0.539
   90    HA   VAL  17           HA       VAL  17  10.207  -3.303  -0.437
   91    HB   VAL  17           HB       VAL  17   8.981  -1.205   1.357
   92   HG11  VAL  17          1HG1      VAL  17  11.393  -0.543   1.698
   93   HG12  VAL  17          2HG1      VAL  17  10.890  -2.040   2.484
   94   HG13  VAL  17          3HG1      VAL  17  11.831  -2.099   0.994
   95   HG21  VAL  17          3HG2      VAL  17   9.415   0.329  -0.227
   96   HG22  VAL  17          1HG2      VAL  17  10.937  -0.435  -0.688
   97   HG23  VAL  17          2HG2      VAL  17   9.412  -1.050  -1.326
   98    H    CYS  18           H        CYS  18   7.840  -2.939   2.211
   99    HA   CYS  18           HA       CYS  18   9.303  -4.921   3.773
  100    HB2  CYS  18           1HB      CYS  18   7.997  -4.213   5.645
  101    HB3  CYS  18           2HB      CYS  18   8.493  -2.759   4.785
  102    H    ARG  19           H        ARG  19   6.463  -4.621   1.847
  103    HA   ARG  19           HA       ARG  19   4.882  -6.119   1.191
  104    HB2  ARG  19           1HB      ARG  19   6.707  -8.132   2.519
  105    HB3  ARG  19           2HB      ARG  19   5.367  -8.522   1.448
  106    HG2  ARG  19           1HG      ARG  19   7.666  -6.799   0.579
  107    HG3  ARG  19           2HG      ARG  19   7.692  -8.559   0.445
  108    HD2  ARG  19           1HD      ARG  19   5.430  -6.944  -0.681
  109    HD3  ARG  19           2HD      ARG  19   6.923  -7.181  -1.589
  110    HE   ARG  19           HE       ARG  19   4.886  -9.157  -1.030
  111   HH11  ARG  19          1HH1      ARG  19   8.161  -8.555  -2.046
  112   HH12  ARG  19          2HH1      ARG  19   8.330 -10.078  -2.852
  113   HH21  ARG  19          1HH2      ARG  19   5.096 -11.167  -2.089
  114   HH22  ARG  19          2HH2      ARG  19   6.585 -11.563  -2.877
  115    H    LYS  20           H        LYS  20   4.177  -4.714   3.347
  116    HA   LYS  20           HA       LYS  20   3.198  -6.585   5.374
  117    HB2  LYS  20           1HB      LYS  20   4.345  -4.431   6.017
  118    HB3  LYS  20           2HB      LYS  20   2.957  -3.575   5.358
  119    HG2  LYS  20           1HG      LYS  20   1.502  -4.522   6.989
  120    HG3  LYS  20           2HG      LYS  20   2.762  -5.621   7.554
  121    HD2  LYS  20           1HD      LYS  20   3.987  -3.883   8.546
  122    HD3  LYS  20           2HD      LYS  20   3.110  -2.639   7.651
  123    HE2  LYS  20           1HE      LYS  20   2.278  -2.558   9.858
  124    HE3  LYS  20           2HE      LYS  20   1.043  -3.381   8.906
  125    HZ1  LYS  20           3HZ      LYS  20   1.335  -4.573  10.925
  126    HZ2  LYS  20           1HZ      LYS  20   3.016  -4.623  10.741
  127    HZ3  LYS  20           2HZ      LYS  20   2.024  -5.508   9.696
  128    H    ALA  21           H        ALA  21   0.994  -6.692   5.953
  129    HA   ALA  21           HA       ALA  21  -0.818  -5.999   3.748
  130    HB1  ALA  21           3HB      ALA  21  -2.127  -7.818   4.304
  131    HB2  ALA  21           1HB      ALA  21  -0.507  -8.404   4.682
  132    HB3  ALA  21           2HB      ALA  21  -1.567  -7.844   5.976
  133    H    PHE  22           H        PHE  22  -2.389  -4.539   4.003
  134    HA   PHE  22           HA       PHE  22  -2.961  -3.588   6.733
  135    HB2  PHE  22           1HB      PHE  22  -3.019  -1.968   4.179
  136    HB3  PHE  22           2HB      PHE  22  -3.354  -1.364   5.798
  137    HD1  PHE  22           HD1      PHE  22  -0.705  -2.827   3.665
  138    HD2  PHE  22           HD2      PHE  22  -1.625  -0.620   7.186
  139    HE1  PHE  22           HE1      PHE  22   1.682  -2.304   3.956
  140    HE2  PHE  22           HE2      PHE  22   0.760  -0.093   7.483
  141    HZ   PHE  22           HZ       PHE  22   2.417  -0.934   5.866
  142    H    SER  23           H        SER  23  -5.129  -2.546   6.950
  143    HA   SER  23           HA       SER  23  -7.114  -4.025   5.352
  144    HB2  SER  23           1HB      SER  23  -8.561  -4.042   7.276
  145    HB3  SER  23           2HB      SER  23  -6.974  -4.610   7.794
  146    HG   SER  23           HG       SER  23  -7.996  -1.979   8.112
  147    H    HIS  24           H        HIS  24  -6.016  -1.534   4.522
  148    HA   HIS  24           HA       HIS  24  -8.401  -0.110   3.967
  149    HB2  HIS  24           1HB      HIS  24  -7.634   0.550   6.416
  150    HB3  HIS  24           2HB      HIS  24  -6.527   1.602   5.540
  151    HD1  HIS  24           HD1      HIS  24  -8.725   2.808   7.298
  152    HD2  HIS  24           HD2      HIS  24  -9.154   2.069   3.232
  153    HE1  HIS  24           HE1      HIS  24 -10.548   4.356   6.521
  154    H    HIS  25           H        HIS  25  -8.018   0.331   1.903
  155    HA   HIS  25           HA       HIS  25  -5.743   0.333   0.481
  156    HB2  HIS  25           1HB      HIS  25  -6.798   2.014  -1.057
  157    HB3  HIS  25           2HB      HIS  25  -7.843   0.661  -0.633
  158    HD1  HIS  25           HD1      HIS  25  -7.476   4.346  -0.225
  159    HD2  HIS  25           HD2      HIS  25 -10.065   1.322   0.963
  160    HE1  HIS  25           HE1      HIS  25  -9.512   5.518   0.673
  161    H    ALA  26           H        ALA  26  -6.945   3.100   2.335
  162    HA   ALA  26           HA       ALA  26  -4.949   4.931   1.577
  163    HB1  ALA  26           3HB      ALA  26  -5.654   5.695   4.122
  164    HB2  ALA  26           1HB      ALA  26  -6.475   6.169   2.634
  165    HB3  ALA  26           2HB      ALA  26  -7.067   4.795   3.569
  166    H    SER  27           H        SER  27  -5.203   2.884   4.484
  167    HA   SER  27           HA       SER  27  -2.946   3.565   5.832
  168    HB2  SER  27           1HB      SER  27  -4.697   1.720   6.340
  169    HB3  SER  27           2HB      SER  27  -3.604   0.653   5.457
  170    HG   SER  27           HG       SER  27  -2.003   1.805   7.033
  171    H    LEU  28           H        LEU  28  -3.137   1.859   2.812
  172    HA   LEU  28           HA       LEU  28  -0.372   1.018   2.859
  173    HB2  LEU  28           1HB      LEU  28  -2.131  -0.306   1.742
  174    HB3  LEU  28           2HB      LEU  28  -2.359   1.009   0.591
  175    HG   LEU  28           HG       LEU  28   0.045   0.664  -0.098
  176   HD11  LEU  28          1HD1      LEU  28   0.064  -2.095   0.815
  177   HD12  LEU  28          2HD1      LEU  28   0.145  -0.935   2.141
  178   HD13  LEU  28          3HD1      LEU  28   1.342  -0.880   0.847
  179   HD21  LEU  28          3HD2      LEU  28  -0.828  -1.834  -0.959
  180   HD22  LEU  28          1HD2      LEU  28  -1.056  -0.288  -1.779
  181   HD23  LEU  28          2HD2      LEU  28  -2.305  -0.905  -0.696
  182    H    THR  29           H        THR  29  -2.303   3.274   0.886
  183    HA   THR  29           HA       THR  29  -0.178   4.361  -0.569
  184    HB   THR  29           HB       THR  29  -2.751   4.667  -0.871
  185    HG1  THR  29           HG1      THR  29  -1.786   5.708  -2.446
  186   HG21  THR  29          3HG2      THR  29  -3.818   6.356   0.216
  187   HG22  THR  29          1HG2      THR  29  -2.356   7.332   0.364
  188   HG23  THR  29          2HG2      THR  29  -2.629   5.979   1.462
  189    H    GLN  30           H        GLN  30  -1.036   4.764   2.713
  190    HA   GLN  30           HA       GLN  30   0.410   7.287   2.967
  191    HB2  GLN  30           1HB      GLN  30  -1.723   7.030   4.166
  192    HB3  GLN  30           2HB      GLN  30  -1.061   5.660   5.048
  193    HG2  GLN  30           1HG      GLN  30   0.709   7.234   5.916
  194    HG3  GLN  30           2HG      GLN  30  -0.256   8.545   5.239
  195   HE21  GLN  30          1HE2      GLN  30   0.184   6.430   7.849
  196   HE22  GLN  30          2HE2      GLN  30  -1.213   6.878   8.761
  197    H    HIS  31           H        HIS  31   0.471   4.049   4.459
  198    HA   HIS  31           HA       HIS  31   2.784   4.298   5.939
  199    HB2  HIS  31           1HB      HIS  31   1.702   2.310   6.359
  200    HB3  HIS  31           2HB      HIS  31   1.385   1.998   4.655
  201    HD1  HIS  31           HD1      HIS  31   3.925   1.471   7.329
  202    HD2  HIS  31           HD2      HIS  31   3.455   0.678   3.277
  203    HE1  HIS  31           HE1      HIS  31   5.751  -0.157   6.746
  204    H    GLN  32           H        GLN  32   2.445   3.422   2.525
  205    HA   GLN  32           HA       GLN  32   4.919   2.635   1.799
  206    HB2  GLN  32           1HB      GLN  32   2.900   4.362   0.451
  207    HB3  GLN  32           2HB      GLN  32   4.490   4.223  -0.288
  208    HG2  GLN  32           1HG      GLN  32   2.770   1.867   0.439
  209    HG3  GLN  32           2HG      GLN  32   2.782   2.627  -1.151
  210   HE21  GLN  32          1HE2      GLN  32   3.428   0.535  -1.931
  211   HE22  GLN  32          2HE2      GLN  32   5.088   0.062  -1.847
  212    H    ARG  33           H        ARG  33   4.054   5.770   2.982
  213    HA   ARG  33           HA       ARG  33   6.068   7.390   2.034
  214    HB2  ARG  33           1HB      ARG  33   4.576   7.304   4.629
  215    HB3  ARG  33           2HB      ARG  33   5.894   8.449   4.424
  216    HG2  ARG  33           1HG      ARG  33   4.703   9.225   2.325
  217    HG3  ARG  33           2HG      ARG  33   3.321   8.283   2.890
  218    HD2  ARG  33           1HD      ARG  33   3.127  10.624   3.552
  219    HD3  ARG  33           2HD      ARG  33   3.277   9.572   4.959
  220    HE   ARG  33           HE       ARG  33   5.279  10.574   5.459
  221   HH11  ARG  33          1HH1      ARG  33   4.330  11.433   2.222
  222   HH12  ARG  33          2HH1      ARG  33   5.572  12.627   2.035
  223   HH21  ARG  33          1HH2      ARG  33   6.918  12.143   5.225
  224   HH22  ARG  33          2HH2      ARG  33   7.044  13.029   3.744
  225    H    VAL  34           H        VAL  34   6.176   5.194   4.820
  226    HA   VAL  34           HA       VAL  34   8.601   5.741   5.917
  227    HB   VAL  34           HB       VAL  34   8.783   3.424   6.594
  228   HG11  VAL  34          1HG1      VAL  34   7.225   4.263   7.999
  229   HG12  VAL  34          2HG1      VAL  34   6.192   4.834   6.687
  230   HG13  VAL  34          3HG1      VAL  34   6.170   3.132   7.151
  231   HG21  VAL  34          3HG2      VAL  34   8.361   2.308   4.505
  232   HG22  VAL  34          1HG2      VAL  34   7.201   1.730   5.701
  233   HG23  VAL  34          2HG2      VAL  34   6.699   2.897   4.478
  234    H    HIS  35           H        HIS  35   7.998   4.003   2.912
  235    HA   HIS  35           HA       HIS  35  10.855   3.568   2.512
  236    HB2  HIS  35           1HB      HIS  35   8.608   2.809   0.643
  237    HB3  HIS  35           2HB      HIS  35  10.248   2.167   0.672
  238    HD1  HIS  35           HD1      HIS  35  10.710   1.149   3.359
  239    HD2  HIS  35           HD2      HIS  35   6.940   0.942   1.627
  240    HE1  HIS  35           HE1      HIS  35   9.500  -0.675   4.598
  241    H    SER  36           H        SER  36  12.089   4.879   1.339
  242    HA   SER  36           HA       SER  36  10.762   6.816  -0.443
  243    HB2  SER  36           1HB      SER  36  12.738   8.301   0.013
  244    HB3  SER  36           2HB      SER  36  11.726   7.995   1.424
  245    HG   SER  36           HG       SER  36  14.297   7.048   0.830
  246    H    GLY  37           H        GLY  37  11.030   6.146  -2.475
  247    HA2  GLY  37           1HA      GLY  37  13.761   5.550  -3.371
  248    HA3  GLY  37           2HA      GLY  37  12.491   4.387  -3.721
  249    H    GLU  38           H        GLU  38  13.771   7.552  -4.440
  250    HA   GLU  38           HA       GLU  38  11.726   8.256  -6.315
  251    HB2  GLU  38           1HB      GLU  38  13.399   9.785  -5.014
  252    HB3  GLU  38           2HB      GLU  38  14.480   9.441  -6.357
  253    HG2  GLU  38           1HG      GLU  38  11.707  10.475  -6.812
  254    HG3  GLU  38           2HG      GLU  38  13.052  11.559  -6.460
  255    H    LYS  39           H        LYS  39  14.076   5.956  -6.422
  256    HA   LYS  39           HA       LYS  39  14.332   6.150  -9.352
  257    HB2  LYS  39           1HB      LYS  39  16.355   4.601  -8.948
  258    HB3  LYS  39           2HB      LYS  39  16.522   6.307  -8.554
  259    HG2  LYS  39           1HG      LYS  39  16.553   5.925  -6.292
  260    HG3  LYS  39           2HG      LYS  39  15.659   4.409  -6.427
  261    HD2  LYS  39           1HD      LYS  39  17.587   3.281  -7.303
  262    HD3  LYS  39           2HD      LYS  39  18.483   4.798  -7.413
  263    HE2  LYS  39           1HE      LYS  39  17.437   3.689  -4.817
  264    HE3  LYS  39           2HE      LYS  39  19.041   3.313  -5.444
  265    HZ1  LYS  39           3HZ      LYS  39  19.246   5.878  -5.579
  266    HZ2  LYS  39           1HZ      LYS  39  19.460   5.101  -4.092
  267    HZ3  LYS  39           2HZ      LYS  39  17.995   5.871  -4.440
  268    HA   PRO  40           HA       PRO  40  11.720   2.444  -8.509
  269    HB2  PRO  40           1HB      PRO  40  10.127   2.809 -10.677
  270    HB3  PRO  40           2HB      PRO  40   9.834   3.604  -9.126
  271    HG2  PRO  40           1HG      PRO  40  11.146   4.685 -11.590
  272    HG3  PRO  40           2HG      PRO  40   9.971   5.464 -10.515
  273    HD2  PRO  40           1HD      PRO  40  12.627   5.974 -10.384
  274    HD3  PRO  40           2HD      PRO  40  11.576   6.015  -8.955
  275    H    SER  41           H        SER  41  12.913   3.619 -11.652
  276    HA   SER  41           HA       SER  41  13.672   0.845 -12.298
  277    HB2  SER  41           1HB      SER  41  13.234   1.300 -14.641
  278    HB3  SER  41           2HB      SER  41  11.795   1.694 -13.703
  279    HG   SER  41           HG       SER  41  13.078   3.262 -15.357
  280    H    GLY  42           H        GLY  42  15.638   0.524 -13.382
  281    HA2  GLY  42           1HA      GLY  42  17.751   2.203 -12.621
  282    HA3  GLY  42           2HA      GLY  42  17.854   0.922 -13.819
  283    HA   PRO  43           HA       PRO  43  18.680   4.881 -16.024
  284    HB2  PRO  43           1HB      PRO  43  20.657   3.856 -17.577
  285    HB3  PRO  43           2HB      PRO  43  20.942   4.483 -15.949
  286    HG2  PRO  43           1HG      PRO  43  20.605   1.650 -16.856
  287    HG3  PRO  43           2HG      PRO  43  21.772   2.324 -15.704
  288    HD2  PRO  43           1HD      PRO  43  19.529   1.028 -14.916
  289    HD3  PRO  43           2HD      PRO  43  20.241   2.359 -13.981
  290    H    SER  44           H        SER  44  17.557   1.790 -16.818
  291    HA   SER  44           HA       SER  44  17.479   1.661 -19.552
  292    HB2  SER  44           1HB      SER  44  15.489   0.289 -19.335
  293    HB3  SER  44           2HB      SER  44  16.581  -0.071 -17.998
  294    HG   SER  44           HG       SER  44  15.168   1.767 -16.999
  295    H    SER  45           H        SER  45  16.619   2.833 -21.135
  296    HA   SER  45           HA       SER  45  14.430   4.691 -20.480
  297    HB2  SER  45           1HB      SER  45  16.935   5.208 -22.076
  298    HB3  SER  45           2HB      SER  45  15.493   6.206 -22.261
  299    HG   SER  45           HG       SER  45  15.627   6.542 -19.941
  300    H    GLY  46           H        GLY  46  13.574   5.618 -22.734
  301    HA2  GLY  46           1HA      GLY  46  13.073   5.040 -25.031
  302    HA3  GLY  46           2HA      GLY  46  13.302   3.351 -24.602
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1  10.035 -21.279 -11.743
    2    HA2  GLY   1           1HA      GLY   1   9.915 -18.829 -12.210
    3    HA3  GLY   1           2HA      GLY   1   8.185 -19.070 -12.405
    4    H    SER   2           H        SER   2   7.437 -17.801 -10.779
    5    HA   SER   2           HA       SER   2   8.334 -18.476  -8.053
    6    HB2  SER   2           1HB      SER   2   8.797 -16.117  -8.886
    7    HB3  SER   2           2HB      SER   2   7.051 -15.868  -8.878
    8    HG   SER   2           HG       SER   2   8.772 -16.380  -6.698
    9    H    SER   3           H        SER   3   6.893 -19.795  -7.155
   10    HA   SER   3           HA       SER   3   4.363 -20.405  -7.854
   11    HB2  SER   3           1HB      SER   3   4.009 -21.263  -5.675
   12    HB3  SER   3           2HB      SER   3   5.753 -21.350  -5.921
   13    HG   SER   3           HG       SER   3   4.262 -19.620  -4.292
   14    H    GLY   4           H        GLY   4   2.248 -19.767  -7.216
   15    HA2  GLY   4           1HA      GLY   4   1.708 -17.045  -7.419
   16    HA3  GLY   4           2HA      GLY   4   0.575 -18.247  -6.819
   17    H    SER   5           H        SER   5   1.085 -18.970  -4.485
   18    HA   SER   5           HA       SER   5   0.778 -18.238  -2.322
   19    HB2  SER   5           1HB      SER   5   2.868 -17.438  -1.330
   20    HB3  SER   5           2HB      SER   5   3.194 -18.734  -2.480
   21    HG   SER   5           HG       SER   5   4.037 -16.159  -2.504
   22    H    SER   6           H        SER   6  -0.579 -16.535  -4.030
   23    HA   SER   6           HA       SER   6   0.075 -13.804  -3.677
   24    HB2  SER   6           1HB      SER   6  -2.242 -13.377  -4.455
   25    HB3  SER   6           2HB      SER   6  -1.390 -14.526  -5.488
   26    HG   SER   6           HG       SER   6  -3.699 -14.882  -4.339
   27    H    GLY   7           H        GLY   7  -2.394 -15.844  -2.102
   28    HA2  GLY   7           1HA      GLY   7  -2.472 -15.662   0.376
   29    HA3  GLY   7           2HA      GLY   7  -2.369 -13.923   0.145
   30    H    THR   8           H        THR   8  -4.425 -15.774   1.383
   31    HA   THR   8           HA       THR   8  -6.748 -14.810  -0.156
   32    HB   THR   8           HB       THR   8  -8.034 -16.697   0.741
   33    HG1  THR   8           HG1      THR   8  -5.643 -17.128   2.137
   34   HG21  THR   8          3HG2      THR   8  -7.300 -18.221  -0.807
   35   HG22  THR   8          1HG2      THR   8  -5.603 -18.002  -0.382
   36   HG23  THR   8          2HG2      THR   8  -6.431 -16.791  -1.361
   37    H    GLY   9           H        GLY   9  -8.273 -13.641   0.888
   38    HA2  GLY   9           1HA      GLY   9  -9.371 -13.487   3.215
   39    HA3  GLY   9           2HA      GLY   9  -7.748 -13.042   3.722
   40    H    GLU  10           H        GLU  10  -8.726 -11.059   4.486
   41    HA   GLU  10           HA       GLU  10  -9.586  -9.197   2.401
   42    HB2  GLU  10           1HB      GLU  10 -10.236  -7.731   4.277
   43    HB3  GLU  10           2HB      GLU  10 -11.001  -9.311   4.368
   44    HG2  GLU  10           1HG      GLU  10  -9.593 -10.004   6.125
   45    HG3  GLU  10           2HG      GLU  10  -8.499  -8.644   5.884
   46    H    LYS  11           H        LYS  11  -6.905  -9.889   2.272
   47    HA   LYS  11           HA       LYS  11  -5.608  -7.379   3.105
   48    HB2  LYS  11           1HB      LYS  11  -3.470  -8.734   3.198
   49    HB3  LYS  11           2HB      LYS  11  -4.638  -9.056   4.473
   50    HG2  LYS  11           1HG      LYS  11  -5.411 -11.036   3.206
   51    HG3  LYS  11           2HG      LYS  11  -4.135 -10.734   2.024
   52    HD2  LYS  11           1HD      LYS  11  -3.380 -10.918   4.897
   53    HD3  LYS  11           2HD      LYS  11  -3.790 -12.408   4.044
   54    HE2  LYS  11           1HE      LYS  11  -2.066 -12.065   2.446
   55    HE3  LYS  11           2HE      LYS  11  -1.790 -10.414   3.000
   56    HZ1  LYS  11           3HZ      LYS  11  -1.401 -11.892   5.236
   57    HZ2  LYS  11           1HZ      LYS  11  -0.177 -11.307   4.226
   58    HZ3  LYS  11           2HZ      LYS  11  -0.752 -12.885   4.030
   59    HA   PRO  12           HA       PRO  12  -5.341  -8.295  -1.546
   60    HB2  PRO  12           1HB      PRO  12  -6.959  -6.288  -2.397
   61    HB3  PRO  12           2HB      PRO  12  -7.555  -7.910  -2.024
   62    HG2  PRO  12           1HG      PRO  12  -7.622  -5.433  -0.344
   63    HG3  PRO  12           2HG      PRO  12  -8.889  -6.649  -0.596
   64    HD2  PRO  12           1HD      PRO  12  -7.329  -6.609   1.617
   65    HD3  PRO  12           2HD      PRO  12  -7.959  -8.115   0.920
   66    H    TYR  13           H        TYR  13  -4.515  -6.020   0.702
   67    HA   TYR  13           HA       TYR  13  -3.068  -4.398  -1.289
   68    HB2  TYR  13           1HB      TYR  13  -3.983  -3.505   1.451
   69    HB3  TYR  13           2HB      TYR  13  -3.180  -2.513   0.239
   70    HD1  TYR  13           HD2      TYR  13  -4.546  -2.957  -2.206
   71    HD2  TYR  13           HD1      TYR  13  -6.172  -2.843   1.724
   72    HE1  TYR  13           HE2      TYR  13  -6.731  -2.316  -3.135
   73    HE2  TYR  13           HE1      TYR  13  -8.362  -2.202   0.806
   74    HH   TYR  13           HH       TYR  13  -9.042  -0.922  -1.607
   75    H    GLU  14           H        GLU  14  -0.941  -4.636  -1.243
   76    HA   GLU  14           HA       GLU  14   0.371  -5.245   1.314
   77    HB2  GLU  14           1HB      GLU  14   0.469  -6.801  -1.219
   78    HB3  GLU  14           2HB      GLU  14   1.968  -6.635  -0.315
   79    HG2  GLU  14           1HG      GLU  14   1.183  -8.548   0.613
   80    HG3  GLU  14           2HG      GLU  14   0.430  -7.377   1.694
   81    H    CYS  15           H        CYS  15   2.655  -4.708   1.364
   82    HA   CYS  15           HA       CYS  15   3.205  -2.340  -0.256
   83    HB2  CYS  15           1HB      CYS  15   3.391  -2.323   2.271
   84    HB3  CYS  15           2HB      CYS  15   4.799  -3.367   2.094
   85    H    ASP  16           H        ASP  16   4.781  -2.226  -1.745
   86    HA   ASP  16           HA       ASP  16   6.160  -4.682  -2.447
   87    HB2  ASP  16           1HB      ASP  16   5.011  -2.985  -4.065
   88    HB3  ASP  16           2HB      ASP  16   6.514  -2.082  -3.901
   89    H    VAL  17           H        VAL  17   6.876  -3.085  -0.027
   90    HA   VAL  17           HA       VAL  17   9.739  -2.792  -0.638
   91    HB   VAL  17           HB       VAL  17   8.133  -0.968   1.158
   92   HG11  VAL  17          1HG1      VAL  17  10.402  -1.445   2.004
   93   HG12  VAL  17          2HG1      VAL  17  11.070  -0.875   0.473
   94   HG13  VAL  17          3HG1      VAL  17  10.196   0.239   1.525
   95   HG21  VAL  17          3HG2      VAL  17   8.702  -0.875  -1.641
   96   HG22  VAL  17          1HG2      VAL  17   7.793   0.270  -0.654
   97   HG23  VAL  17          2HG2      VAL  17   9.537   0.453  -0.835
   98    H    CYS  18           H        CYS  18   7.347  -3.101   1.980
   99    HA   CYS  18           HA       CYS  18   9.324  -4.682   3.487
  100    HB2  CYS  18           1HB      CYS  18   8.071  -4.074   5.510
  101    HB3  CYS  18           2HB      CYS  18   8.629  -2.642   4.651
  102    H    ARG  19           H        ARG  19   6.617  -4.965   1.610
  103    HA   ARG  19           HA       ARG  19   5.111  -6.624   1.220
  104    HB2  ARG  19           1HB      ARG  19   7.063  -8.211   2.897
  105    HB3  ARG  19           2HB      ARG  19   5.736  -8.914   1.980
  106    HG2  ARG  19           1HG      ARG  19   7.869  -7.244   0.687
  107    HG3  ARG  19           2HG      ARG  19   8.035  -8.986   0.920
  108    HD2  ARG  19           1HD      ARG  19   5.659  -9.019  -0.218
  109    HD3  ARG  19           2HD      ARG  19   6.195  -7.468  -0.862
  110    HE   ARG  19           HE       ARG  19   8.273  -9.048  -1.447
  111   HH11  ARG  19          1HH1      ARG  19   4.847  -9.474  -1.896
  112   HH12  ARG  19          2HH1      ARG  19   5.024 -10.460  -3.310
  113   HH21  ARG  19          1HH2      ARG  19   8.518 -10.345  -3.307
  114   HH22  ARG  19          2HH2      ARG  19   7.112 -10.956  -4.111
  115    H    LYS  20           H        LYS  20   4.295  -4.902   3.130
  116    HA   LYS  20           HA       LYS  20   3.196  -6.572   5.287
  117    HB2  LYS  20           1HB      LYS  20   4.517  -4.529   5.910
  118    HB3  LYS  20           2HB      LYS  20   3.270  -3.555   5.140
  119    HG2  LYS  20           1HG      LYS  20   1.659  -4.164   6.741
  120    HG3  LYS  20           2HG      LYS  20   2.656  -5.485   7.356
  121    HD2  LYS  20           1HD      LYS  20   4.178  -3.987   8.374
  122    HD3  LYS  20           2HD      LYS  20   3.511  -2.603   7.504
  123    HE2  LYS  20           1HE      LYS  20   1.939  -4.231   9.491
  124    HE3  LYS  20           2HE      LYS  20   2.852  -2.788   9.928
  125    HZ1  LYS  20           3HZ      LYS  20   1.501  -1.483   8.459
  126    HZ2  LYS  20           1HZ      LYS  20   0.483  -2.349   9.497
  127    HZ3  LYS  20           2HZ      LYS  20   0.687  -2.855   7.897
  128    H    ALA  21           H        ALA  21   1.043  -6.864   5.499
  129    HA   ALA  21           HA       ALA  21  -0.650  -5.857   3.342
  130    HB1  ALA  21           3HB      ALA  21  -2.295  -7.502   4.616
  131    HB2  ALA  21           1HB      ALA  21  -1.086  -8.086   3.473
  132    HB3  ALA  21           2HB      ALA  21  -0.770  -8.161   5.207
  133    H    PHE  22           H        PHE  22  -2.384  -4.540   3.636
  134    HA   PHE  22           HA       PHE  22  -2.925  -3.621   6.382
  135    HB2  PHE  22           1HB      PHE  22  -2.931  -1.912   3.885
  136    HB3  PHE  22           2HB      PHE  22  -3.280  -1.362   5.521
  137    HD1  PHE  22           HD1      PHE  22  -0.598  -2.996   3.523
  138    HD2  PHE  22           HD2      PHE  22  -1.583  -0.469   6.803
  139    HE1  PHE  22           HE1      PHE  22   1.791  -2.511   3.863
  140    HE2  PHE  22           HE2      PHE  22   0.803   0.021   7.147
  141    HZ   PHE  22           HZ       PHE  22   2.494  -1.000   5.676
  142    H    SER  23           H        SER  23  -5.058  -3.097   6.888
  143    HA   SER  23           HA       SER  23  -7.045  -4.626   5.603
  144    HB2  SER  23           1HB      SER  23  -7.152  -2.451   7.687
  145    HB3  SER  23           2HB      SER  23  -8.618  -3.215   7.072
  146    HG   SER  23           HG       SER  23  -6.602  -4.259   8.686
  147    H    HIS  24           H        HIS  24  -6.421  -1.128   5.616
  148    HA   HIS  24           HA       HIS  24  -8.204  -0.888   3.282
  149    HB2  HIS  24           1HB      HIS  24  -8.764   0.349   5.495
  150    HB3  HIS  24           2HB      HIS  24  -7.451   1.431   5.040
  151    HD1  HIS  24           HD1      HIS  24  -8.466   3.486   4.126
  152    HD2  HIS  24           HD2      HIS  24 -10.470   0.078   2.847
  153    HE1  HIS  24           HE1      HIS  24 -10.245   4.304   2.549
  154    H    HIS  25           H        HIS  25  -7.533   0.358   1.527
  155    HA   HIS  25           HA       HIS  25  -4.871   0.207   0.786
  156    HB2  HIS  25           1HB      HIS  25  -6.941   0.647  -0.670
  157    HB3  HIS  25           2HB      HIS  25  -6.716   2.345  -0.262
  158    HD1  HIS  25           HD1      HIS  25  -5.743   3.414  -2.267
  159    HD2  HIS  25           HD2      HIS  25  -4.000  -0.275  -1.481
  160    HE1  HIS  25           HE1      HIS  25  -3.906   3.163  -3.966
  161    H    ALA  26           H        ALA  26  -6.616   3.171   1.744
  162    HA   ALA  26           HA       ALA  26  -4.749   5.067   1.724
  163    HB1  ALA  26           3HB      ALA  26  -6.839   4.455   3.758
  164    HB2  ALA  26           1HB      ALA  26  -5.707   5.774   4.060
  165    HB3  ALA  26           2HB      ALA  26  -6.729   5.800   2.622
  166    H    SER  27           H        SER  27  -5.035   2.762   4.431
  167    HA   SER  27           HA       SER  27  -2.928   3.586   5.980
  168    HB2  SER  27           1HB      SER  27  -4.639   1.574   6.219
  169    HB3  SER  27           2HB      SER  27  -3.279   0.644   5.590
  170    HG   SER  27           HG       SER  27  -2.962   0.640   7.739
  171    H    LEU  28           H        LEU  28  -2.820   1.432   3.169
  172    HA   LEU  28           HA       LEU  28   0.013   1.028   3.343
  173    HB2  LEU  28           1HB      LEU  28  -1.131  -0.728   2.331
  174    HB3  LEU  28           2HB      LEU  28  -2.104   0.355   1.337
  175    HG   LEU  28           HG       LEU  28  -0.049   0.869   0.015
  176   HD11  LEU  28          1HD1      LEU  28   1.891  -0.532   0.226
  177   HD12  LEU  28          2HD1      LEU  28   1.132  -1.460   1.519
  178   HD13  LEU  28          3HD1      LEU  28   1.564   0.229   1.783
  179   HD21  LEU  28          3HD2      LEU  28  -1.230  -1.874   0.176
  180   HD22  LEU  28          1HD2      LEU  28   0.058  -1.527  -0.977
  181   HD23  LEU  28          2HD2      LEU  28  -1.456  -0.625  -1.050
  182    H    THR  29           H        THR  29  -2.135   3.027   1.362
  183    HA   THR  29           HA       THR  29  -0.279   4.074  -0.416
  184    HB   THR  29           HB       THR  29  -2.818   5.201   0.731
  185    HG1  THR  29           HG1      THR  29  -3.241   3.739  -0.835
  186   HG21  THR  29          3HG2      THR  29  -2.033   7.262   0.273
  187   HG22  THR  29          1HG2      THR  29  -2.308   6.810  -1.408
  188   HG23  THR  29          2HG2      THR  29  -0.700   6.645  -0.702
  189    H    GLN  30           H        GLN  30  -1.254   5.335   2.765
  190    HA   GLN  30           HA       GLN  30   0.607   7.502   2.685
  191    HB2  GLN  30           1HB      GLN  30  -1.336   7.817   4.015
  192    HB3  GLN  30           2HB      GLN  30  -1.079   6.307   4.878
  193    HG2  GLN  30           1HG      GLN  30   0.960   7.276   5.883
  194    HG3  GLN  30           2HG      GLN  30   0.587   8.804   5.087
  195   HE21  GLN  30          1HE2      GLN  30   0.666   7.705   7.970
  196   HE22  GLN  30          2HE2      GLN  30  -0.786   8.331   8.664
  197    H    HIS  31           H        HIS  31   0.513   4.377   4.369
  198    HA   HIS  31           HA       HIS  31   2.799   4.545   5.880
  199    HB2  HIS  31           1HB      HIS  31   1.656   2.583   6.259
  200    HB3  HIS  31           2HB      HIS  31   1.376   2.290   4.545
  201    HD1  HIS  31           HD1      HIS  31   3.884   1.744   7.262
  202    HD2  HIS  31           HD2      HIS  31   3.392   0.861   3.232
  203    HE1  HIS  31           HE1      HIS  31   5.668   0.057   6.721
  204    H    GLN  32           H        GLN  32   2.521   3.763   2.445
  205    HA   GLN  32           HA       GLN  32   5.021   2.910   1.804
  206    HB2  GLN  32           1HB      GLN  32   3.106   4.702   0.352
  207    HB3  GLN  32           2HB      GLN  32   4.680   4.349  -0.348
  208    HG2  GLN  32           1HG      GLN  32   3.942   1.863   0.188
  209    HG3  GLN  32           2HG      GLN  32   2.338   2.581   0.057
  210   HE21  GLN  32          1HE2      GLN  32   2.712   0.764  -1.722
  211   HE22  GLN  32          2HE2      GLN  32   3.098   1.400  -3.281
  212    H    ARG  33           H        ARG  33   4.094   6.110   2.809
  213    HA   ARG  33           HA       ARG  33   6.250   7.612   1.910
  214    HB2  ARG  33           1HB      ARG  33   4.600   7.853   4.425
  215    HB3  ARG  33           2HB      ARG  33   5.796   9.048   3.945
  216    HG2  ARG  33           1HG      ARG  33   4.477   9.128   1.723
  217    HG3  ARG  33           2HG      ARG  33   3.189   8.366   2.658
  218    HD2  ARG  33           1HD      ARG  33   4.564  10.964   3.336
  219    HD3  ARG  33           2HD      ARG  33   2.962  10.805   2.616
  220    HE   ARG  33           HE       ARG  33   3.060   9.346   5.021
  221   HH11  ARG  33          1HH1      ARG  33   3.026  12.625   3.850
  222   HH12  ARG  33          2HH1      ARG  33   2.269  13.263   5.272
  223   HH21  ARG  33          1HH2      ARG  33   2.062  10.174   6.898
  224   HH22  ARG  33          2HH2      ARG  33   1.722  11.868   7.005
  225    H    VAL  34           H        VAL  34   5.920   5.758   4.922
  226    HA   VAL  34           HA       VAL  34   8.172   6.356   6.284
  227    HB   VAL  34           HB       VAL  34   8.250   4.066   7.125
  228   HG11  VAL  34          1HG1      VAL  34   5.724   5.563   6.863
  229   HG12  VAL  34          2HG1      VAL  34   5.581   3.895   7.420
  230   HG13  VAL  34          3HG1      VAL  34   6.590   5.039   8.306
  231   HG21  VAL  34          3HG2      VAL  34   7.782   2.350   5.796
  232   HG22  VAL  34          1HG2      VAL  34   6.091   2.850   5.767
  233   HG23  VAL  34          2HG2      VAL  34   7.208   3.450   4.542
  234    H    HIS  35           H        HIS  35   8.005   4.665   3.247
  235    HA   HIS  35           HA       HIS  35  10.867   4.051   3.343
  236    HB2  HIS  35           1HB      HIS  35   8.959   3.324   1.125
  237    HB3  HIS  35           2HB      HIS  35  10.512   2.588   1.508
  238    HD1  HIS  35           HD1      HIS  35  10.286   1.786   4.349
  239    HD2  HIS  35           HD2      HIS  35   7.075   1.494   1.728
  240    HE1  HIS  35           HE1      HIS  35   8.750   0.068   5.357
  241    H    SER  36           H        SER  36  11.384   6.359   3.224
  242    HA   SER  36           HA       SER  36  10.783   7.763   0.774
  243    HB2  SER  36           1HB      SER  36  11.190   8.705   3.216
  244    HB3  SER  36           2HB      SER  36  12.871   8.726   2.684
  245    HG   SER  36           HG       SER  36  11.436  10.656   2.280
  246    H    GLY  37           H        GLY  37  13.921   7.151   2.356
  247    HA2  GLY  37           1HA      GLY  37  16.019   7.023   1.359
  248    HA3  GLY  37           2HA      GLY  37  15.259   5.625   0.613
  249    H    GLU  38           H        GLU  38  15.934   9.063   0.209
  250    HA   GLU  38           HA       GLU  38  15.277   8.892  -2.632
  251    HB2  GLU  38           1HB      GLU  38  15.680  11.104  -0.685
  252    HB3  GLU  38           2HB      GLU  38  16.074  11.428  -2.367
  253    HG2  GLU  38           1HG      GLU  38  13.884  12.098  -2.257
  254    HG3  GLU  38           2HG      GLU  38  13.724  10.444  -2.843
  255    H    LYS  39           H        LYS  39  17.515   7.399  -1.733
  256    HA   LYS  39           HA       LYS  39  19.489   8.358  -3.570
  257    HB2  LYS  39           1HB      LYS  39  19.882   8.684  -0.637
  258    HB3  LYS  39           2HB      LYS  39  21.261   8.145  -1.586
  259    HG2  LYS  39           1HG      LYS  39  20.770  10.150  -3.097
  260    HG3  LYS  39           2HG      LYS  39  19.750  10.725  -1.776
  261    HD2  LYS  39           1HD      LYS  39  22.564   9.873  -1.227
  262    HD3  LYS  39           2HD      LYS  39  22.245  11.469  -1.911
  263    HE2  LYS  39           1HE      LYS  39  20.930  10.428   0.592
  264    HE3  LYS  39           2HE      LYS  39  22.408  11.389   0.594
  265    HZ1  LYS  39           3HZ      LYS  39  21.058  13.070  -0.728
  266    HZ2  LYS  39           1HZ      LYS  39  20.701  12.920   0.919
  267    HZ3  LYS  39           2HZ      LYS  39  19.691  12.205  -0.233
  268    HA   PRO  40           HA       PRO  40  20.163   4.016  -3.830
  269    HB2  PRO  40           1HB      PRO  40  22.576   4.024  -5.074
  270    HB3  PRO  40           2HB      PRO  40  21.068   4.431  -5.901
  271    HG2  PRO  40           1HG      PRO  40  23.158   6.250  -4.768
  272    HG3  PRO  40           2HG      PRO  40  22.290   6.366  -6.310
  273    HD2  PRO  40           1HD      PRO  40  21.610   7.838  -4.141
  274    HD3  PRO  40           2HD      PRO  40  20.415   7.281  -5.329
  275    H    SER  41           H        SER  41  20.438   3.265  -1.752
  276    HA   SER  41           HA       SER  41  23.210   3.242  -0.753
  277    HB2  SER  41           1HB      SER  41  20.733   3.291   0.984
  278    HB3  SER  41           2HB      SER  41  22.411   3.400   1.518
  279    HG   SER  41           HG       SER  41  21.233   5.288  -0.233
  280    H    GLY  42           H        GLY  42  20.059   1.607  -0.372
  281    HA2  GLY  42           1HA      GLY  42  21.437  -0.891   0.246
  282    HA3  GLY  42           2HA      GLY  42  19.707  -0.601   0.358
  283    HA   PRO  43           HA       PRO  43  19.161  -2.794  -3.401
  284    HB2  PRO  43           1HB      PRO  43  16.855  -1.667  -4.286
  285    HB3  PRO  43           2HB      PRO  43  16.914  -2.789  -2.921
  286    HG2  PRO  43           1HG      PRO  43  16.790   0.202  -2.911
  287    HG3  PRO  43           2HG      PRO  43  15.910  -0.957  -1.898
  288    HD2  PRO  43           1HD      PRO  43  18.101   0.372  -1.024
  289    HD3  PRO  43           2HD      PRO  43  17.702  -1.271  -0.482
  290    H    SER  44           H        SER  44  19.925  -2.619  -5.422
  291    HA   SER  44           HA       SER  44  20.568   0.046  -6.429
  292    HB2  SER  44           1HB      SER  44  22.334  -1.710  -6.358
  293    HB3  SER  44           2HB      SER  44  21.398  -2.656  -7.515
  294    HG   SER  44           HG       SER  44  22.252  -0.002  -8.017
  295    H    SER  45           H        SER  45  19.293  -2.984  -7.820
  296    HA   SER  45           HA       SER  45  18.291  -1.807 -10.163
  297    HB2  SER  45           1HB      SER  45  17.598  -4.370  -8.729
  298    HB3  SER  45           2HB      SER  45  16.848  -3.914 -10.258
  299    HG   SER  45           HG       SER  45  18.550  -4.929 -11.015
  300    H    GLY  46           H        GLY  46  16.729  -2.535  -7.063
  301    HA2  GLY  46           1HA      GLY  46  14.686  -1.910  -6.209
  302    HA3  GLY  46           2HA      GLY  46  15.035  -0.375  -6.989
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1   5.469 -33.302   7.544
    2    HA2  GLY   1           1HA      GLY   1   7.517 -35.212   6.924
    3    HA3  GLY   1           2HA      GLY   1   6.553 -34.791   5.517
    4    H    SER   2           H        SER   2   6.110 -32.163   5.727
    5    HA   SER   2           HA       SER   2   8.603 -30.795   6.324
    6    HB2  SER   2           1HB      SER   2   7.488 -31.027   3.525
    7    HB3  SER   2           2HB      SER   2   8.644 -29.782   4.001
    8    HG   SER   2           HG       SER   2   9.297 -32.399   4.661
    9    H    SER   3           H        SER   3   8.411 -28.462   6.199
   10    HA   SER   3           HA       SER   3   5.723 -27.603   6.909
   11    HB2  SER   3           1HB      SER   3   6.719 -25.723   7.917
   12    HB3  SER   3           2HB      SER   3   7.877 -27.021   8.209
   13    HG   SER   3           HG       SER   3   8.993 -25.247   7.446
   14    H    GLY   4           H        GLY   4   4.917 -25.497   6.092
   15    HA2  GLY   4           1HA      GLY   4   5.805 -24.100   3.911
   16    HA3  GLY   4           2HA      GLY   4   4.979 -25.490   3.224
   17    H    SER   5           H        SER   5   4.134 -22.893   2.741
   18    HA   SER   5           HA       SER   5   1.420 -23.054   3.705
   19    HB2  SER   5           1HB      SER   5   2.839 -21.716   5.425
   20    HB3  SER   5           2HB      SER   5   2.818 -20.440   4.208
   21    HG   SER   5           HG       SER   5   0.460 -20.727   4.246
   22    H    SER   6           H        SER   6  -0.006 -22.191   2.283
   23    HA   SER   6           HA       SER   6   0.696 -21.714  -0.338
   24    HB2  SER   6           1HB      SER   6  -1.551 -20.901  -0.678
   25    HB3  SER   6           2HB      SER   6  -1.614 -22.203   0.510
   26    HG   SER   6           HG       SER   6  -1.595 -19.424   1.096
   27    H    GLY   7           H        GLY   7   0.153 -19.342   2.246
   28    HA2  GLY   7           1HA      GLY   7   1.982 -17.503   1.881
   29    HA3  GLY   7           2HA      GLY   7   1.012 -17.193   0.448
   30    H    THR   8           H        THR   8   1.434 -16.515   3.723
   31    HA   THR   8           HA       THR   8  -1.269 -15.801   4.353
   32    HB   THR   8           HB       THR   8   1.294 -14.988   5.740
   33    HG1  THR   8           HG1      THR   8   1.059 -17.217   5.828
   34   HG21  THR   8          3HG2      THR   8  -1.558 -14.964   6.735
   35   HG22  THR   8          1HG2      THR   8  -0.626 -13.539   6.277
   36   HG23  THR   8          2HG2      THR   8  -0.127 -14.512   7.660
   37    H    GLY   9           H        GLY   9  -1.820 -14.433   2.572
   38    HA2  GLY   9           1HA      GLY   9  -1.530 -11.679   3.121
   39    HA3  GLY   9           2HA      GLY   9  -0.444 -12.122   1.813
   40    H    GLU  10           H        GLU  10  -3.839 -12.235   2.823
   41    HA   GLU  10           HA       GLU  10  -4.631 -12.403   0.002
   42    HB2  GLU  10           1HB      GLU  10  -5.564 -14.042   1.677
   43    HB3  GLU  10           2HB      GLU  10  -6.399 -12.692   2.432
   44    HG2  GLU  10           1HG      GLU  10  -8.020 -13.600   1.068
   45    HG3  GLU  10           2HG      GLU  10  -7.385 -12.278   0.090
   46    H    LYS  11           H        LYS  11  -4.673 -10.336   2.785
   47    HA   LYS  11           HA       LYS  11  -6.655  -8.571   2.504
   48    HB2  LYS  11           1HB      LYS  11  -3.742  -8.118   3.032
   49    HB3  LYS  11           2HB      LYS  11  -4.825  -6.737   2.910
   50    HG2  LYS  11           1HG      LYS  11  -4.938  -7.092   5.146
   51    HG3  LYS  11           2HG      LYS  11  -6.244  -8.162   4.630
   52    HD2  LYS  11           1HD      LYS  11  -4.702 -10.062   4.669
   53    HD3  LYS  11           2HD      LYS  11  -3.393  -8.992   5.175
   54    HE2  LYS  11           1HE      LYS  11  -4.266 -10.142   7.103
   55    HE3  LYS  11           2HE      LYS  11  -4.690  -8.434   7.207
   56    HZ1  LYS  11           3HZ      LYS  11  -6.567 -10.409   6.066
   57    HZ2  LYS  11           1HZ      LYS  11  -6.900  -8.873   6.695
   58    HZ3  LYS  11           2HZ      LYS  11  -6.486 -10.142   7.735
   59    HA   PRO  12           HA       PRO  12  -6.670  -6.909  -1.570
   60    HB2  PRO  12           1HB      PRO  12  -7.977  -4.578  -1.090
   61    HB3  PRO  12           2HB      PRO  12  -8.786  -6.150  -1.094
   62    HG2  PRO  12           1HG      PRO  12  -7.821  -4.521   1.225
   63    HG3  PRO  12           2HG      PRO  12  -9.343  -5.412   1.040
   64    HD2  PRO  12           1HD      PRO  12  -7.249  -6.385   2.453
   65    HD3  PRO  12           2HD      PRO  12  -8.369  -7.434   1.562
   66    H    TYR  13           H        TYR  13  -5.137  -5.327   1.075
   67    HA   TYR  13           HA       TYR  13  -3.546  -3.734  -0.818
   68    HB2  TYR  13           1HB      TYR  13  -4.303  -2.764   1.938
   69    HB3  TYR  13           2HB      TYR  13  -3.522  -1.852   0.651
   70    HD1  TYR  13           HD2      TYR  13  -4.837  -1.189  -1.359
   71    HD2  TYR  13           HD1      TYR  13  -6.671  -2.973   2.041
   72    HE1  TYR  13           HE2      TYR  13  -7.033  -0.396  -2.133
   73    HE2  TYR  13           HE1      TYR  13  -8.871  -2.185   1.275
   74    HH   TYR  13           HH       TYR  13  -9.898  -0.692  -0.153
   75    H    GLU  14           H        GLU  14  -1.407  -3.955  -0.609
   76    HA   GLU  14           HA       GLU  14  -0.213  -4.702   1.921
   77    HB2  GLU  14           1HB      GLU  14  -0.906  -6.863   0.861
   78    HB3  GLU  14           2HB      GLU  14   0.161  -6.490  -0.485
   79    HG2  GLU  14           1HG      GLU  14   2.086  -6.655   0.864
   80    HG3  GLU  14           2HG      GLU  14   1.136  -6.654   2.348
   81    H    CYS  15           H        CYS  15   2.005  -4.292   2.024
   82    HA   CYS  15           HA       CYS  15   2.944  -2.291   0.218
   83    HB2  CYS  15           1HB      CYS  15   3.450  -2.656   2.769
   84    HB3  CYS  15           2HB      CYS  15   4.748  -3.681   2.164
   85    H    ASP  16           H        ASP  16   5.334  -2.504  -0.556
   86    HA   ASP  16           HA       ASP  16   5.563  -5.075  -1.979
   87    HB2  ASP  16           1HB      ASP  16   6.518  -3.939  -3.830
   88    HB3  ASP  16           2HB      ASP  16   5.123  -2.977  -3.347
   89    H    VAL  17           H        VAL  17   7.209  -2.680  -0.054
   90    HA   VAL  17           HA       VAL  17   9.808  -3.908  -0.367
   91    HB   VAL  17           HB       VAL  17   8.868  -1.721   1.493
   92   HG11  VAL  17          1HG1      VAL  17  10.815  -1.819   2.557
   93   HG12  VAL  17          2HG1      VAL  17  11.163  -3.318   1.695
   94   HG13  VAL  17          3HG1      VAL  17  11.701  -1.774   1.034
   95   HG21  VAL  17          3HG2      VAL  17   8.836  -0.665  -0.521
   96   HG22  VAL  17          1HG2      VAL  17  10.556  -0.501  -0.167
   97   HG23  VAL  17          2HG2      VAL  17   9.995  -1.776  -1.248
   98    H    CYS  18           H        CYS  18   7.481  -3.497   2.300
   99    HA   CYS  18           HA       CYS  18   8.824  -5.706   3.708
  100    HB2  CYS  18           1HB      CYS  18   7.817  -4.826   5.760
  101    HB3  CYS  18           2HB      CYS  18   8.768  -3.585   4.950
  102    H    ARG  19           H        ARG  19   6.323  -5.236   1.707
  103    HA   ARG  19           HA       ARG  19   4.249  -6.163   1.387
  104    HB2  ARG  19           1HB      ARG  19   6.101  -8.330   2.238
  105    HB3  ARG  19           2HB      ARG  19   4.392  -8.727   2.126
  106    HG2  ARG  19           1HG      ARG  19   5.055  -9.263   0.019
  107    HG3  ARG  19           2HG      ARG  19   4.626  -7.569  -0.228
  108    HD2  ARG  19           1HD      ARG  19   6.711  -7.788  -1.260
  109    HD3  ARG  19           2HD      ARG  19   7.078  -7.065   0.306
  110    HE   ARG  19           HE       ARG  19   7.390  -9.661   0.837
  111   HH11  ARG  19          1HH1      ARG  19   8.528  -7.714  -1.815
  112   HH12  ARG  19          2HH1      ARG  19   9.957  -8.660  -2.068
  113   HH21  ARG  19          1HH2      ARG  19   9.268 -10.915   0.514
  114   HH22  ARG  19          2HH2      ARG  19  10.376 -10.481  -0.743
  115    H    LYS  20           H        LYS  20   4.230  -4.696   3.716
  116    HA   LYS  20           HA       LYS  20   3.131  -6.276   5.866
  117    HB2  LYS  20           1HB      LYS  20   4.501  -4.212   6.231
  118    HB3  LYS  20           2HB      LYS  20   3.173  -3.269   5.567
  119    HG2  LYS  20           1HG      LYS  20   1.719  -4.026   7.368
  120    HG3  LYS  20           2HG      LYS  20   3.035  -5.000   8.028
  121    HD2  LYS  20           1HD      LYS  20   3.149  -2.007   7.669
  122    HD3  LYS  20           2HD      LYS  20   2.711  -2.811   9.178
  123    HE2  LYS  20           1HE      LYS  20   5.325  -3.144   7.708
  124    HE3  LYS  20           2HE      LYS  20   5.075  -2.131   9.129
  125    HZ1  LYS  20           3HZ      LYS  20   4.713  -5.078   9.027
  126    HZ2  LYS  20           1HZ      LYS  20   4.485  -4.102  10.390
  127    HZ3  LYS  20           2HZ      LYS  20   6.028  -4.270   9.720
  128    H    ALA  21           H        ALA  21   1.009  -6.363   6.531
  129    HA   ALA  21           HA       ALA  21  -0.964  -5.775   4.483
  130    HB1  ALA  21           3HB      ALA  21  -1.151  -7.243   7.107
  131    HB2  ALA  21           1HB      ALA  21  -2.513  -6.999   6.013
  132    HB3  ALA  21           2HB      ALA  21  -1.115  -7.937   5.486
  133    H    PHE  22           H        PHE  22  -2.645  -4.349   4.664
  134    HA   PHE  22           HA       PHE  22  -2.791  -2.717   7.103
  135    HB2  PHE  22           1HB      PHE  22  -2.832  -1.624   4.282
  136    HB3  PHE  22           2HB      PHE  22  -3.024  -0.684   5.757
  137    HD1  PHE  22           HD1      PHE  22  -0.650  -2.727   3.804
  138    HD2  PHE  22           HD2      PHE  22  -1.154   0.050   6.990
  139    HE1  PHE  22           HE1      PHE  22   1.788  -2.412   3.911
  140    HE2  PHE  22           HE2      PHE  22   1.282   0.370   7.102
  141    HZ   PHE  22           HZ       PHE  22   2.757  -0.861   5.561
  142    H    SER  23           H        SER  23  -4.346  -3.961   4.221
  143    HA   SER  23           HA       SER  23  -6.526  -4.321   3.679
  144    HB2  SER  23           1HB      SER  23  -6.561  -4.362   6.667
  145    HB3  SER  23           2HB      SER  23  -8.102  -4.349   5.810
  146    HG   SER  23           HG       SER  23  -7.768  -6.334   5.181
  147    H    HIS  24           H        HIS  24  -5.481  -1.607   3.709
  148    HA   HIS  24           HA       HIS  24  -7.943  -0.211   3.336
  149    HB2  HIS  24           1HB      HIS  24  -7.300  -0.157   5.907
  150    HB3  HIS  24           2HB      HIS  24  -6.223   1.130   5.375
  151    HD1  HIS  24           HD1      HIS  24  -8.093   2.470   3.299
  152    HD2  HIS  24           HD2      HIS  24  -9.244   1.323   7.123
  153    HE1  HIS  24           HE1      HIS  24 -10.087   3.897   3.857
  154    H    HIS  25           H        HIS  25  -7.474   0.680   1.437
  155    HA   HIS  25           HA       HIS  25  -5.067   1.188   0.289
  156    HB2  HIS  25           1HB      HIS  25  -6.167   2.662  -1.233
  157    HB3  HIS  25           2HB      HIS  25  -7.347   1.439  -0.770
  158    HD1  HIS  25           HD1      HIS  25  -8.969   2.296   1.319
  159    HD2  HIS  25           HD2      HIS  25  -7.128   5.178  -1.041
  160    HE1  HIS  25           HE1      HIS  25 -10.280   4.410   1.693
  161    H    ALA  26           H        ALA  26  -6.881   3.418   2.368
  162    HA   ALA  26           HA       ALA  26  -5.083   5.577   2.191
  163    HB1  ALA  26           3HB      ALA  26  -6.164   6.150   4.492
  164    HB2  ALA  26           1HB      ALA  26  -7.141   6.189   3.024
  165    HB3  ALA  26           2HB      ALA  26  -7.234   4.802   4.110
  166    H    SER  27           H        SER  27  -5.127   2.701   4.180
  167    HA   SER  27           HA       SER  27  -3.156   3.597   6.044
  168    HB2  SER  27           1HB      SER  27  -4.240   0.859   5.369
  169    HB3  SER  27           2HB      SER  27  -3.027   1.129   6.620
  170    HG   SER  27           HG       SER  27  -5.405   2.623   6.639
  171    H    LEU  28           H        LEU  28  -3.093   1.978   2.953
  172    HA   LEU  28           HA       LEU  28  -0.299   1.266   3.159
  173    HB2  LEU  28           1HB      LEU  28  -1.862  -0.150   1.924
  174    HB3  LEU  28           2HB      LEU  28  -2.190   1.178   0.812
  175    HG   LEU  28           HG       LEU  28   0.198   1.082   0.101
  176   HD11  LEU  28          1HD1      LEU  28   0.500  -1.635   1.194
  177   HD12  LEU  28          2HD1      LEU  28   0.638  -0.319   2.359
  178   HD13  LEU  28          3HD1      LEU  28   1.699  -0.364   0.951
  179   HD21  LEU  28          3HD2      LEU  28  -1.571  -1.327  -0.239
  180   HD22  LEU  28          1HD2      LEU  28  -0.066  -1.108  -1.133
  181   HD23  LEU  28          2HD2      LEU  28  -1.381   0.052  -1.324
  182    H    THR  29           H        THR  29  -2.257   3.608   1.352
  183    HA   THR  29           HA       THR  29  -0.260   4.769  -0.185
  184    HB   THR  29           HB       THR  29  -2.833   5.221  -0.131
  185    HG1  THR  29           HG1      THR  29  -1.261   7.526  -0.573
  186   HG21  THR  29          3HG2      THR  29  -3.546   7.158   1.039
  187   HG22  THR  29          1HG2      THR  29  -1.896   7.572   1.505
  188   HG23  THR  29          2HG2      THR  29  -2.687   6.165   2.216
  189    H    GLN  30           H        GLN  30  -1.088   5.285   3.187
  190    HA   GLN  30           HA       GLN  30   0.639   7.562   3.492
  191    HB2  GLN  30           1HB      GLN  30  -1.051   5.905   5.313
  192    HB3  GLN  30           2HB      GLN  30   0.208   6.911   6.016
  193    HG2  GLN  30           1HG      GLN  30  -0.777   8.871   4.886
  194    HG3  GLN  30           2HG      GLN  30  -2.078   7.839   4.294
  195   HE21  GLN  30          1HE2      GLN  30  -2.849   9.938   5.686
  196   HE22  GLN  30          2HE2      GLN  30  -3.356   9.504   7.280
  197    H    HIS  31           H        HIS  31   0.723   4.208   4.698
  198    HA   HIS  31           HA       HIS  31   3.191   4.266   5.937
  199    HB2  HIS  31           1HB      HIS  31   1.930   2.322   6.279
  200    HB3  HIS  31           2HB      HIS  31   1.672   2.073   4.554
  201    HD1  HIS  31           HD1      HIS  31   4.235   1.582   7.252
  202    HD2  HIS  31           HD2      HIS  31   3.651   0.625   3.251
  203    HE1  HIS  31           HE1      HIS  31   6.034  -0.083   6.689
  204    H    GLN  32           H        GLN  32   2.494   3.368   2.561
  205    HA   GLN  32           HA       GLN  32   4.903   2.691   1.583
  206    HB2  GLN  32           1HB      GLN  32   2.669   4.288   0.438
  207    HB3  GLN  32           2HB      GLN  32   4.179   4.240  -0.463
  208    HG2  GLN  32           1HG      GLN  32   2.773   1.758   0.469
  209    HG3  GLN  32           2HG      GLN  32   2.429   2.527  -1.080
  210   HE21  GLN  32          1HE2      GLN  32   3.247   1.148  -2.516
  211   HE22  GLN  32          2HE2      GLN  32   4.883   0.593  -2.545
  212    H    ARG  33           H        ARG  33   4.019   5.831   2.763
  213    HA   ARG  33           HA       ARG  33   5.923   7.457   1.579
  214    HB2  ARG  33           1HB      ARG  33   4.844   7.565   4.401
  215    HB3  ARG  33           2HB      ARG  33   5.738   8.863   3.621
  216    HG2  ARG  33           1HG      ARG  33   3.319   7.819   2.253
  217    HG3  ARG  33           2HG      ARG  33   3.104   8.827   3.686
  218    HD2  ARG  33           1HD      ARG  33   3.101  10.393   1.987
  219    HD3  ARG  33           2HD      ARG  33   4.786  10.413   2.506
  220    HE   ARG  33           HE       ARG  33   4.662   8.555   0.486
  221   HH11  ARG  33          1HH1      ARG  33   3.940  11.942   0.835
  222   HH12  ARG  33          2HH1      ARG  33   4.306  12.324  -0.815
  223   HH21  ARG  33          1HH2      ARG  33   5.147   9.044  -1.688
  224   HH22  ARG  33          2HH2      ARG  33   4.992  10.674  -2.249
  225    H    VAL  34           H        VAL  34   6.213   5.499   4.530
  226    HA   VAL  34           HA       VAL  34   8.754   6.220   5.331
  227    HB   VAL  34           HB       VAL  34   8.936   3.994   6.373
  228   HG11  VAL  34          1HG1      VAL  34   6.114   4.593   6.904
  229   HG12  VAL  34          2HG1      VAL  34   7.498   4.569   8.000
  230   HG13  VAL  34          3HG1      VAL  34   7.193   5.985   6.993
  231   HG21  VAL  34          3HG2      VAL  34   7.309   3.194   4.247
  232   HG22  VAL  34          1HG2      VAL  34   7.875   2.203   5.592
  233   HG23  VAL  34          2HG2      VAL  34   6.313   3.016   5.692
  234    H    HIS  35           H        HIS  35   7.824   4.545   2.505
  235    HA   HIS  35           HA       HIS  35  10.574   3.601   2.060
  236    HB2  HIS  35           1HB      HIS  35   8.050   2.826   0.583
  237    HB3  HIS  35           2HB      HIS  35   9.649   2.124   0.352
  238    HD1  HIS  35           HD1      HIS  35  10.512   1.498   3.162
  239    HD2  HIS  35           HD2      HIS  35   6.630   0.884   1.816
  240    HE1  HIS  35           HE1      HIS  35   9.535  -0.239   4.696
  241    H    SER  36           H        SER  36  11.278   5.759   1.541
  242    HA   SER  36           HA       SER  36  10.386   7.600  -0.165
  243    HB2  SER  36           1HB      SER  36  13.175   6.477   0.047
  244    HB3  SER  36           2HB      SER  36  12.808   7.855  -0.990
  245    HG   SER  36           HG       SER  36  11.885   7.956   1.634
  246    H    GLY  37           H        GLY  37   9.786   7.794  -2.233
  247    HA2  GLY  37           1HA      GLY  37  10.846   6.004  -4.262
  248    HA3  GLY  37           2HA      GLY  37   9.129   5.832  -3.930
  249    H    GLU  38           H        GLU  38  11.244   7.205  -5.986
  250    HA   GLU  38           HA       GLU  38  11.190   8.928  -7.478
  251    HB2  GLU  38           1HB      GLU  38   9.034   7.580  -7.934
  252    HB3  GLU  38           2HB      GLU  38   8.201   8.922  -7.163
  253    HG2  GLU  38           1HG      GLU  38   9.472  10.392  -8.854
  254    HG3  GLU  38           2HG      GLU  38   9.737   8.883  -9.726
  255    H    LYS  39           H        LYS  39  11.713   9.816  -4.944
  256    HA   LYS  39           HA       LYS  39  10.411  12.449  -4.967
  257    HB2  LYS  39           1HB      LYS  39  10.062  12.474  -2.646
  258    HB3  LYS  39           2HB      LYS  39   9.532  10.873  -3.144
  259    HG2  LYS  39           1HG      LYS  39  11.919  10.129  -2.527
  260    HG3  LYS  39           2HG      LYS  39  12.000  11.659  -1.649
  261    HD2  LYS  39           1HD      LYS  39   9.667   9.837  -1.239
  262    HD3  LYS  39           2HD      LYS  39  11.199   9.490  -0.434
  263    HE2  LYS  39           1HE      LYS  39  11.125  11.909   0.373
  264    HE3  LYS  39           2HE      LYS  39   9.443  11.914  -0.154
  265    HZ1  LYS  39           3HZ      LYS  39   8.932  11.024   1.794
  266    HZ2  LYS  39           1HZ      LYS  39  10.561  10.846   2.217
  267    HZ3  LYS  39           2HZ      LYS  39   9.772   9.623   1.355
  268    HA   PRO  40           HA       PRO  40  14.490  14.069  -4.777
  269    HB2  PRO  40           1HB      PRO  40  14.032  16.423  -3.504
  270    HB3  PRO  40           2HB      PRO  40  13.552  16.127  -5.180
  271    HG2  PRO  40           1HG      PRO  40  11.900  16.007  -2.686
  272    HG3  PRO  40           2HG      PRO  40  11.495  16.707  -4.264
  273    HD2  PRO  40           1HD      PRO  40  10.608  14.272  -3.480
  274    HD3  PRO  40           2HD      PRO  40  10.960  14.659  -5.176
  275    H    SER  41           H        SER  41  16.220  14.629  -3.339
  276    HA   SER  41           HA       SER  41  15.733  13.947  -0.517
  277    HB2  SER  41           1HB      SER  41  16.770  12.018  -1.601
  278    HB3  SER  41           2HB      SER  41  18.068  13.040  -2.219
  279    HG   SER  41           HG       SER  41  17.631  12.066   0.349
  280    H    GLY  42           H        GLY  42  18.621  14.903  -2.363
  281    HA2  GLY  42           1HA      GLY  42  19.142  17.388  -2.215
  282    HA3  GLY  42           2HA      GLY  42  18.934  17.158  -0.485
  283    HA   PRO  43           HA       PRO  43  23.231  16.334  -0.158
  284    HB2  PRO  43           1HB      PRO  43  23.254  14.828   2.100
  285    HB3  PRO  43           2HB      PRO  43  22.963  16.571   2.112
  286    HG2  PRO  43           1HG      PRO  43  20.992  14.322   2.246
  287    HG3  PRO  43           2HG      PRO  43  21.032  15.832   3.175
  288    HD2  PRO  43           1HD      PRO  43  19.406  15.478   1.040
  289    HD3  PRO  43           2HD      PRO  43  20.097  17.058   1.462
  290    H    SER  44           H        SER  44  23.781  15.041  -1.889
  291    HA   SER  44           HA       SER  44  23.029  12.314  -2.132
  292    HB2  SER  44           1HB      SER  44  24.828  12.267  -3.903
  293    HB3  SER  44           2HB      SER  44  23.602  13.514  -4.127
  294    HG   SER  44           HG       SER  44  25.373  14.685  -4.329
  295    H    SER  45           H        SER  45  23.573  11.395  -0.105
  296    HA   SER  45           HA       SER  45  26.404  10.650   0.085
  297    HB2  SER  45           1HB      SER  45  25.595  12.529   1.741
  298    HB3  SER  45           2HB      SER  45  24.882  11.171   2.612
  299    HG   SER  45           HG       SER  45  27.087  11.759   3.220
  300    H    GLY  46           H        GLY  46  26.804   8.602   0.937
  301    HA2  GLY  46           1HA      GLY  46  25.158   6.903   2.296
  302    HA3  GLY  46           2HA      GLY  46  24.640   6.734   0.625
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1  -5.498 -27.071  -0.673
    2    HA2  GLY   1           1HA      GLY   1  -6.819 -29.706  -0.648
    3    HA3  GLY   1           2HA      GLY   1  -5.120 -29.424  -0.296
    4    H    SER   2           H        SER   2  -8.177 -28.048   0.922
    5    HA   SER   2           HA       SER   2  -8.690 -27.412   3.084
    6    HB2  SER   2           1HB      SER   2  -9.314 -29.290   4.371
    7    HB3  SER   2           2HB      SER   2  -9.394 -29.856   2.703
    8    HG   SER   2           HG       SER   2  -7.942 -31.280   3.191
    9    H    SER   3           H        SER   3  -6.057 -26.699   2.584
   10    HA   SER   3           HA       SER   3  -4.053 -27.614   4.198
   11    HB2  SER   3           1HB      SER   3  -4.690 -24.715   3.596
   12    HB3  SER   3           2HB      SER   3  -3.137 -25.320   4.171
   13    HG   SER   3           HG       SER   3  -4.409 -26.055   1.740
   14    H    GLY   4           H        GLY   4  -6.547 -25.238   5.096
   15    HA2  GLY   4           1HA      GLY   4  -7.545 -24.977   7.189
   16    HA3  GLY   4           2HA      GLY   4  -6.387 -26.119   7.856
   17    H    SER   5           H        SER   5  -6.704 -22.798   6.659
   18    HA   SER   5           HA       SER   5  -4.518 -22.031   8.481
   19    HB2  SER   5           1HB      SER   5  -3.971 -20.218   6.993
   20    HB3  SER   5           2HB      SER   5  -4.066 -21.693   6.031
   21    HG   SER   5           HG       SER   5  -5.311 -20.407   4.873
   22    H    SER   6           H        SER   6  -5.353 -21.184  10.270
   23    HA   SER   6           HA       SER   6  -7.786 -19.552  10.081
   24    HB2  SER   6           1HB      SER   6  -6.452 -20.785  12.505
   25    HB3  SER   6           2HB      SER   6  -7.959 -19.868  12.523
   26    HG   SER   6           HG       SER   6  -7.841 -22.380  12.281
   27    H    GLY   7           H        GLY   7  -7.638 -17.415  10.186
   28    HA2  GLY   7           1HA      GLY   7  -6.839 -15.517  11.563
   29    HA3  GLY   7           2HA      GLY   7  -5.244 -16.249  11.470
   30    H    THR   8           H        THR   8  -5.036 -16.891   8.822
   31    HA   THR   8           HA       THR   8  -4.464 -14.343   7.671
   32    HB   THR   8           HB       THR   8  -3.831 -15.694   5.638
   33    HG1  THR   8           HG1      THR   8  -4.057 -18.005   7.218
   34   HG21  THR   8          3HG2      THR   8  -2.586 -15.531   8.180
   35   HG22  THR   8          1HG2      THR   8  -1.824 -15.722   6.602
   36   HG23  THR   8          2HG2      THR   8  -2.279 -17.145   7.539
   37    H    GLY   9           H        GLY   9  -6.123 -13.092   7.038
   38    HA2  GLY   9           1HA      GLY   9  -8.363 -14.335   5.598
   39    HA3  GLY   9           2HA      GLY   9  -8.377 -12.740   6.335
   40    H    GLU  10           H        GLU  10  -9.336 -12.278   4.145
   41    HA   GLU  10           HA       GLU  10  -7.737 -12.353   1.819
   42    HB2  GLU  10           1HB      GLU  10 -10.215 -10.861   2.610
   43    HB3  GLU  10           2HB      GLU  10  -9.400 -10.474   1.101
   44    HG2  GLU  10           1HG      GLU  10 -10.278 -13.255   1.819
   45    HG3  GLU  10           2HG      GLU  10 -11.300 -12.113   0.948
   46    H    LYS  11           H        LYS  11  -6.171 -11.054   1.101
   47    HA   LYS  11           HA       LYS  11  -5.808  -8.437   2.396
   48    HB2  LYS  11           1HB      LYS  11  -3.717 -10.542   1.850
   49    HB3  LYS  11           2HB      LYS  11  -3.310  -8.858   2.155
   50    HG2  LYS  11           1HG      LYS  11  -3.851  -8.980   4.364
   51    HG3  LYS  11           2HG      LYS  11  -5.059 -10.243   4.113
   52    HD2  LYS  11           1HD      LYS  11  -3.324 -11.895   3.798
   53    HD3  LYS  11           2HD      LYS  11  -2.076 -10.649   3.895
   54    HE2  LYS  11           1HE      LYS  11  -3.220 -10.174   6.223
   55    HE3  LYS  11           2HE      LYS  11  -3.748 -11.847   6.050
   56    HZ1  LYS  11           3HZ      LYS  11  -1.636 -12.631   6.232
   57    HZ2  LYS  11           1HZ      LYS  11  -1.473 -11.237   7.176
   58    HZ3  LYS  11           2HZ      LYS  11  -0.924 -11.244   5.577
   59    HA   PRO  12           HA       PRO  12  -5.964  -7.943  -2.195
   60    HB2  PRO  12           1HB      PRO  12  -7.435  -5.663  -2.117
   61    HB3  PRO  12           2HB      PRO  12  -8.160  -7.274  -2.082
   62    HG2  PRO  12           1HG      PRO  12  -7.608  -5.396   0.183
   63    HG3  PRO  12           2HG      PRO  12  -9.045  -6.389  -0.122
   64    HD2  PRO  12           1HD      PRO  12  -7.125  -7.110   1.647
   65    HD3  PRO  12           2HD      PRO  12  -8.058  -8.297   0.714
   66    H    TYR  13           H        TYR  13  -4.936  -6.007   0.475
   67    HA   TYR  13           HA       TYR  13  -3.317  -4.346  -1.344
   68    HB2  TYR  13           1HB      TYR  13  -4.103  -3.616   1.478
   69    HB3  TYR  13           2HB      TYR  13  -3.377  -2.573   0.260
   70    HD1  TYR  13           HD2      TYR  13  -4.732  -1.834  -1.694
   71    HD2  TYR  13           HD1      TYR  13  -6.457  -3.963   1.561
   72    HE1  TYR  13           HE2      TYR  13  -6.970  -1.105  -2.410
   73    HE2  TYR  13           HE1      TYR  13  -8.699  -3.241   0.853
   74    HH   TYR  13           HH       TYR  13  -9.711  -1.400  -0.460
   75    H    GLU  14           H        GLU  14  -1.156  -3.923  -0.774
   76    HA   GLU  14           HA       GLU  14   0.096  -4.916   1.551
   77    HB2  GLU  14           1HB      GLU  14  -0.439  -7.078   0.395
   78    HB3  GLU  14           2HB      GLU  14   0.610  -6.572  -0.922
   79    HG2  GLU  14           1HG      GLU  14   2.531  -6.724   0.384
   80    HG3  GLU  14           2HG      GLU  14   1.618  -6.707   1.892
   81    H    CYS  15           H        CYS  15   2.183  -4.187   1.734
   82    HA   CYS  15           HA       CYS  15   2.995  -2.161  -0.111
   83    HB2  CYS  15           1HB      CYS  15   3.378  -2.377   2.489
   84    HB3  CYS  15           2HB      CYS  15   4.836  -3.229   1.990
   85    H    ASP  16           H        ASP  16   5.509  -2.163  -0.625
   86    HA   ASP  16           HA       ASP  16   6.096  -4.739  -1.931
   87    HB2  ASP  16           1HB      ASP  16   6.951  -2.001  -2.887
   88    HB3  ASP  16           2HB      ASP  16   7.151  -3.532  -3.736
   89    H    VAL  17           H        VAL  17   7.523  -1.869  -0.421
   90    HA   VAL  17           HA       VAL  17  10.187  -2.806  -0.405
   91    HB   VAL  17           HB       VAL  17   8.863  -0.823   1.452
   92   HG11  VAL  17          1HG1      VAL  17  11.269  -2.013   1.850
   93   HG12  VAL  17          2HG1      VAL  17  11.738  -0.606   0.894
   94   HG13  VAL  17          3HG1      VAL  17  10.853  -0.391   2.405
   95   HG21  VAL  17          3HG2      VAL  17   9.137  -0.578  -1.231
   96   HG22  VAL  17          1HG2      VAL  17   9.146   0.779  -0.105
   97   HG23  VAL  17          2HG2      VAL  17  10.669   0.100  -0.679
   98    H    CYS  18           H        CYS  18   7.667  -2.833   2.108
   99    HA   CYS  18           HA       CYS  18   9.307  -4.720   3.653
  100    HB2  CYS  18           1HB      CYS  18   7.987  -4.106   5.583
  101    HB3  CYS  18           2HB      CYS  18   8.566  -2.638   4.801
  102    H    ARG  19           H        ARG  19   6.395  -4.398   1.841
  103    HA   ARG  19           HA       ARG  19   4.817  -5.903   1.191
  104    HB2  ARG  19           1HB      ARG  19   6.637  -7.956   2.462
  105    HB3  ARG  19           2HB      ARG  19   5.326  -8.286   1.337
  106    HG2  ARG  19           1HG      ARG  19   7.260  -8.403   0.041
  107    HG3  ARG  19           2HG      ARG  19   6.593  -6.807  -0.309
  108    HD2  ARG  19           1HD      ARG  19   8.235  -5.713   0.893
  109    HD3  ARG  19           2HD      ARG  19   8.596  -7.127   1.882
  110    HE   ARG  19           HE       ARG  19   9.238  -7.385  -0.927
  111   HH11  ARG  19          1HH1      ARG  19  10.360  -6.525   2.255
  112   HH12  ARG  19          2HH1      ARG  19  12.033  -6.759   1.870
  113   HH21  ARG  19          1HH2      ARG  19  11.438  -7.697  -1.445
  114   HH22  ARG  19          2HH2      ARG  19  12.645  -7.425  -0.234
  115    H    LYS  20           H        LYS  20   4.185  -4.534   3.408
  116    HA   LYS  20           HA       LYS  20   3.274  -6.435   5.431
  117    HB2  LYS  20           1HB      LYS  20   4.391  -4.183   5.962
  118    HB3  LYS  20           2HB      LYS  20   2.863  -3.452   5.487
  119    HG2  LYS  20           1HG      LYS  20   1.702  -4.655   7.231
  120    HG3  LYS  20           2HG      LYS  20   3.186  -5.505   7.667
  121    HD2  LYS  20           1HD      LYS  20   4.187  -3.194   8.080
  122    HD3  LYS  20           2HD      LYS  20   2.530  -2.590   8.003
  123    HE2  LYS  20           1HE      LYS  20   3.174  -2.997  10.307
  124    HE3  LYS  20           2HE      LYS  20   1.905  -4.119   9.820
  125    HZ1  LYS  20           3HZ      LYS  20   3.724  -5.166  11.094
  126    HZ2  LYS  20           1HZ      LYS  20   4.797  -4.784   9.844
  127    HZ3  LYS  20           2HZ      LYS  20   3.514  -5.848   9.560
  128    H    ALA  21           H        ALA  21   1.064  -6.453   6.145
  129    HA   ALA  21           HA       ALA  21  -0.797  -6.017   3.928
  130    HB1  ALA  21           3HB      ALA  21  -1.761  -7.915   4.565
  131    HB2  ALA  21           1HB      ALA  21  -0.461  -8.112   5.741
  132    HB3  ALA  21           2HB      ALA  21  -1.966  -7.323   6.214
  133    H    PHE  22           H        PHE  22  -2.774  -4.934   4.200
  134    HA   PHE  22           HA       PHE  22  -3.193  -3.451   6.677
  135    HB2  PHE  22           1HB      PHE  22  -3.135  -2.037   4.008
  136    HB3  PHE  22           2HB      PHE  22  -3.341  -1.308   5.598
  137    HD1  PHE  22           HD1      PHE  22  -0.934  -3.033   3.392
  138    HD2  PHE  22           HD2      PHE  22  -1.484  -0.714   6.919
  139    HE1  PHE  22           HE1      PHE  22   1.498  -2.696   3.546
  140    HE2  PHE  22           HE2      PHE  22   0.947  -0.373   7.078
  141    HZ   PHE  22           HZ       PHE  22   2.442  -1.364   5.390
  142    H    SER  23           H        SER  23  -5.325  -2.515   6.844
  143    HA   SER  23           HA       SER  23  -7.321  -4.208   5.666
  144    HB2  SER  23           1HB      SER  23  -7.637  -1.778   7.445
  145    HB3  SER  23           2HB      SER  23  -8.907  -2.935   7.049
  146    HG   SER  23           HG       SER  23  -6.536  -3.399   8.530
  147    H    HIS  24           H        HIS  24  -6.806  -0.678   5.655
  148    HA   HIS  24           HA       HIS  24  -8.384  -0.536   3.176
  149    HB2  HIS  24           1HB      HIS  24  -9.036   0.819   5.269
  150    HB3  HIS  24           2HB      HIS  24  -7.642   1.826   4.889
  151    HD1  HIS  24           HD1      HIS  24  -8.085   3.717   3.352
  152    HD2  HIS  24           HD2      HIS  24 -10.947   0.726   2.998
  153    HE1  HIS  24           HE1      HIS  24  -9.799   4.613   1.745
  154    H    HIS  25           H        HIS  25  -7.677   1.112   1.585
  155    HA   HIS  25           HA       HIS  25  -5.032   0.661   0.769
  156    HB2  HIS  25           1HB      HIS  25  -7.091   1.432  -0.605
  157    HB3  HIS  25           2HB      HIS  25  -6.613   3.057  -0.125
  158    HD1  HIS  25           HD1      HIS  25  -5.056   0.038  -1.838
  159    HD2  HIS  25           HD2      HIS  25  -4.813   4.185  -1.802
  160    HE1  HIS  25           HE1      HIS  25  -3.431   0.632  -3.663
  161    H    ALA  26           H        ALA  26  -6.499   3.663   2.021
  162    HA   ALA  26           HA       ALA  26  -4.497   5.411   2.100
  163    HB1  ALA  26           3HB      ALA  26  -5.332   6.244   4.271
  164    HB2  ALA  26           1HB      ALA  26  -6.627   5.895   3.125
  165    HB3  ALA  26           2HB      ALA  26  -6.286   4.771   4.441
  166    H    SER  27           H        SER  27  -4.905   3.099   4.792
  167    HA   SER  27           HA       SER  27  -2.671   3.557   6.236
  168    HB2  SER  27           1HB      SER  27  -4.520   1.669   6.401
  169    HB3  SER  27           2HB      SER  27  -3.269   0.689   5.636
  170    HG   SER  27           HG       SER  27  -2.993   0.524   7.831
  171    H    LEU  28           H        LEU  28  -2.822   1.620   3.273
  172    HA   LEU  28           HA       LEU  28  -0.025   1.000   3.302
  173    HB2  LEU  28           1HB      LEU  28  -1.336  -0.583   2.210
  174    HB3  LEU  28           2HB      LEU  28  -2.251   0.642   1.334
  175    HG   LEU  28           HG       LEU  28  -0.232   1.092  -0.040
  176   HD11  LEU  28          1HD1      LEU  28   0.863  -1.155   1.619
  177   HD12  LEU  28          2HD1      LEU  28   1.571   0.427   1.295
  178   HD13  LEU  28          3HD1      LEU  28   1.496  -0.784   0.015
  179   HD21  LEU  28          3HD2      LEU  28  -0.361  -1.018  -1.336
  180   HD22  LEU  28          1HD2      LEU  28  -1.940  -0.357  -0.913
  181   HD23  LEU  28          2HD2      LEU  28  -1.291  -1.731  -0.018
  182    H    THR  29           H        THR  29  -2.079   3.308   1.580
  183    HA   THR  29           HA       THR  29  -0.167   4.349  -0.168
  184    HB   THR  29           HB       THR  29  -2.630   5.567   1.063
  185    HG1  THR  29           HG1      THR  29  -2.399   3.890  -0.813
  186   HG21  THR  29          3HG2      THR  29  -1.874   7.605   0.551
  187   HG22  THR  29          1HG2      THR  29  -1.933   7.121  -1.143
  188   HG23  THR  29          2HG2      THR  29  -0.436   6.945  -0.227
  189    H    GLN  30           H        GLN  30  -1.246   5.746   2.937
  190    HA   GLN  30           HA       GLN  30   0.712   7.745   3.053
  191    HB2  GLN  30           1HB      GLN  30  -1.321   7.758   4.434
  192    HB3  GLN  30           2HB      GLN  30  -0.719   6.375   5.337
  193    HG2  GLN  30           1HG      GLN  30  -0.113   8.032   6.756
  194    HG3  GLN  30           2HG      GLN  30   1.332   7.984   5.747
  195   HE21  GLN  30          1HE2      GLN  30   1.367   9.501   3.907
  196   HE22  GLN  30          2HE2      GLN  30   0.662  11.063   4.127
  197    H    HIS  31           H        HIS  31   0.647   4.506   4.513
  198    HA   HIS  31           HA       HIS  31   3.022   4.585   5.920
  199    HB2  HIS  31           1HB      HIS  31   1.742   2.667   6.271
  200    HB3  HIS  31           2HB      HIS  31   1.540   2.367   4.547
  201    HD1  HIS  31           HD1      HIS  31   3.988   1.904   7.353
  202    HD2  HIS  31           HD2      HIS  31   3.539   0.843   3.361
  203    HE1  HIS  31           HE1      HIS  31   5.770   0.186   6.909
  204    H    GLN  32           H        GLN  32   2.558   3.526   2.550
  205    HA   GLN  32           HA       GLN  32   5.010   2.779   1.770
  206    HB2  GLN  32           1HB      GLN  32   2.946   4.442   0.391
  207    HB3  GLN  32           2HB      GLN  32   4.500   4.197  -0.394
  208    HG2  GLN  32           1HG      GLN  32   2.713   1.974   0.562
  209    HG3  GLN  32           2HG      GLN  32   2.743   2.594  -1.088
  210   HE21  GLN  32          1HE2      GLN  32   3.210   0.180  -1.294
  211   HE22  GLN  32          2HE2      GLN  32   4.879  -0.266  -1.333
  212    H    ARG  33           H        ARG  33   4.105   6.000   2.720
  213    HA   ARG  33           HA       ARG  33   6.115   7.543   1.636
  214    HB2  ARG  33           1HB      ARG  33   4.830   7.726   4.364
  215    HB3  ARG  33           2HB      ARG  33   5.871   8.972   3.688
  216    HG2  ARG  33           1HG      ARG  33   3.347   8.016   2.361
  217    HG3  ARG  33           2HG      ARG  33   3.418   9.392   3.464
  218    HD2  ARG  33           1HD      ARG  33   5.156   9.186   1.019
  219    HD3  ARG  33           2HD      ARG  33   3.545   9.903   0.976
  220    HE   ARG  33           HE       ARG  33   4.683  11.281   2.957
  221   HH11  ARG  33          1HH1      ARG  33   5.843  10.455  -0.220
  222   HH12  ARG  33          2HH1      ARG  33   6.822  11.876  -0.375
  223   HH21  ARG  33          1HH2      ARG  33   5.969  13.156   2.766
  224   HH22  ARG  33          2HH2      ARG  33   6.894  13.411   1.325
  225    H    VAL  34           H        VAL  34   6.204   5.746   4.709
  226    HA   VAL  34           HA       VAL  34   8.657   6.395   5.676
  227    HB   VAL  34           HB       VAL  34   8.802   4.184   6.687
  228   HG11  VAL  34          1HG1      VAL  34   6.428   4.087   7.632
  229   HG12  VAL  34          2HG1      VAL  34   7.326   5.592   7.838
  230   HG13  VAL  34          3HG1      VAL  34   6.090   5.466   6.586
  231   HG21  VAL  34          3HG2      VAL  34   6.349   3.151   5.444
  232   HG22  VAL  34          1HG2      VAL  34   7.748   3.236   4.373
  233   HG23  VAL  34          2HG2      VAL  34   7.842   2.317   5.876
  234    H    HIS  35           H        HIS  35   7.977   4.610   2.793
  235    HA   HIS  35           HA       HIS  35  10.797   3.847   2.510
  236    HB2  HIS  35           1HB      HIS  35   8.508   3.043   0.713
  237    HB3  HIS  35           2HB      HIS  35  10.105   2.307   0.818
  238    HD1  HIS  35           HD1      HIS  35  10.526   1.468   3.541
  239    HD2  HIS  35           HD2      HIS  35   6.699   1.463   1.922
  240    HE1  HIS  35           HE1      HIS  35   9.197  -0.126   4.962
  241    H    SER  36           H        SER  36  12.011   4.447   0.710
  242    HA   SER  36           HA       SER  36  10.852   6.574  -0.966
  243    HB2  SER  36           1HB      SER  36  13.020   7.750  -0.889
  244    HB3  SER  36           2HB      SER  36  12.315   7.591   0.720
  245    HG   SER  36           HG       SER  36  13.755   5.465   0.450
  246    H    GLY  37           H        GLY  37  10.513   5.156  -2.685
  247    HA2  GLY  37           1HA      GLY  37  11.091   3.676  -4.388
  248    HA3  GLY  37           2HA      GLY  37  12.230   4.973  -4.721
  249    H    GLU  38           H        GLU  38  12.097   2.527  -2.137
  250    HA   GLU  38           HA       GLU  38  14.918   1.973  -2.549
  251    HB2  GLU  38           1HB      GLU  38  13.877   2.242  -0.265
  252    HB3  GLU  38           2HB      GLU  38  13.055   0.712  -0.536
  253    HG2  GLU  38           1HG      GLU  38  15.059   0.426   0.812
  254    HG3  GLU  38           2HG      GLU  38  15.187  -0.429  -0.725
  255    H    LYS  39           H        LYS  39  15.738   0.214  -3.510
  256    HA   LYS  39           HA       LYS  39  13.837  -1.781  -4.532
  257    HB2  LYS  39           1HB      LYS  39  15.461  -2.264  -6.260
  258    HB3  LYS  39           2HB      LYS  39  15.163  -0.531  -6.211
  259    HG2  LYS  39           1HG      LYS  39  17.250  -0.060  -5.352
  260    HG3  LYS  39           2HG      LYS  39  17.460  -1.684  -4.692
  261    HD2  LYS  39           1HD      LYS  39  17.277  -1.231  -7.651
  262    HD3  LYS  39           2HD      LYS  39  18.804  -1.018  -6.792
  263    HE2  LYS  39           1HE      LYS  39  18.923  -3.226  -7.471
  264    HE3  LYS  39           2HE      LYS  39  18.300  -3.371  -5.828
  265    HZ1  LYS  39           3HZ      LYS  39  16.234  -3.090  -7.802
  266    HZ2  LYS  39           1HZ      LYS  39  16.395  -4.229  -6.561
  267    HZ3  LYS  39           2HZ      LYS  39  17.183  -4.470  -8.038
  268    HA   PRO  40           HA       PRO  40  15.533  -4.964  -2.025
  269    HB2  PRO  40           1HB      PRO  40  15.194  -7.117  -3.645
  270    HB3  PRO  40           2HB      PRO  40  13.852  -6.313  -2.822
  271    HG2  PRO  40           1HG      PRO  40  14.785  -6.025  -5.652
  272    HG3  PRO  40           2HG      PRO  40  13.131  -6.153  -5.027
  273    HD2  PRO  40           1HD      PRO  40  14.242  -3.787  -5.733
  274    HD3  PRO  40           2HD      PRO  40  13.053  -3.931  -4.423
  275    H    SER  41           H        SER  41  17.663  -5.010  -1.647
  276    HA   SER  41           HA       SER  41  19.446  -5.861  -3.836
  277    HB2  SER  41           1HB      SER  41  19.996  -3.933  -1.570
  278    HB3  SER  41           2HB      SER  41  21.237  -4.557  -2.657
  279    HG   SER  41           HG       SER  41  18.920  -3.211  -3.573
  280    H    GLY  42           H        GLY  42  19.347  -5.679  -0.269
  281    HA2  GLY  42           1HA      GLY  42  19.319  -7.944   0.835
  282    HA3  GLY  42           2HA      GLY  42  20.674  -8.319  -0.219
  283    HA   PRO  43           HA       PRO  43  22.099  -5.124   3.171
  284    HB2  PRO  43           1HB      PRO  43  20.624  -5.210   5.449
  285    HB3  PRO  43           2HB      PRO  43  20.277  -4.096   4.121
  286    HG2  PRO  43           1HG      PRO  43  18.983  -6.712   4.785
  287    HG3  PRO  43           2HG      PRO  43  18.230  -5.188   4.279
  288    HD2  PRO  43           1HD      PRO  43  18.645  -7.246   2.570
  289    HD3  PRO  43           2HD      PRO  43  18.702  -5.549   2.052
  290    H    SER  44           H        SER  44  23.242  -5.515   5.231
  291    HA   SER  44           HA       SER  44  23.615  -8.401   5.675
  292    HB2  SER  44           1HB      SER  44  25.531  -6.849   4.817
  293    HB3  SER  44           2HB      SER  44  25.622  -6.323   6.498
  294    HG   SER  44           HG       SER  44  26.211  -8.331   7.110
  295    H    SER  45           H        SER  45  23.629  -9.239   7.728
  296    HA   SER  45           HA       SER  45  22.257  -7.683   9.733
  297    HB2  SER  45           1HB      SER  45  22.325  -9.805  11.047
  298    HB3  SER  45           2HB      SER  45  21.613 -10.002   9.446
  299    HG   SER  45           HG       SER  45  23.463 -11.466  10.379
  300    H    GLY  46           H        GLY  46  23.049  -6.963  11.668
  301    HA2  GLY  46           1HA      GLY  46  25.776  -7.608  12.451
  302    HA3  GLY  46           2HA      GLY  46  25.488  -5.934  12.001
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1   2.406 -29.704  -8.547
    2    HA2  GLY   1           1HA      GLY   1   1.601 -29.499  -5.942
    3    HA3  GLY   1           2HA      GLY   1   3.088 -28.785  -6.548
    4    H    SER   2           H        SER   2   0.107 -28.173  -5.132
    5    HA   SER   2           HA       SER   2   0.515 -25.291  -5.462
    6    HB2  SER   2           1HB      SER   2  -1.852 -24.893  -5.868
    7    HB3  SER   2           2HB      SER   2  -1.224 -25.994  -7.095
    8    HG   SER   2           HG       SER   2  -3.291 -26.397  -5.586
    9    H    SER   3           H        SER   3   0.187 -24.132  -3.643
   10    HA   SER   3           HA       SER   3  -0.644 -25.628  -1.257
   11    HB2  SER   3           1HB      SER   3   0.989 -23.100  -1.566
   12    HB3  SER   3           2HB      SER   3   0.475 -23.751  -0.009
   13    HG   SER   3           HG       SER   3   2.114 -25.052  -1.929
   14    H    GLY   4           H        GLY   4  -2.685 -24.788  -2.946
   15    HA2  GLY   4           1HA      GLY   4  -4.528 -23.379  -3.105
   16    HA3  GLY   4           2HA      GLY   4  -4.599 -23.754  -1.390
   17    H    SER   5           H        SER   5  -3.170 -21.491  -3.716
   18    HA   SER   5           HA       SER   5  -3.721 -19.301  -1.889
   19    HB2  SER   5           1HB      SER   5  -1.368 -20.221  -1.414
   20    HB3  SER   5           2HB      SER   5  -0.926 -19.563  -2.989
   21    HG   SER   5           HG       SER   5  -2.219 -17.964  -1.061
   22    H    SER   6           H        SER   6  -4.831 -17.951  -3.128
   23    HA   SER   6           HA       SER   6  -4.116 -17.687  -5.962
   24    HB2  SER   6           1HB      SER   6  -6.504 -18.236  -5.205
   25    HB3  SER   6           2HB      SER   6  -6.590 -16.563  -4.652
   26    HG   SER   6           HG       SER   6  -6.742 -15.913  -6.652
   27    H    GLY   7           H        GLY   7  -5.163 -15.597  -3.260
   28    HA2  GLY   7           1HA      GLY   7  -3.976 -13.656  -2.567
   29    HA3  GLY   7           2HA      GLY   7  -3.205 -13.599  -4.146
   30    H    THR   8           H        THR   8  -6.651 -13.905  -3.391
   31    HA   THR   8           HA       THR   8  -7.123 -11.173  -4.301
   32    HB   THR   8           HB       THR   8  -8.776 -11.795  -5.947
   33    HG1  THR   8           HG1      THR   8  -8.204 -14.429  -5.062
   34   HG21  THR   8          3HG2      THR   8  -6.134 -13.207  -6.286
   35   HG22  THR   8          1HG2      THR   8  -6.585 -11.603  -6.864
   36   HG23  THR   8          2HG2      THR   8  -7.315 -13.038  -7.585
   37    H    GLY   9           H        GLY   9  -8.676 -10.212  -3.142
   38    HA2  GLY   9           1HA      GLY   9 -11.063 -10.584  -2.348
   39    HA3  GLY   9           2HA      GLY   9 -10.379 -11.939  -1.461
   40    H    GLU  10           H        GLU  10  -9.491 -11.596   0.502
   41    HA   GLU  10           HA       GLU  10  -9.782  -8.939   1.629
   42    HB2  GLU  10           1HB      GLU  10  -9.035 -11.595   2.859
   43    HB3  GLU  10           2HB      GLU  10  -9.150 -10.095   3.769
   44    HG2  GLU  10           1HG      GLU  10 -11.217 -10.949   4.162
   45    HG3  GLU  10           2HG      GLU  10 -11.552 -10.019   2.703
   46    H    LYS  11           H        LYS  11  -8.123  -7.781   2.664
   47    HA   LYS  11           HA       LYS  11  -6.050  -6.847   2.779
   48    HB2  LYS  11           1HB      LYS  11  -4.850  -9.591   2.614
   49    HB3  LYS  11           2HB      LYS  11  -4.334  -8.213   3.578
   50    HG2  LYS  11           1HG      LYS  11  -6.323  -8.490   4.999
   51    HG3  LYS  11           2HG      LYS  11  -6.775  -9.912   4.055
   52    HD2  LYS  11           1HD      LYS  11  -4.437 -10.798   4.652
   53    HD3  LYS  11           2HD      LYS  11  -4.423  -9.534   5.883
   54    HE2  LYS  11           1HE      LYS  11  -6.179 -10.492   7.063
   55    HE3  LYS  11           2HE      LYS  11  -6.740 -11.417   5.670
   56    HZ1  LYS  11           3HZ      LYS  11  -4.697 -12.064   7.621
   57    HZ2  LYS  11           1HZ      LYS  11  -4.299 -12.435   6.018
   58    HZ3  LYS  11           2HZ      LYS  11  -5.695 -13.087   6.716
   59    HA   PRO  12           HA       PRO  12  -5.366  -7.952  -1.808
   60    HB2  PRO  12           1HB      PRO  12  -6.738  -5.887  -2.915
   61    HB3  PRO  12           2HB      PRO  12  -7.478  -7.454  -2.565
   62    HG2  PRO  12           1HG      PRO  12  -7.587  -4.913  -0.986
   63    HG3  PRO  12           2HG      PRO  12  -8.889  -6.060  -1.352
   64    HD2  PRO  12           1HD      PRO  12  -7.607  -6.025   1.032
   65    HD3  PRO  12           2HD      PRO  12  -8.245  -7.517   0.313
   66    H    TYR  13           H        TYR  13  -4.640  -5.674   0.455
   67    HA   TYR  13           HA       TYR  13  -2.866  -4.220  -1.396
   68    HB2  TYR  13           1HB      TYR  13  -3.985  -3.117   1.185
   69    HB3  TYR  13           2HB      TYR  13  -3.076  -2.245  -0.044
   70    HD1  TYR  13           HD2      TYR  13  -4.137  -1.809  -2.271
   71    HD2  TYR  13           HD1      TYR  13  -6.334  -3.389   1.012
   72    HE1  TYR  13           HE2      TYR  13  -6.238  -1.169  -3.377
   73    HE2  TYR  13           HE1      TYR  13  -8.442  -2.754  -0.085
   74    HH   TYR  13           HH       TYR  13  -8.464  -0.914  -3.095
   75    H    GLU  14           H        GLU  14  -0.753  -4.347  -0.990
   76    HA   GLU  14           HA       GLU  14   0.248  -4.760   1.690
   77    HB2  GLU  14           1HB      GLU  14  -0.340  -7.050   0.589
   78    HB3  GLU  14           2HB      GLU  14   1.117  -6.774  -0.356
   79    HG2  GLU  14           1HG      GLU  14   2.401  -6.567   1.735
   80    HG3  GLU  14           2HG      GLU  14   0.936  -6.935   2.644
   81    H    CYS  15           H        CYS  15   2.385  -4.158   1.934
   82    HA   CYS  15           HA       CYS  15   3.426  -2.383  -0.024
   83    HB2  CYS  15           1HB      CYS  15   3.743  -2.497   2.605
   84    HB3  CYS  15           2HB      CYS  15   5.158  -3.448   2.163
   85    H    ASP  16           H        ASP  16   5.966  -2.632  -0.429
   86    HA   ASP  16           HA       ASP  16   6.385  -5.333  -1.532
   87    HB2  ASP  16           1HB      ASP  16   5.907  -3.544  -3.246
   88    HB3  ASP  16           2HB      ASP  16   7.409  -2.766  -2.753
   89    H    VAL  17           H        VAL  17   8.042  -2.374  -0.463
   90    HA   VAL  17           HA       VAL  17  10.619  -3.480  -0.290
   91    HB   VAL  17           HB       VAL  17   9.425  -1.186   1.273
   92   HG11  VAL  17          1HG1      VAL  17  11.911  -2.517   1.599
   93   HG12  VAL  17          2HG1      VAL  17  12.227  -0.926   0.903
   94   HG13  VAL  17          3HG1      VAL  17  11.325  -1.066   2.412
   95   HG21  VAL  17          3HG2      VAL  17  11.110  -1.192  -1.230
   96   HG22  VAL  17          1HG2      VAL  17   9.374  -0.886  -1.162
   97   HG23  VAL  17          2HG2      VAL  17  10.497   0.232  -0.388
   98    H    CYS  18           H        CYS  18   8.169  -2.968   2.246
   99    HA   CYS  18           HA       CYS  18   9.703  -4.714   4.032
  100    HB2  CYS  18           1HB      CYS  18   8.423  -3.805   5.835
  101    HB3  CYS  18           2HB      CYS  18   8.919  -2.454   4.822
  102    H    ARG  19           H        ARG  19   6.887  -4.641   2.075
  103    HA   ARG  19           HA       ARG  19   5.285  -6.187   1.609
  104    HB2  ARG  19           1HB      ARG  19   7.173  -8.001   3.119
  105    HB3  ARG  19           2HB      ARG  19   5.760  -8.560   2.232
  106    HG2  ARG  19           1HG      ARG  19   7.934  -6.970   0.912
  107    HG3  ARG  19           2HG      ARG  19   8.016  -8.725   1.073
  108    HD2  ARG  19           1HD      ARG  19   5.564  -7.464  -0.070
  109    HD3  ARG  19           2HD      ARG  19   7.001  -7.631  -1.077
  110    HE   ARG  19           HE       ARG  19   6.730 -10.111  -0.129
  111   HH11  ARG  19          1HH1      ARG  19   4.403  -7.918  -1.507
  112   HH12  ARG  19          2HH1      ARG  19   3.410  -9.177  -2.163
  113   HH21  ARG  19          1HH2      ARG  19   5.432 -11.778  -0.989
  114   HH22  ARG  19          2HH2      ARG  19   3.996 -11.372  -1.868
  115    H    LYS  20           H        LYS  20   4.592  -4.538   3.591
  116    HA   LYS  20           HA       LYS  20   3.656  -6.117   5.858
  117    HB2  LYS  20           1HB      LYS  20   4.678  -3.858   6.190
  118    HB3  LYS  20           2HB      LYS  20   3.311  -3.160   5.331
  119    HG2  LYS  20           1HG      LYS  20   1.810  -3.706   7.037
  120    HG3  LYS  20           2HG      LYS  20   2.925  -4.862   7.768
  121    HD2  LYS  20           1HD      LYS  20   4.331  -3.128   8.575
  122    HD3  LYS  20           2HD      LYS  20   3.501  -1.911   7.602
  123    HE2  LYS  20           1HE      LYS  20   2.564  -1.532   9.664
  124    HE3  LYS  20           2HE      LYS  20   1.411  -2.678   8.982
  125    HZ1  LYS  20           3HZ      LYS  20   1.761  -3.747  10.908
  126    HZ2  LYS  20           1HZ      LYS  20   3.254  -3.002  11.193
  127    HZ3  LYS  20           2HZ      LYS  20   3.156  -4.327  10.147
  128    H    ALA  21           H        ALA  21   1.461  -6.259   6.453
  129    HA   ALA  21           HA       ALA  21  -0.368  -6.098   4.170
  130    HB1  ALA  21           3HB      ALA  21  -1.639  -7.342   6.356
  131    HB2  ALA  21           1HB      ALA  21  -1.035  -8.091   4.877
  132    HB3  ALA  21           2HB      ALA  21   0.008  -7.971   6.295
  133    H    PHE  22           H        PHE  22  -2.292  -4.984   4.232
  134    HA   PHE  22           HA       PHE  22  -2.885  -3.411   6.635
  135    HB2  PHE  22           1HB      PHE  22  -2.903  -2.225   3.855
  136    HB3  PHE  22           2HB      PHE  22  -3.176  -1.381   5.376
  137    HD1  PHE  22           HD1      PHE  22  -0.643  -3.049   3.288
  138    HD2  PHE  22           HD2      PHE  22  -1.369  -0.613   6.702
  139    HE1  PHE  22           HE1      PHE  22   1.759  -2.531   3.425
  140    HE2  PHE  22           HE2      PHE  22   1.031  -0.090   6.844
  141    HZ   PHE  22           HZ       PHE  22   2.598  -1.049   5.203
  142    H    SER  23           H        SER  23  -5.060  -2.811   6.882
  143    HA   SER  23           HA       SER  23  -6.910  -4.564   5.485
  144    HB2  SER  23           1HB      SER  23  -7.072  -4.416   7.920
  145    HB3  SER  23           2HB      SER  23  -7.339  -2.677   7.815
  146    HG   SER  23           HG       SER  23  -9.049  -4.318   6.355
  147    H    HIS  24           H        HIS  24  -6.464  -1.091   6.052
  148    HA   HIS  24           HA       HIS  24  -8.509  -0.519   4.029
  149    HB2  HIS  24           1HB      HIS  24  -8.452   0.585   6.373
  150    HB3  HIS  24           2HB      HIS  24  -7.137   1.556   5.717
  151    HD1  HIS  24           HD1      HIS  24  -7.870   3.687   4.716
  152    HD2  HIS  24           HD2      HIS  24 -10.868   0.813   4.584
  153    HE1  HIS  24           HE1      HIS  24  -9.867   4.844   3.717
  154    H    HIS  25           H        HIS  25  -7.937   0.041   2.039
  155    HA   HIS  25           HA       HIS  25  -5.470  -0.039   0.942
  156    HB2  HIS  25           1HB      HIS  25  -6.325   1.520  -0.832
  157    HB3  HIS  25           2HB      HIS  25  -7.398   0.171  -0.470
  158    HD1  HIS  25           HD1      HIS  25  -9.506   0.781   1.084
  159    HD2  HIS  25           HD2      HIS  25  -7.461   3.990  -0.583
  160    HE1  HIS  25           HE1      HIS  25 -11.065   2.745   1.277
  161    H    ALA  26           H        ALA  26  -6.964   2.823   2.405
  162    HA   ALA  26           HA       ALA  26  -5.066   4.734   1.808
  163    HB1  ALA  26           3HB      ALA  26  -6.085   6.054   3.363
  164    HB2  ALA  26           1HB      ALA  26  -7.327   4.815   3.180
  165    HB3  ALA  26           2HB      ALA  26  -6.214   4.754   4.547
  166    H    SER  27           H        SER  27  -5.149   2.636   4.691
  167    HA   SER  27           HA       SER  27  -2.954   3.437   6.050
  168    HB2  SER  27           1HB      SER  27  -3.697   0.554   5.494
  169    HB3  SER  27           2HB      SER  27  -2.665   1.110   6.812
  170    HG   SER  27           HG       SER  27  -4.602   2.466   7.361
  171    H    LEU  28           H        LEU  28  -2.992   1.800   2.977
  172    HA   LEU  28           HA       LEU  28  -0.164   1.227   2.994
  173    HB2  LEU  28           1HB      LEU  28  -1.803  -0.203   1.821
  174    HB3  LEU  28           2HB      LEU  28  -2.139   1.129   0.718
  175    HG   LEU  28           HG       LEU  28   0.208   1.019  -0.064
  176   HD11  LEU  28          1HD1      LEU  28   1.629  -0.804   0.544
  177   HD12  LEU  28          2HD1      LEU  28   0.367  -1.524   1.542
  178   HD13  LEU  28          3HD1      LEU  28   1.108   0.001   2.024
  179   HD21  LEU  28          3HD2      LEU  28  -0.425  -0.412  -1.657
  180   HD22  LEU  28          1HD2      LEU  28  -1.921  -0.585  -0.738
  181   HD23  LEU  28          2HD2      LEU  28  -0.609  -1.741  -0.511
  182    H    THR  29           H        THR  29  -2.250   3.284   0.956
  183    HA   THR  29           HA       THR  29  -0.296   4.627  -0.441
  184    HB   THR  29           HB       THR  29  -2.892   4.797  -0.599
  185    HG1  THR  29           HG1      THR  29  -2.608   6.707  -1.793
  186   HG21  THR  29          3HG2      THR  29  -3.995   6.221   0.740
  187   HG22  THR  29          1HG2      THR  29  -2.725   7.440   0.638
  188   HG23  THR  29          2HG2      THR  29  -2.584   6.114   1.792
  189    H    GLN  30           H        GLN  30  -1.083   4.888   2.894
  190    HA   GLN  30           HA       GLN  30   0.282   7.447   3.191
  191    HB2  GLN  30           1HB      GLN  30  -1.448   5.753   4.922
  192    HB3  GLN  30           2HB      GLN  30  -0.280   6.801   5.716
  193    HG2  GLN  30           1HG      GLN  30  -1.320   8.721   5.026
  194    HG3  GLN  30           2HG      GLN  30  -2.048   7.949   3.618
  195   HE21  GLN  30          1HE2      GLN  30  -3.058   9.541   6.021
  196   HE22  GLN  30          2HE2      GLN  30  -4.399   8.611   6.588
  197    H    HIS  31           H        HIS  31   0.552   4.137   4.480
  198    HA   HIS  31           HA       HIS  31   2.946   4.490   5.871
  199    HB2  HIS  31           1HB      HIS  31   1.923   2.497   6.411
  200    HB3  HIS  31           2HB      HIS  31   1.499   2.138   4.740
  201    HD1  HIS  31           HD1      HIS  31   4.322   1.852   7.192
  202    HD2  HIS  31           HD2      HIS  31   3.396   0.685   3.313
  203    HE1  HIS  31           HE1      HIS  31   6.108   0.207   6.540
  204    H    GLN  32           H        GLN  32   2.400   3.381   2.540
  205    HA   GLN  32           HA       GLN  32   4.842   2.682   1.672
  206    HB2  GLN  32           1HB      GLN  32   2.719   4.335   0.353
  207    HB3  GLN  32           2HB      GLN  32   4.233   4.024  -0.486
  208    HG2  GLN  32           1HG      GLN  32   2.349   1.926   0.565
  209    HG3  GLN  32           2HG      GLN  32   2.491   2.437  -1.116
  210   HE21  GLN  32          1HE2      GLN  32   2.788  -0.110  -0.849
  211   HE22  GLN  32          2HE2      GLN  32   4.440  -0.612  -0.895
  212    H    ARG  33           H        ARG  33   3.888   5.883   2.644
  213    HA   ARG  33           HA       ARG  33   5.793   7.489   1.489
  214    HB2  ARG  33           1HB      ARG  33   4.585   7.580   4.250
  215    HB3  ARG  33           2HB      ARG  33   5.656   8.838   3.646
  216    HG2  ARG  33           1HG      ARG  33   4.128   9.434   1.931
  217    HG3  ARG  33           2HG      ARG  33   3.128   8.014   2.244
  218    HD2  ARG  33           1HD      ARG  33   1.943   9.691   3.305
  219    HD3  ARG  33           2HD      ARG  33   2.898   9.015   4.624
  220    HE   ARG  33           HE       ARG  33   4.096  11.265   3.256
  221   HH11  ARG  33          1HH1      ARG  33   2.112  10.182   5.904
  222   HH12  ARG  33          2HH1      ARG  33   2.380  11.604   6.857
  223   HH21  ARG  33          1HH2      ARG  33   4.457  13.142   4.502
  224   HH22  ARG  33          2HH2      ARG  33   3.713  13.287   6.058
  225    H    VAL  34           H        VAL  34   6.113   5.768   4.596
  226    HA   VAL  34           HA       VAL  34   8.598   6.446   5.398
  227    HB   VAL  34           HB       VAL  34   8.889   4.144   6.287
  228   HG11  VAL  34          1HG1      VAL  34   7.172   4.306   7.873
  229   HG12  VAL  34          2HG1      VAL  34   7.419   5.963   7.321
  230   HG13  VAL  34          3HG1      VAL  34   6.052   5.026   6.718
  231   HG21  VAL  34          3HG2      VAL  34   7.279   3.429   4.134
  232   HG22  VAL  34          1HG2      VAL  34   7.829   2.378   5.440
  233   HG23  VAL  34          2HG2      VAL  34   6.263   3.181   5.554
  234    H    HIS  35           H        HIS  35   7.807   4.615   2.564
  235    HA   HIS  35           HA       HIS  35  10.653   4.051   2.087
  236    HB2  HIS  35           1HB      HIS  35   8.353   2.923   0.500
  237    HB3  HIS  35           2HB      HIS  35  10.003   2.317   0.612
  238    HD1  HIS  35           HD1      HIS  35  10.449   1.973   3.536
  239    HD2  HIS  35           HD2      HIS  35   6.810   1.088   1.736
  240    HE1  HIS  35           HE1      HIS  35   9.309   0.352   5.085
  241    H    SER  36           H        SER  36  10.982   6.313   1.529
  242    HA   SER  36           HA       SER  36  10.439   6.770  -1.304
  243    HB2  SER  36           1HB      SER  36   8.738   7.958   0.313
  244    HB3  SER  36           2HB      SER  36  10.070   9.086   0.561
  245    HG   SER  36           HG       SER  36   8.410   8.808  -1.575
  246    H    GLY  37           H        GLY  37  11.897   8.237  -2.311
  247    HA2  GLY  37           1HA      GLY  37  14.536   8.126  -1.233
  248    HA3  GLY  37           2HA      GLY  37  14.051   8.943  -2.712
  249    H    GLU  38           H        GLU  38  15.295   9.396   0.317
  250    HA   GLU  38           HA       GLU  38  14.206  12.104   0.600
  251    HB2  GLU  38           1HB      GLU  38  15.572  10.204   2.467
  252    HB3  GLU  38           2HB      GLU  38  15.630  11.929   2.799
  253    HG2  GLU  38           1HG      GLU  38  12.999  10.663   2.232
  254    HG3  GLU  38           2HG      GLU  38  13.749  10.417   3.809
  255    H    LYS  39           H        LYS  39  15.732  13.841   1.185
  256    HA   LYS  39           HA       LYS  39  18.266  13.537  -0.286
  257    HB2  LYS  39           1HB      LYS  39  16.517  15.160  -1.171
  258    HB3  LYS  39           2HB      LYS  39  16.834  16.135   0.258
  259    HG2  LYS  39           1HG      LYS  39  19.257  16.162  -0.456
  260    HG3  LYS  39           2HG      LYS  39  18.716  15.471  -1.987
  261    HD2  LYS  39           1HD      LYS  39  18.737  17.746  -2.439
  262    HD3  LYS  39           2HD      LYS  39  17.049  17.458  -2.008
  263    HE2  LYS  39           1HE      LYS  39  17.626  19.388  -0.821
  264    HE3  LYS  39           2HE      LYS  39  17.742  18.095   0.371
  265    HZ1  LYS  39           3HZ      LYS  39  20.038  19.234  -1.129
  266    HZ2  LYS  39           1HZ      LYS  39  20.121  18.054   0.081
  267    HZ3  LYS  39           2HZ      LYS  39  19.630  19.627   0.465
  268    HA   PRO  40           HA       PRO  40  19.455  14.169   4.131
  269    HB2  PRO  40           1HB      PRO  40  21.555  12.451   4.037
  270    HB3  PRO  40           2HB      PRO  40  19.899  11.927   4.366
  271    HG2  PRO  40           1HG      PRO  40  21.443  11.830   1.803
  272    HG3  PRO  40           2HG      PRO  40  20.385  10.600   2.519
  273    HD2  PRO  40           1HD      PRO  40  19.573  12.235   0.519
  274    HD3  PRO  40           2HD      PRO  40  18.466  11.635   1.770
  275    H    SER  41           H        SER  41  21.038  14.453   1.073
  276    HA   SER  41           HA       SER  41  22.616  16.664   2.025
  277    HB2  SER  41           1HB      SER  41  24.788  15.795   1.501
  278    HB3  SER  41           2HB      SER  41  24.006  14.624   2.564
  279    HG   SER  41           HG       SER  41  23.317  13.764   0.294
  280    H    GLY  42           H        GLY  42  23.328  18.013   0.370
  281    HA2  GLY  42           1HA      GLY  42  23.672  17.593  -2.278
  282    HA3  GLY  42           2HA      GLY  42  21.922  17.673  -2.134
  283    HA   PRO  43           HA       PRO  43  23.398  21.973  -2.876
  284    HB2  PRO  43           1HB      PRO  43  21.355  22.617  -4.544
  285    HB3  PRO  43           2HB      PRO  43  22.829  21.813  -5.096
  286    HG2  PRO  43           1HG      PRO  43  20.152  20.633  -4.461
  287    HG3  PRO  43           2HG      PRO  43  21.237  20.281  -5.819
  288    HD2  PRO  43           1HD      PRO  43  21.070  18.687  -3.637
  289    HD3  PRO  43           2HD      PRO  43  22.575  18.895  -4.555
  290    H    SER  44           H        SER  44  22.244  24.027  -2.489
  291    HA   SER  44           HA       SER  44  20.531  23.788  -0.185
  292    HB2  SER  44           1HB      SER  44  22.348  25.502  -0.371
  293    HB3  SER  44           2HB      SER  44  21.402  26.303  -1.625
  294    HG   SER  44           HG       SER  44  19.797  26.706  -0.121
  295    H    SER  45           H        SER  45  19.176  22.667  -2.225
  296    HA   SER  45           HA       SER  45  16.902  24.461  -2.494
  297    HB2  SER  45           1HB      SER  45  18.555  23.491  -4.776
  298    HB3  SER  45           2HB      SER  45  16.806  23.529  -4.993
  299    HG   SER  45           HG       SER  45  17.775  25.498  -5.618
  300    H    GLY  46           H        GLY  46  15.379  23.286  -1.521
  301    HA2  GLY  46           1HA      GLY  46  14.620  20.741  -2.653
  302    HA3  GLY  46           2HA      GLY  46  15.248  20.626  -1.016
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1  14.725 -24.847   5.830
    2    HA2  GLY   1           1HA      GLY   1  13.511 -22.960   5.340
    3    HA3  GLY   1           2HA      GLY   1  14.952 -22.346   4.544
    4    H    SER   2           H        SER   2  12.623 -24.977   3.922
    5    HA   SER   2           HA       SER   2  12.530 -24.095   1.118
    6    HB2  SER   2           1HB      SER   2  11.876 -26.327   0.530
    7    HB3  SER   2           2HB      SER   2  13.249 -26.461   1.629
    8    HG   SER   2           HG       SER   2  11.849 -27.839   2.501
    9    H    SER   3           H        SER   3  10.451 -24.237   0.008
   10    HA   SER   3           HA       SER   3   8.361 -23.074   1.617
   11    HB2  SER   3           1HB      SER   3   7.261 -22.582  -0.435
   12    HB3  SER   3           2HB      SER   3   8.981 -22.346  -0.744
   13    HG   SER   3           HG       SER   3   9.044 -24.297  -1.808
   14    H    GLY   4           H        GLY   4   8.797 -25.616   2.521
   15    HA2  GLY   4           1HA      GLY   4   7.171 -27.600   1.326
   16    HA3  GLY   4           2HA      GLY   4   7.752 -27.608   2.984
   17    H    SER   5           H        SER   5   6.539 -25.270   3.921
   18    HA   SER   5           HA       SER   5   3.777 -26.203   4.103
   19    HB2  SER   5           1HB      SER   5   3.616 -24.743   6.065
   20    HB3  SER   5           2HB      SER   5   5.021 -25.800   6.197
   21    HG   SER   5           HG       SER   5   6.288 -24.118   6.124
   22    H    SER   6           H        SER   6   2.869 -25.458   2.198
   23    HA   SER   6           HA       SER   6   2.851 -22.542   1.804
   24    HB2  SER   6           1HB      SER   6   2.273 -24.786  -0.142
   25    HB3  SER   6           2HB      SER   6   2.093 -23.073  -0.517
   26    HG   SER   6           HG       SER   6   4.119 -23.224  -1.059
   27    H    GLY   7           H        GLY   7   1.195 -21.891   3.116
   28    HA2  GLY   7           1HA      GLY   7  -1.398 -23.239   2.855
   29    HA3  GLY   7           2HA      GLY   7  -0.954 -22.096   4.114
   30    H    THR   8           H        THR   8  -2.550 -20.615   3.905
   31    HA   THR   8           HA       THR   8  -2.767 -19.266   1.292
   32    HB   THR   8           HB       THR   8  -4.970 -19.514   3.348
   33    HG1  THR   8           HG1      THR   8  -5.065 -20.751   0.825
   34   HG21  THR   8          3HG2      THR   8  -6.216 -18.881   1.068
   35   HG22  THR   8          1HG2      THR   8  -4.670 -18.088   0.765
   36   HG23  THR   8          2HG2      THR   8  -5.616 -17.662   2.192
   37    H    GLY   9           H        GLY   9  -2.721 -17.054   1.252
   38    HA2  GLY   9           1HA      GLY   9  -3.016 -15.446   3.597
   39    HA3  GLY   9           2HA      GLY   9  -1.325 -15.643   3.158
   40    H    GLU  10           H        GLU  10  -4.430 -14.372   2.130
   41    HA   GLU  10           HA       GLU  10  -3.006 -12.669   0.191
   42    HB2  GLU  10           1HB      GLU  10  -5.665 -14.044  -0.009
   43    HB3  GLU  10           2HB      GLU  10  -5.359 -12.573  -0.921
   44    HG2  GLU  10           1HG      GLU  10  -4.856 -14.289  -2.406
   45    HG3  GLU  10           2HG      GLU  10  -3.285 -13.757  -1.809
   46    H    LYS  11           H        LYS  11  -4.488 -10.691  -0.371
   47    HA   LYS  11           HA       LYS  11  -6.237  -9.661   1.580
   48    HB2  LYS  11           1HB      LYS  11  -4.596  -7.794   2.324
   49    HB3  LYS  11           2HB      LYS  11  -4.517  -9.362   3.116
   50    HG2  LYS  11           1HG      LYS  11  -2.734  -9.824   1.216
   51    HG3  LYS  11           2HG      LYS  11  -2.592  -8.065   1.272
   52    HD2  LYS  11           1HD      LYS  11  -1.733  -8.065   3.391
   53    HD3  LYS  11           2HD      LYS  11  -2.579  -9.545   3.850
   54    HE2  LYS  11           1HE      LYS  11  -0.458 -10.364   3.703
   55    HE3  LYS  11           2HE      LYS  11  -0.966 -10.593   2.030
   56    HZ1  LYS  11           3HZ      LYS  11   1.279  -9.397   2.637
   57    HZ2  LYS  11           1HZ      LYS  11   0.272  -8.041   2.742
   58    HZ3  LYS  11           2HZ      LYS  11   0.361  -8.918   1.299
   59    HA   PRO  12           HA       PRO  12  -7.040  -6.819  -1.666
   60    HB2  PRO  12           1HB      PRO  12  -8.013  -4.688  -0.294
   61    HB3  PRO  12           2HB      PRO  12  -8.919  -6.192  -0.501
   62    HG2  PRO  12           1HG      PRO  12  -7.311  -5.257   1.845
   63    HG3  PRO  12           2HG      PRO  12  -8.898  -6.048   1.820
   64    HD2  PRO  12           1HD      PRO  12  -6.611  -7.388   2.370
   65    HD3  PRO  12           2HD      PRO  12  -7.987  -8.147   1.544
   66    H    TYR  13           H        TYR  13  -4.974  -5.819   0.967
   67    HA   TYR  13           HA       TYR  13  -3.525  -4.070  -0.887
   68    HB2  TYR  13           1HB      TYR  13  -3.903  -3.206   1.961
   69    HB3  TYR  13           2HB      TYR  13  -3.465  -2.239   0.557
   70    HD1  TYR  13           HD2      TYR  13  -5.186  -1.504  -1.031
   71    HD2  TYR  13           HD1      TYR  13  -6.207  -3.678   2.481
   72    HE1  TYR  13           HE2      TYR  13  -7.535  -0.828  -1.303
   73    HE2  TYR  13           HE1      TYR  13  -8.560  -3.009   2.218
   74    HH   TYR  13           HH       TYR  13  -9.774  -1.641  -0.620
   75    H    GLU  14           H        GLU  14  -1.309  -3.686  -0.286
   76    HA   GLU  14           HA       GLU  14  -0.058  -4.887   1.930
   77    HB2  GLU  14           1HB      GLU  14  -0.532  -7.012   0.972
   78    HB3  GLU  14           2HB      GLU  14  -0.049  -6.475  -0.631
   79    HG2  GLU  14           1HG      GLU  14   2.275  -6.136   0.425
   80    HG3  GLU  14           2HG      GLU  14   1.665  -7.169   1.717
   81    H    CYS  15           H        CYS  15   2.150  -4.430   2.029
   82    HA   CYS  15           HA       CYS  15   3.013  -2.357   0.194
   83    HB2  CYS  15           1HB      CYS  15   3.284  -2.494   2.825
   84    HB3  CYS  15           2HB      CYS  15   4.753  -3.367   2.402
   85    H    ASP  16           H        ASP  16   4.241  -2.719  -1.521
   86    HA   ASP  16           HA       ASP  16   5.400  -5.321  -1.974
   87    HB2  ASP  16           1HB      ASP  16   4.290  -3.656  -3.686
   88    HB3  ASP  16           2HB      ASP  16   5.916  -2.984  -3.770
   89    H    VAL  17           H        VAL  17   6.418  -3.189   0.049
   90    HA   VAL  17           HA       VAL  17   9.245  -3.308  -0.783
   91    HB   VAL  17           HB       VAL  17   7.923  -1.281   1.028
   92   HG11  VAL  17          1HG1      VAL  17  10.752  -1.226   0.013
   93   HG12  VAL  17          2HG1      VAL  17  10.020  -0.238   1.279
   94   HG13  VAL  17          3HG1      VAL  17  10.316  -1.955   1.557
   95   HG21  VAL  17          3HG2      VAL  17   8.068   0.269  -0.699
   96   HG22  VAL  17          1HG2      VAL  17   9.246  -0.691  -1.594
   97   HG23  VAL  17          2HG2      VAL  17   7.559  -1.201  -1.530
   98    H    CYS  18           H        CYS  18   6.988  -3.604   1.916
   99    HA   CYS  18           HA       CYS  18   9.067  -5.081   3.395
  100    HB2  CYS  18           1HB      CYS  18   7.891  -4.355   5.477
  101    HB3  CYS  18           2HB      CYS  18   8.610  -3.028   4.570
  102    H    ARG  19           H        ARG  19   6.203  -5.341   1.759
  103    HA   ARG  19           HA       ARG  19   4.644  -6.983   1.546
  104    HB2  ARG  19           1HB      ARG  19   6.852  -8.384   2.995
  105    HB3  ARG  19           2HB      ARG  19   5.304  -9.199   2.818
  106    HG2  ARG  19           1HG      ARG  19   6.840  -9.841   1.052
  107    HG3  ARG  19           2HG      ARG  19   5.453  -8.972   0.395
  108    HD2  ARG  19           1HD      ARG  19   6.696  -7.144  -0.181
  109    HD3  ARG  19           2HD      ARG  19   7.865  -7.398   1.113
  110    HE   ARG  19           HE       ARG  19   8.384  -9.475  -0.478
  111   HH11  ARG  19          1HH1      ARG  19   7.917  -6.101  -1.198
  112   HH12  ARG  19          2HH1      ARG  19   8.965  -6.116  -2.577
  113   HH21  ARG  19          1HH2      ARG  19   9.766  -9.508  -2.292
  114   HH22  ARG  19          2HH2      ARG  19  10.016  -8.054  -3.199
  115    H    LYS  20           H        LYS  20   4.119  -5.058   3.449
  116    HA   LYS  20           HA       LYS  20   3.161  -6.425   5.837
  117    HB2  LYS  20           1HB      LYS  20   3.557  -3.591   5.021
  118    HB3  LYS  20           2HB      LYS  20   2.300  -3.921   6.205
  119    HG2  LYS  20           1HG      LYS  20   4.073  -5.185   7.512
  120    HG3  LYS  20           2HG      LYS  20   5.247  -4.438   6.426
  121    HD2  LYS  20           1HD      LYS  20   3.985  -2.234   7.098
  122    HD3  LYS  20           2HD      LYS  20   3.511  -3.187   8.505
  123    HE2  LYS  20           1HE      LYS  20   6.368  -2.907   7.602
  124    HE3  LYS  20           2HE      LYS  20   5.614  -1.796   8.744
  125    HZ1  LYS  20           3HZ      LYS  20   6.369  -3.254  10.249
  126    HZ2  LYS  20           1HZ      LYS  20   6.511  -4.519   9.135
  127    HZ3  LYS  20           2HZ      LYS  20   5.009  -4.166   9.826
  128    H    ALA  21           H        ALA  21   0.891  -5.408   6.564
  129    HA   ALA  21           HA       ALA  21  -0.969  -5.538   4.294
  130    HB1  ALA  21           3HB      ALA  21  -0.924  -7.769   5.218
  131    HB2  ALA  21           1HB      ALA  21  -1.212  -7.137   6.840
  132    HB3  ALA  21           2HB      ALA  21  -2.464  -7.002   5.605
  133    H    PHE  22           H        PHE  22  -2.910  -4.421   4.566
  134    HA   PHE  22           HA       PHE  22  -3.279  -2.924   7.052
  135    HB2  PHE  22           1HB      PHE  22  -3.172  -1.647   4.311
  136    HB3  PHE  22           2HB      PHE  22  -3.652  -0.826   5.792
  137    HD1  PHE  22           HD1      PHE  22  -0.813  -2.787   4.384
  138    HD2  PHE  22           HD2      PHE  22  -2.067   0.354   6.968
  139    HE1  PHE  22           HE1      PHE  22   1.539  -2.210   4.819
  140    HE2  PHE  22           HE2      PHE  22   0.283   0.937   7.406
  141    HZ   PHE  22           HZ       PHE  22   2.090  -0.345   6.330
  142    H    SER  23           H        SER  23  -5.414  -1.639   6.912
  143    HA   SER  23           HA       SER  23  -7.429  -3.433   5.742
  144    HB2  SER  23           1HB      SER  23  -7.595  -3.263   8.156
  145    HB3  SER  23           2HB      SER  23  -7.623  -1.502   8.066
  146    HG   SER  23           HG       SER  23  -9.720  -2.049   8.207
  147    H    HIS  24           H        HIS  24  -6.637  -0.012   6.221
  148    HA   HIS  24           HA       HIS  24  -8.706   0.753   4.301
  149    HB2  HIS  24           1HB      HIS  24  -8.123   1.929   6.603
  150    HB3  HIS  24           2HB      HIS  24  -6.921   2.755   5.616
  151    HD1  HIS  24           HD1      HIS  24  -9.029   4.499   6.780
  152    HD2  HIS  24           HD2      HIS  24  -9.535   2.558   3.142
  153    HE1  HIS  24           HE1      HIS  24 -10.792   5.811   5.558
  154    H    HIS  25           H        HIS  25  -8.226   1.002   2.230
  155    HA   HIS  25           HA       HIS  25  -5.904   0.545   0.952
  156    HB2  HIS  25           1HB      HIS  25  -8.013   0.974  -0.221
  157    HB3  HIS  25           2HB      HIS  25  -7.903   2.684   0.186
  158    HD1  HIS  25           HD1      HIS  25  -5.920   0.090  -1.762
  159    HD2  HIS  25           HD2      HIS  25  -6.664   4.177  -1.706
  160    HE1  HIS  25           HE1      HIS  25  -4.762   1.012  -3.795
  161    H    ALA  26           H        ALA  26  -6.942   3.819   1.918
  162    HA   ALA  26           HA       ALA  26  -4.704   5.231   1.152
  163    HB1  ALA  26           3HB      ALA  26  -5.973   6.856   1.967
  164    HB2  ALA  26           1HB      ALA  26  -6.971   5.686   2.831
  165    HB3  ALA  26           2HB      ALA  26  -5.530   6.355   3.599
  166    H    SER  27           H        SER  27  -5.300   3.787   4.358
  167    HA   SER  27           HA       SER  27  -3.091   4.442   5.743
  168    HB2  SER  27           1HB      SER  27  -4.288   1.666   5.573
  169    HB3  SER  27           2HB      SER  27  -3.201   2.219   6.847
  170    HG   SER  27           HG       SER  27  -5.096   2.671   7.724
  171    H    LEU  28           H        LEU  28  -3.192   2.359   2.959
  172    HA   LEU  28           HA       LEU  28  -0.524   1.338   3.307
  173    HB2  LEU  28           1HB      LEU  28  -2.229   0.034   2.151
  174    HB3  LEU  28           2HB      LEU  28  -2.366   1.288   0.920
  175    HG   LEU  28           HG       LEU  28   0.036   0.818   0.328
  176   HD11  LEU  28          1HD1      LEU  28   0.264  -1.822   1.173
  177   HD12  LEU  28          2HD1      LEU  28  -0.242  -0.930   2.607
  178   HD13  LEU  28          3HD1      LEU  28   1.209  -0.441   1.731
  179   HD21  LEU  28          3HD2      LEU  28  -2.243  -0.279  -0.594
  180   HD22  LEU  28          1HD2      LEU  28  -1.381  -1.733  -0.090
  181   HD23  LEU  28          2HD2      LEU  28  -0.647  -0.634  -1.258
  182    H    THR  29           H        THR  29  -2.040   3.513   0.919
  183    HA   THR  29           HA       THR  29   0.292   4.295  -0.385
  184    HB   THR  29           HB       THR  29  -2.139   4.778  -1.047
  185    HG1  THR  29           HG1      THR  29  -1.193   6.001  -2.488
  186   HG21  THR  29          3HG2      THR  29  -2.013   6.352   1.281
  187   HG22  THR  29          1HG2      THR  29  -3.333   6.257   0.117
  188   HG23  THR  29          2HG2      THR  29  -2.076   7.479  -0.074
  189    H    GLN  30           H        GLN  30  -0.856   5.120   2.738
  190    HA   GLN  30           HA       GLN  30   0.773   7.524   2.923
  191    HB2  GLN  30           1HB      GLN  30  -1.307   6.228   4.606
  192    HB3  GLN  30           2HB      GLN  30  -0.108   7.218   5.427
  193    HG2  GLN  30           1HG      GLN  30  -0.781   9.158   4.346
  194    HG3  GLN  30           2HG      GLN  30  -1.594   8.271   3.057
  195   HE21  GLN  30          1HE2      GLN  30  -3.458   9.533   3.416
  196   HE22  GLN  30          2HE2      GLN  30  -4.510   9.213   4.749
  197    H    HIS  31           H        HIS  31   0.744   4.203   4.065
  198    HA   HIS  31           HA       HIS  31   2.879   4.457   5.910
  199    HB2  HIS  31           1HB      HIS  31   1.626   2.539   6.264
  200    HB3  HIS  31           2HB      HIS  31   1.519   2.166   4.546
  201    HD1  HIS  31           HD1      HIS  31   3.789   1.801   7.507
  202    HD2  HIS  31           HD2      HIS  31   3.593   0.612   3.531
  203    HE1  HIS  31           HE1      HIS  31   5.592   0.069   7.233
  204    H    GLN  32           H        GLN  32   2.766   3.256   2.560
  205    HA   GLN  32           HA       GLN  32   5.306   2.486   2.099
  206    HB2  GLN  32           1HB      GLN  32   3.571   4.202   0.322
  207    HB3  GLN  32           2HB      GLN  32   5.065   3.446  -0.218
  208    HG2  GLN  32           1HG      GLN  32   3.893   1.275   0.710
  209    HG3  GLN  32           2HG      GLN  32   2.436   2.224   0.416
  210   HE21  GLN  32          1HE2      GLN  32   2.968  -0.129  -0.933
  211   HE22  GLN  32          2HE2      GLN  32   3.257   0.226  -2.598
  212    H    ARG  33           H        ARG  33   4.210   5.802   2.486
  213    HA   ARG  33           HA       ARG  33   6.202   7.354   1.582
  214    HB2  ARG  33           1HB      ARG  33   5.032   7.582   4.362
  215    HB3  ARG  33           2HB      ARG  33   5.827   8.872   3.469
  216    HG2  ARG  33           1HG      ARG  33   3.326   7.483   2.539
  217    HG3  ARG  33           2HG      ARG  33   3.340   8.982   3.470
  218    HD2  ARG  33           1HD      ARG  33   5.010   9.714   1.542
  219    HD3  ARG  33           2HD      ARG  33   4.122   8.481   0.648
  220    HE   ARG  33           HE       ARG  33   2.127   9.925   1.672
  221   HH11  ARG  33          1HH1      ARG  33   5.052  10.890   0.050
  222   HH12  ARG  33          2HH1      ARG  33   4.359  12.328  -0.624
  223   HH21  ARG  33          1HH2      ARG  33   1.203  11.815   0.791
  224   HH22  ARG  33          2HH2      ARG  33   2.170  12.854  -0.201
  225    H    VAL  34           H        VAL  34   6.333   5.714   4.746
  226    HA   VAL  34           HA       VAL  34   8.718   6.431   5.738
  227    HB   VAL  34           HB       VAL  34   8.977   4.252   6.744
  228   HG11  VAL  34          1HG1      VAL  34   6.860   4.043   7.833
  229   HG12  VAL  34          2HG1      VAL  34   7.119   5.754   7.485
  230   HG13  VAL  34          3HG1      VAL  34   6.026   4.802   6.478
  231   HG21  VAL  34          3HG2      VAL  34   8.731   2.702   5.022
  232   HG22  VAL  34          1HG2      VAL  34   7.294   2.443   6.011
  233   HG23  VAL  34          2HG2      VAL  34   7.179   3.367   4.514
  234    H    HIS  35           H        HIS  35   8.280   4.080   3.120
  235    HA   HIS  35           HA       HIS  35  11.125   3.708   2.801
  236    HB2  HIS  35           1HB      HIS  35   9.026   2.820   0.835
  237    HB3  HIS  35           2HB      HIS  35  10.594   2.092   1.170
  238    HD1  HIS  35           HD1      HIS  35  10.658   1.334   3.946
  239    HD2  HIS  35           HD2      HIS  35   7.071   1.278   1.851
  240    HE1  HIS  35           HE1      HIS  35   9.153  -0.217   5.232
  241    H    SER  36           H        SER  36  12.421   4.943   1.622
  242    HA   SER  36           HA       SER  36  11.225   6.625  -0.483
  243    HB2  SER  36           1HB      SER  36  12.031   7.858   1.583
  244    HB3  SER  36           2HB      SER  36  13.665   7.360   1.142
  245    HG   SER  36           HG       SER  36  13.080   8.366  -0.987
  246    H    GLY  37           H        GLY  37  14.329   5.237   0.602
  247    HA2  GLY  37           1HA      GLY  37  14.857   3.879  -1.793
  248    HA3  GLY  37           2HA      GLY  37  15.632   5.454  -1.884
  249    H    GLU  38           H        GLU  38  16.083   5.479   1.052
  250    HA   GLU  38           HA       GLU  38  17.770   4.980   2.494
  251    HB2  GLU  38           1HB      GLU  38  17.100   2.328   1.293
  252    HB3  GLU  38           2HB      GLU  38  18.524   2.454   2.316
  253    HG2  GLU  38           1HG      GLU  38  16.974   3.524   4.038
  254    HG3  GLU  38           2HG      GLU  38  15.654   2.917   3.041
  255    H    LYS  39           H        LYS  39  18.543   6.210   0.120
  256    HA   LYS  39           HA       LYS  39  20.487   5.183  -1.454
  257    HB2  LYS  39           1HB      LYS  39  19.635   7.572  -1.388
  258    HB3  LYS  39           2HB      LYS  39  20.804   7.865  -0.107
  259    HG2  LYS  39           1HG      LYS  39  21.825   8.611  -2.082
  260    HG3  LYS  39           2HG      LYS  39  22.574   7.053  -1.725
  261    HD2  LYS  39           1HD      LYS  39  22.137   6.816  -3.968
  262    HD3  LYS  39           2HD      LYS  39  20.664   6.135  -3.274
  263    HE2  LYS  39           1HE      LYS  39  19.889   7.569  -4.944
  264    HE3  LYS  39           2HE      LYS  39  19.712   8.508  -3.462
  265    HZ1  LYS  39           3HZ      LYS  39  22.263   8.999  -4.459
  266    HZ2  LYS  39           1HZ      LYS  39  20.957  10.071  -4.378
  267    HZ3  LYS  39           2HZ      LYS  39  21.197   9.134  -5.765
  268    HA   PRO  40           HA       PRO  40  23.712   3.750   1.200
  269    HB2  PRO  40           1HB      PRO  40  25.663   3.518  -0.674
  270    HB3  PRO  40           2HB      PRO  40  24.317   2.379  -0.542
  271    HG2  PRO  40           1HG      PRO  40  24.665   4.691  -2.412
  272    HG3  PRO  40           2HG      PRO  40  24.056   3.060  -2.750
  273    HD2  PRO  40           1HD      PRO  40  22.415   5.187  -2.413
  274    HD3  PRO  40           2HD      PRO  40  21.954   3.540  -1.936
  275    H    SER  41           H        SER  41  23.825   5.816   2.343
  276    HA   SER  41           HA       SER  41  25.236   8.056   1.510
  277    HB2  SER  41           1HB      SER  41  24.573   6.896   4.187
  278    HB3  SER  41           2HB      SER  41  25.700   8.250   4.103
  279    HG   SER  41           HG       SER  41  23.935   9.202   2.703
  280    H    GLY  42           H        GLY  42  27.339   8.819   2.573
  281    HA2  GLY  42           1HA      GLY  42  29.326   7.032   3.405
  282    HA3  GLY  42           2HA      GLY  42  29.445   7.181   1.658
  283    HA   PRO  43           HA       PRO  43  31.887  10.789   2.112
  284    HB2  PRO  43           1HB      PRO  43  31.171  12.208  -0.089
  285    HB3  PRO  43           2HB      PRO  43  32.167  10.750  -0.168
  286    HG2  PRO  43           1HG      PRO  43  29.233  11.068  -0.666
  287    HG3  PRO  43           2HG      PRO  43  30.427  10.129  -1.580
  288    HD2  PRO  43           1HD      PRO  43  28.736   8.993   0.204
  289    HD3  PRO  43           2HD      PRO  43  30.373   8.373  -0.088
  290    H    SER  44           H        SER  44  31.749  12.620   3.261
  291    HA   SER  44           HA       SER  44  29.171  13.647   4.002
  292    HB2  SER  44           1HB      SER  44  30.355  15.044   5.551
  293    HB3  SER  44           2HB      SER  44  31.153  13.472   5.558
  294    HG   SER  44           HG       SER  44  32.840  14.303   4.472
  295    H    SER  45           H        SER  45  28.708  16.007   3.951
  296    HA   SER  45           HA       SER  45  28.292  17.916   2.787
  297    HB2  SER  45           1HB      SER  45  31.154  17.365   2.092
  298    HB3  SER  45           2HB      SER  45  30.300  18.668   1.265
  299    HG   SER  45           HG       SER  45  30.728  18.376   4.052
  300    H    GLY  46           H        GLY  46  27.159  15.663   1.730
  301    HA2  GLY  46           1HA      GLY  46  27.658  15.728  -1.156
  302    HA3  GLY  46           2HA      GLY  46  26.673  14.550  -0.302
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1  -1.919 -30.348   1.569
    2    HA2  GLY   1           1HA      GLY   1  -2.559 -28.661   3.900
    3    HA3  GLY   1           2HA      GLY   1  -0.987 -28.539   3.124
    4    H    SER   2           H        SER   2  -0.852 -27.684   0.998
    5    HA   SER   2           HA       SER   2  -2.855 -25.661   0.496
    6    HB2  SER   2           1HB      SER   2  -0.257 -26.317  -0.911
    7    HB3  SER   2           2HB      SER   2  -1.295 -24.955  -1.328
    8    HG   SER   2           HG       SER   2   0.359 -24.322   0.100
    9    H    SER   3           H        SER   3  -4.623 -26.107  -0.625
   10    HA   SER   3           HA       SER   3  -4.583 -28.263  -2.600
   11    HB2  SER   3           1HB      SER   3  -6.766 -26.815  -1.129
   12    HB3  SER   3           2HB      SER   3  -7.134 -27.721  -2.596
   13    HG   SER   3           HG       SER   3  -7.375 -29.038  -0.772
   14    H    GLY   4           H        GLY   4  -3.558 -27.321  -4.352
   15    HA2  GLY   4           1HA      GLY   4  -3.813 -26.368  -6.476
   16    HA3  GLY   4           2HA      GLY   4  -5.227 -25.502  -5.894
   17    H    SER   5           H        SER   5  -2.890 -24.559  -7.430
   18    HA   SER   5           HA       SER   5  -1.095 -23.085  -5.908
   19    HB2  SER   5           1HB      SER   5  -1.255 -23.477  -8.497
   20    HB3  SER   5           2HB      SER   5  -2.160 -21.964  -8.477
   21    HG   SER   5           HG       SER   5   0.532 -22.445  -7.906
   22    H    SER   6           H        SER   6  -1.992 -22.051  -4.162
   23    HA   SER   6           HA       SER   6  -4.317 -20.474  -4.212
   24    HB2  SER   6           1HB      SER   6  -3.479 -19.550  -2.059
   25    HB3  SER   6           2HB      SER   6  -3.412 -21.311  -2.116
   26    HG   SER   6           HG       SER   6  -1.174 -21.083  -2.688
   27    H    GLY   7           H        GLY   7  -0.885 -19.552  -4.414
   28    HA2  GLY   7           1HA      GLY   7   0.014 -17.800  -5.670
   29    HA3  GLY   7           2HA      GLY   7  -1.616 -17.229  -5.998
   30    H    THR   8           H        THR   8  -0.192 -15.205  -5.530
   31    HA   THR   8           HA       THR   8  -0.078 -14.648  -2.656
   32    HB   THR   8           HB       THR   8   1.134 -12.568  -3.346
   33    HG1  THR   8           HG1      THR   8   1.978 -12.926  -5.666
   34   HG21  THR   8          3HG2      THR   8   3.137 -13.957  -4.364
   35   HG22  THR   8          1HG2      THR   8   2.117 -15.323  -3.915
   36   HG23  THR   8          2HG2      THR   8   2.639 -14.170  -2.686
   37    H    GLY   9           H        GLY   9  -1.387 -13.207  -1.669
   38    HA2  GLY   9           1HA      GLY   9  -2.597 -10.964  -2.473
   39    HA3  GLY   9           2HA      GLY   9  -3.632 -12.180  -3.206
   40    H    GLU  10           H        GLU  10  -2.014 -11.931  -0.040
   41    HA   GLU  10           HA       GLU  10  -4.130 -13.134   1.372
   42    HB2  GLU  10           1HB      GLU  10  -1.762 -11.480   2.192
   43    HB3  GLU  10           2HB      GLU  10  -2.964 -11.967   3.379
   44    HG2  GLU  10           1HG      GLU  10  -0.965 -13.449   3.225
   45    HG3  GLU  10           2HG      GLU  10  -2.515 -14.265   3.025
   46    H    LYS  11           H        LYS  11  -3.615  -9.897   0.294
   47    HA   LYS  11           HA       LYS  11  -6.248  -9.127   1.155
   48    HB2  LYS  11           1HB      LYS  11  -3.800  -8.064   2.504
   49    HB3  LYS  11           2HB      LYS  11  -5.165  -6.986   2.249
   50    HG2  LYS  11           1HG      LYS  11  -6.593  -8.710   3.406
   51    HG3  LYS  11           2HG      LYS  11  -5.092  -9.526   3.852
   52    HD2  LYS  11           1HD      LYS  11  -5.366  -8.215   5.700
   53    HD3  LYS  11           2HD      LYS  11  -4.453  -7.093   4.688
   54    HE2  LYS  11           1HE      LYS  11  -6.243  -5.828   5.521
   55    HE3  LYS  11           2HE      LYS  11  -6.718  -6.249   3.876
   56    HZ1  LYS  11           3HZ      LYS  11  -8.290  -6.589   5.989
   57    HZ2  LYS  11           1HZ      LYS  11  -7.544  -8.107   5.948
   58    HZ3  LYS  11           2HZ      LYS  11  -8.391  -7.545   4.597
   59    HA   PRO  12           HA       PRO  12  -6.021  -6.525  -2.370
   60    HB2  PRO  12           1HB      PRO  12  -7.565  -4.417  -1.633
   61    HB3  PRO  12           2HB      PRO  12  -8.232  -6.010  -2.011
   62    HG2  PRO  12           1HG      PRO  12  -7.649  -4.787   0.658
   63    HG3  PRO  12           2HG      PRO  12  -9.062  -5.725   0.142
   64    HD2  PRO  12           1HD      PRO  12  -7.045  -6.806   1.588
   65    HD3  PRO  12           2HD      PRO  12  -7.976  -7.741   0.400
   66    H    TYR  13           H        TYR  13  -4.931  -5.348   0.684
   67    HA   TYR  13           HA       TYR  13  -3.332  -3.295  -0.696
   68    HB2  TYR  13           1HB      TYR  13  -4.224  -2.982   2.158
   69    HB3  TYR  13           2HB      TYR  13  -3.637  -1.751   1.046
   70    HD1  TYR  13           HD2      TYR  13  -5.122  -1.083  -0.900
   71    HD2  TYR  13           HD1      TYR  13  -6.524  -3.420   2.367
   72    HE1  TYR  13           HE2      TYR  13  -7.439  -0.502  -1.486
   73    HE2  TYR  13           HE1      TYR  13  -8.845  -2.846   1.789
   74    HH   TYR  13           HH       TYR  13  -9.585  -0.529  -0.758
   75    H    GLU  14           H        GLU  14  -1.282  -3.919  -0.682
   76    HA   GLU  14           HA       GLU  14  -0.054  -4.746   1.820
   77    HB2  GLU  14           1HB      GLU  14  -0.703  -6.881   0.904
   78    HB3  GLU  14           2HB      GLU  14  -0.027  -6.464  -0.664
   79    HG2  GLU  14           1HG      GLU  14   2.205  -6.248   0.603
   80    HG3  GLU  14           2HG      GLU  14   1.392  -7.165   1.871
   81    H    CYS  15           H        CYS  15   2.198  -4.454   1.877
   82    HA   CYS  15           HA       CYS  15   3.167  -2.539  -0.088
   83    HB2  CYS  15           1HB      CYS  15   3.429  -2.102   2.345
   84    HB3  CYS  15           2HB      CYS  15   4.479  -3.510   2.459
   85    H    ASP  16           H        ASP  16   4.588  -2.988  -1.644
   86    HA   ASP  16           HA       ASP  16   5.545  -5.708  -1.926
   87    HB2  ASP  16           1HB      ASP  16   4.608  -4.418  -3.851
   88    HB3  ASP  16           2HB      ASP  16   5.998  -3.341  -3.753
   89    H    VAL  17           H        VAL  17   6.615  -3.860   0.170
   90    HA   VAL  17           HA       VAL  17   9.459  -4.113  -0.552
   91    HB   VAL  17           HB       VAL  17   8.231  -1.870   1.058
   92   HG11  VAL  17          1HG1      VAL  17  10.900  -2.917   0.966
   93   HG12  VAL  17          2HG1      VAL  17  10.874  -1.272   0.328
   94   HG13  VAL  17          3HG1      VAL  17  10.249  -1.602   1.944
   95   HG21  VAL  17          3HG2      VAL  17   9.426  -0.618  -0.962
   96   HG22  VAL  17          1HG2      VAL  17   9.058  -2.138  -1.778
   97   HG23  VAL  17          2HG2      VAL  17   7.759  -1.184  -1.062
   98    H    CYS  18           H        CYS  18   7.172  -3.765   2.151
   99    HA   CYS  18           HA       CYS  18   8.983  -5.416   3.787
  100    HB2  CYS  18           1HB      CYS  18   7.874  -4.396   5.754
  101    HB3  CYS  18           2HB      CYS  18   8.678  -3.203   4.739
  102    H    ARG  19           H        ARG  19   6.100  -5.443   2.107
  103    HA   ARG  19           HA       ARG  19   4.368  -6.911   1.971
  104    HB2  ARG  19           1HB      ARG  19   6.020  -8.639   3.821
  105    HB3  ARG  19           2HB      ARG  19   4.702  -9.171   2.785
  106    HG2  ARG  19           1HG      ARG  19   7.239  -7.946   1.736
  107    HG3  ARG  19           2HG      ARG  19   7.003  -9.682   1.946
  108    HD2  ARG  19           1HD      ARG  19   4.933  -9.423   0.499
  109    HD3  ARG  19           2HD      ARG  19   5.526  -7.808   0.115
  110    HE   ARG  19           HE       ARG  19   7.123  -8.747  -1.238
  111   HH11  ARG  19          1HH1      ARG  19   5.703 -11.216   0.764
  112   HH12  ARG  19          2HH1      ARG  19   6.471 -12.522  -0.077
  113   HH21  ARG  19          1HH2      ARG  19   8.139 -10.458  -2.353
  114   HH22  ARG  19          2HH2      ARG  19   7.856 -12.090  -1.849
  115    H    LYS  20           H        LYS  20   3.932  -4.884   3.693
  116    HA   LYS  20           HA       LYS  20   2.837  -6.067   6.143
  117    HB2  LYS  20           1HB      LYS  20   4.323  -3.928   6.057
  118    HB3  LYS  20           2HB      LYS  20   2.845  -3.127   5.537
  119    HG2  LYS  20           1HG      LYS  20   1.728  -3.780   7.576
  120    HG3  LYS  20           2HG      LYS  20   3.147  -4.697   8.089
  121    HD2  LYS  20           1HD      LYS  20   3.428  -1.795   7.441
  122    HD3  LYS  20           2HD      LYS  20   2.736  -2.274   8.993
  123    HE2  LYS  20           1HE      LYS  20   4.831  -3.834   9.108
  124    HE3  LYS  20           2HE      LYS  20   5.491  -2.708   7.923
  125    HZ1  LYS  20           3HZ      LYS  20   5.685  -2.359  10.551
  126    HZ2  LYS  20           1HZ      LYS  20   4.253  -1.506  10.258
  127    HZ3  LYS  20           2HZ      LYS  20   5.673  -1.080   9.444
  128    H    ALA  21           H        ALA  21   0.722  -6.394   6.387
  129    HA   ALA  21           HA       ALA  21  -1.080  -5.592   4.252
  130    HB1  ALA  21           3HB      ALA  21  -1.436  -7.809   4.834
  131    HB2  ALA  21           1HB      ALA  21  -1.279  -7.486   6.561
  132    HB3  ALA  21           2HB      ALA  21  -2.725  -6.967   5.694
  133    H    PHE  22           H        PHE  22  -2.930  -4.345   4.525
  134    HA   PHE  22           HA       PHE  22  -3.204  -2.934   7.087
  135    HB2  PHE  22           1HB      PHE  22  -3.270  -1.627   4.359
  136    HB3  PHE  22           2HB      PHE  22  -3.572  -0.818   5.893
  137    HD1  PHE  22           HD1      PHE  22  -0.977  -2.702   4.024
  138    HD2  PHE  22           HD2      PHE  22  -1.820   0.128   7.089
  139    HE1  PHE  22           HE1      PHE  22   1.427  -2.220   4.236
  140    HE2  PHE  22           HE2      PHE  22   0.582   0.615   7.305
  141    HZ   PHE  22           HZ       PHE  22   2.209  -0.559   5.877
  142    H    SER  23           H        SER  23  -5.293  -2.210   7.592
  143    HA   SER  23           HA       SER  23  -7.393  -3.848   6.616
  144    HB2  SER  23           1HB      SER  23  -7.170  -2.797   8.944
  145    HB3  SER  23           2HB      SER  23  -7.783  -1.316   8.209
  146    HG   SER  23           HG       SER  23  -9.546  -2.390   8.966
  147    H    HIS  24           H        HIS  24  -6.853  -0.331   6.382
  148    HA   HIS  24           HA       HIS  24  -8.829  -0.206   4.225
  149    HB2  HIS  24           1HB      HIS  24  -8.791   1.401   6.247
  150    HB3  HIS  24           2HB      HIS  24  -7.426   2.165   5.437
  151    HD1  HIS  24           HD1      HIS  24  -8.686   4.344   4.975
  152    HD2  HIS  24           HD2      HIS  24 -10.520   0.985   3.356
  153    HE1  HIS  24           HE1      HIS  24 -10.455   5.227   3.420
  154    H    HIS  25           H        HIS  25  -8.289   1.293   2.383
  155    HA   HIS  25           HA       HIS  25  -5.848   0.415   1.171
  156    HB2  HIS  25           1HB      HIS  25  -6.671   1.308  -0.808
  157    HB3  HIS  25           2HB      HIS  25  -8.155   0.941   0.065
  158    HD1  HIS  25           HD1      HIS  25  -5.968   3.852  -0.909
  159    HD2  HIS  25           HD2      HIS  25  -9.755   3.112   0.632
  160    HE1  HIS  25           HE1      HIS  25  -7.155   6.069  -0.947
  161    H    ALA  26           H        ALA  26  -7.081   3.517   2.363
  162    HA   ALA  26           HA       ALA  26  -5.042   5.199   1.574
  163    HB1  ALA  26           3HB      ALA  26  -7.249   5.362   3.283
  164    HB2  ALA  26           1HB      ALA  26  -5.861   5.860   4.251
  165    HB3  ALA  26           2HB      ALA  26  -6.219   6.684   2.732
  166    H    SER  27           H        SER  27  -5.249   3.386   4.638
  167    HA   SER  27           HA       SER  27  -2.964   4.133   5.888
  168    HB2  SER  27           1HB      SER  27  -4.746   2.244   6.427
  169    HB3  SER  27           2HB      SER  27  -3.493   1.194   5.766
  170    HG   SER  27           HG       SER  27  -3.148   1.395   7.960
  171    H    LEU  28           H        LEU  28  -3.213   2.223   2.993
  172    HA   LEU  28           HA       LEU  28  -0.478   1.333   3.035
  173    HB2  LEU  28           1HB      LEU  28  -2.263   0.040   1.946
  174    HB3  LEU  28           2HB      LEU  28  -2.484   1.347   0.784
  175    HG   LEU  28           HG       LEU  28  -0.111   0.948   0.045
  176   HD11  LEU  28          1HD1      LEU  28   0.831  -0.201   1.880
  177   HD12  LEU  28          2HD1      LEU  28   0.734  -1.373   0.566
  178   HD13  LEU  28          3HD1      LEU  28  -0.449  -1.415   1.874
  179   HD21  LEU  28          3HD2      LEU  28  -1.057  -0.190  -1.608
  180   HD22  LEU  28          1HD2      LEU  28  -2.495  -0.384  -0.604
  181   HD23  LEU  28          2HD2      LEU  28  -1.232  -1.615  -0.582
  182    H    THR  29           H        THR  29  -2.298   3.527   0.888
  183    HA   THR  29           HA       THR  29  -0.169   4.525  -0.563
  184    HB   THR  29           HB       THR  29  -2.727   4.971  -0.804
  185    HG1  THR  29           HG1      THR  29  -2.154   6.958  -1.965
  186   HG21  THR  29          3HG2      THR  29  -2.294   7.660   0.248
  187   HG22  THR  29          1HG2      THR  29  -2.309   6.418   1.499
  188   HG23  THR  29          2HG2      THR  29  -3.688   6.593   0.413
  189    H    GLN  30           H        GLN  30  -0.956   5.065   2.728
  190    HA   GLN  30           HA       GLN  30   0.605   7.513   2.915
  191    HB2  GLN  30           1HB      GLN  30  -1.562   6.977   4.225
  192    HB3  GLN  30           2HB      GLN  30  -0.523   5.997   5.251
  193    HG2  GLN  30           1HG      GLN  30   0.196   8.838   4.698
  194    HG3  GLN  30           2HG      GLN  30  -1.048   8.458   5.889
  195   HE21  GLN  30          1HE2      GLN  30   0.034   9.055   7.694
  196   HE22  GLN  30          2HE2      GLN  30   1.475   8.285   8.257
  197    H    HIS  31           H        HIS  31   0.693   4.231   4.295
  198    HA   HIS  31           HA       HIS  31   3.065   4.415   5.700
  199    HB2  HIS  31           1HB      HIS  31   1.978   2.426   6.102
  200    HB3  HIS  31           2HB      HIS  31   1.587   2.172   4.404
  201    HD1  HIS  31           HD1      HIS  31   4.071   1.337   6.991
  202    HD2  HIS  31           HD2      HIS  31   3.741   1.072   2.858
  203    HE1  HIS  31           HE1      HIS  31   5.892  -0.241   6.271
  204    H    GLN  32           H        GLN  32   2.588   3.564   2.289
  205    HA   GLN  32           HA       GLN  32   4.986   2.790   1.410
  206    HB2  GLN  32           1HB      GLN  32   3.091   4.789   0.216
  207    HB3  GLN  32           2HB      GLN  32   4.581   4.363  -0.615
  208    HG2  GLN  32           1HG      GLN  32   2.240   2.612   0.040
  209    HG3  GLN  32           2HG      GLN  32   2.936   2.981  -1.537
  210   HE21  GLN  32          1HE2      GLN  32   2.408   0.415  -0.157
  211   HE22  GLN  32          2HE2      GLN  32   3.919  -0.421  -0.159
  212    H    ARG  33           H        ARG  33   4.246   5.989   2.609
  213    HA   ARG  33           HA       ARG  33   6.360   7.489   1.713
  214    HB2  ARG  33           1HB      ARG  33   4.809   7.481   4.270
  215    HB3  ARG  33           2HB      ARG  33   6.213   8.530   4.127
  216    HG2  ARG  33           1HG      ARG  33   5.199   9.523   2.093
  217    HG3  ARG  33           2HG      ARG  33   3.758   8.547   2.386
  218    HD2  ARG  33           1HD      ARG  33   3.160  10.514   3.405
  219    HD3  ARG  33           2HD      ARG  33   3.876   9.644   4.762
  220    HE   ARG  33           HE       ARG  33   5.444  11.286   4.880
  221   HH11  ARG  33          1HH1      ARG  33   4.174  11.219   1.639
  222   HH12  ARG  33          2HH1      ARG  33   5.097  12.587   1.110
  223   HH21  ARG  33          1HH2      ARG  33   6.663  13.088   4.196
  224   HH22  ARG  33          2HH2      ARG  33   6.513  13.649   2.565
  225    H    VAL  34           H        VAL  34   6.323   5.509   4.679
  226    HA   VAL  34           HA       VAL  34   8.786   5.881   5.695
  227    HB   VAL  34           HB       VAL  34   8.832   3.489   6.364
  228   HG11  VAL  34          1HG1      VAL  34   6.288   5.058   6.677
  229   HG12  VAL  34          2HG1      VAL  34   6.574   3.539   7.530
  230   HG13  VAL  34          3HG1      VAL  34   7.638   4.919   7.803
  231   HG21  VAL  34          3HG2      VAL  34   7.850   1.971   5.073
  232   HG22  VAL  34          1HG2      VAL  34   6.283   2.644   5.523
  233   HG23  VAL  34          2HG2      VAL  34   7.116   3.234   4.085
  234    H    HIS  35           H        HIS  35   8.065   4.388   2.649
  235    HA   HIS  35           HA       HIS  35  10.885   3.635   2.304
  236    HB2  HIS  35           1HB      HIS  35   8.548   2.866   0.548
  237    HB3  HIS  35           2HB      HIS  35  10.173   2.189   0.515
  238    HD1  HIS  35           HD1      HIS  35  10.806   1.134   3.087
  239    HD2  HIS  35           HD2      HIS  35   6.850   1.212   1.820
  240    HE1  HIS  35           HE1      HIS  35   9.616  -0.578   4.493
  241    H    SER  36           H        SER  36  11.830   4.030   0.142
  242    HA   SER  36           HA       SER  36  10.911   6.619  -0.920
  243    HB2  SER  36           1HB      SER  36  13.110   6.764   0.132
  244    HB3  SER  36           2HB      SER  36  13.701   5.441  -0.873
  245    HG   SER  36           HG       SER  36  12.993   6.935  -2.676
  246    H    GLY  37           H        GLY  37  10.494   6.830  -3.052
  247    HA2  GLY  37           1HA      GLY  37  11.029   4.476  -4.758
  248    HA3  GLY  37           2HA      GLY  37   9.541   5.406  -4.856
  249    H    GLU  38           H        GLU  38  13.068   5.805  -5.131
  250    HA   GLU  38           HA       GLU  38  14.348   7.075  -6.518
  251    HB2  GLU  38           1HB      GLU  38  11.929   6.531  -8.205
  252    HB3  GLU  38           2HB      GLU  38  13.196   7.593  -8.802
  253    HG2  GLU  38           1HG      GLU  38  14.792   5.660  -8.232
  254    HG3  GLU  38           2HG      GLU  38  13.332   4.673  -8.174
  255    H    LYS  39           H        LYS  39  13.053   8.486  -4.530
  256    HA   LYS  39           HA       LYS  39  12.255  10.987  -5.864
  257    HB2  LYS  39           1HB      LYS  39  10.634   9.844  -4.258
  258    HB3  LYS  39           2HB      LYS  39  11.751  10.289  -2.974
  259    HG2  LYS  39           1HG      LYS  39  10.070  11.942  -3.012
  260    HG3  LYS  39           2HG      LYS  39  11.504  12.674  -3.736
  261    HD2  LYS  39           1HD      LYS  39   9.936  13.318  -5.267
  262    HD3  LYS  39           2HD      LYS  39  10.398  11.763  -5.962
  263    HE2  LYS  39           1HE      LYS  39   8.202  11.810  -3.959
  264    HE3  LYS  39           2HE      LYS  39   7.863  12.430  -5.574
  265    HZ1  LYS  39           3HZ      LYS  39   7.323  10.122  -5.512
  266    HZ2  LYS  39           1HZ      LYS  39   8.837   9.715  -4.875
  267    HZ3  LYS  39           2HZ      LYS  39   8.715  10.296  -6.458
  268    HA   PRO  40           HA       PRO  40  16.050  12.766  -4.473
  269    HB2  PRO  40           1HB      PRO  40  15.383  15.376  -4.807
  270    HB3  PRO  40           2HB      PRO  40  15.762  14.301  -6.158
  271    HG2  PRO  40           1HG      PRO  40  13.091  15.151  -5.105
  272    HG3  PRO  40           2HG      PRO  40  13.637  15.008  -6.786
  273    HD2  PRO  40           1HD      PRO  40  12.120  13.116  -5.581
  274    HD3  PRO  40           2HD      PRO  40  13.323  12.725  -6.826
  275    H    SER  41           H        SER  41  13.062  14.345  -3.326
  276    HA   SER  41           HA       SER  41  14.099  15.619  -1.098
  277    HB2  SER  41           1HB      SER  41  11.352  14.394  -1.450
  278    HB3  SER  41           2HB      SER  41  11.788  15.546  -0.188
  279    HG   SER  41           HG       SER  41  10.805  16.523  -2.045
  280    H    GLY  42           H        GLY  42  12.849  12.312  -1.388
  281    HA2  GLY  42           1HA      GLY  42  13.267  11.696   1.381
  282    HA3  GLY  42           2HA      GLY  42  12.880  10.551   0.105
  283    HA   PRO  43           HA       PRO  43  17.266   9.858   1.508
  284    HB2  PRO  43           1HB      PRO  43  16.988   7.183   1.884
  285    HB3  PRO  43           2HB      PRO  43  16.624   8.373   3.139
  286    HG2  PRO  43           1HG      PRO  43  14.758   6.942   1.287
  287    HG3  PRO  43           2HG      PRO  43  14.580   7.270   3.021
  288    HD2  PRO  43           1HD      PRO  43  13.339   8.750   1.124
  289    HD3  PRO  43           2HD      PRO  43  13.882   9.438   2.668
  290    H    SER  44           H        SER  44  18.798   8.138   0.590
  291    HA   SER  44           HA       SER  44  18.095   7.630  -2.228
  292    HB2  SER  44           1HB      SER  44  19.866   9.398  -1.801
  293    HB3  SER  44           2HB      SER  44  20.890   8.103  -1.181
  294    HG   SER  44           HG       SER  44  20.164   7.140  -3.399
  295    H    SER  45           H        SER  45  18.445   5.634  -3.051
  296    HA   SER  45           HA       SER  45  20.056   3.701  -1.601
  297    HB2  SER  45           1HB      SER  45  18.253   2.047  -1.437
  298    HB3  SER  45           2HB      SER  45  17.837   3.506  -0.537
  299    HG   SER  45           HG       SER  45  16.849   4.023  -2.802
  300    H    GLY  46           H        GLY  46  20.948   2.188  -2.914
  301    HA2  GLY  46           1HA      GLY  46  20.733   2.588  -5.743
  302    HA3  GLY  46           2HA      GLY  46  21.724   1.384  -4.934
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1   6.959 -30.232   5.658
    2    HA2  GLY   1           1HA      GLY   1   6.779 -32.800   4.644
    3    HA3  GLY   1           2HA      GLY   1   7.271 -32.983   6.321
    4    H    SER   2           H        SER   2   4.684 -32.359   4.172
    5    HA   SER   2           HA       SER   2   2.429 -32.292   4.489
    6    HB2  SER   2           1HB      SER   2   3.078 -34.027   6.311
    7    HB3  SER   2           2HB      SER   2   2.805 -32.703   7.444
    8    HG   SER   2           HG       SER   2   0.882 -33.417   5.502
    9    H    SER   3           H        SER   3   3.842 -29.911   4.440
   10    HA   SER   3           HA       SER   3   3.379 -28.135   6.537
   11    HB2  SER   3           1HB      SER   3   3.838 -27.824   3.598
   12    HB3  SER   3           2HB      SER   3   3.332 -26.415   4.529
   13    HG   SER   3           HG       SER   3   5.400 -27.952   5.579
   14    H    GLY   4           H        GLY   4   1.372 -28.180   7.447
   15    HA2  GLY   4           1HA      GLY   4  -0.985 -27.919   5.746
   16    HA3  GLY   4           2HA      GLY   4  -0.979 -28.210   7.479
   17    H    SER   5           H        SER   5   0.714 -25.661   5.705
   18    HA   SER   5           HA       SER   5   0.006 -23.638   7.504
   19    HB2  SER   5           1HB      SER   5   0.633 -22.115   5.485
   20    HB3  SER   5           2HB      SER   5   1.876 -23.149   6.190
   21    HG   SER   5           HG       SER   5   0.449 -24.405   4.236
   22    H    SER   6           H        SER   6  -1.433 -24.583   4.410
   23    HA   SER   6           HA       SER   6  -3.275 -23.723   3.303
   24    HB2  SER   6           1HB      SER   6  -5.315 -24.290   4.481
   25    HB3  SER   6           2HB      SER   6  -4.096 -25.511   4.842
   26    HG   SER   6           HG       SER   6  -5.136 -23.487   6.488
   27    H    GLY   7           H        GLY   7  -1.768 -21.569   4.115
   28    HA2  GLY   7           1HA      GLY   7  -2.630 -19.623   5.730
   29    HA3  GLY   7           2HA      GLY   7  -2.127 -19.271   4.083
   30    H    THR   8           H        THR   8  -4.267 -18.185   5.964
   31    HA   THR   8           HA       THR   8  -6.827 -18.771   5.200
   32    HB   THR   8           HB       THR   8  -5.737 -15.994   5.697
   33    HG1  THR   8           HG1      THR   8  -5.487 -17.756   7.357
   34   HG21  THR   8          3HG2      THR   8  -8.550 -16.985   6.123
   35   HG22  THR   8          1HG2      THR   8  -8.035 -16.171   4.647
   36   HG23  THR   8          2HG2      THR   8  -7.961 -15.325   6.193
   37    H    GLY   9           H        GLY   9  -4.870 -16.172   3.719
   38    HA2  GLY   9           1HA      GLY   9  -5.414 -16.857   1.063
   39    HA3  GLY   9           2HA      GLY   9  -6.651 -15.721   1.578
   40    H    GLU  10           H        GLU  10  -6.152 -13.862   0.592
   41    HA   GLU  10           HA       GLU  10  -3.560 -12.661   1.214
   42    HB2  GLU  10           1HB      GLU  10  -4.605 -13.276  -1.509
   43    HB3  GLU  10           2HB      GLU  10  -3.733 -11.766  -1.282
   44    HG2  GLU  10           1HG      GLU  10  -1.787 -12.942  -0.514
   45    HG3  GLU  10           2HG      GLU  10  -2.654 -14.477  -0.549
   46    H    LYS  11           H        LYS  11  -3.547 -10.390   1.203
   47    HA   LYS  11           HA       LYS  11  -6.203  -9.212   1.512
   48    HB2  LYS  11           1HB      LYS  11  -4.773  -7.238   2.380
   49    HB3  LYS  11           2HB      LYS  11  -4.900  -8.685   3.371
   50    HG2  LYS  11           1HG      LYS  11  -2.639  -8.503   1.458
   51    HG3  LYS  11           2HG      LYS  11  -2.587  -7.505   2.913
   52    HD2  LYS  11           1HD      LYS  11  -2.586  -9.357   4.330
   53    HD3  LYS  11           2HD      LYS  11  -3.210 -10.433   3.077
   54    HE2  LYS  11           1HE      LYS  11  -1.024 -11.076   3.059
   55    HE3  LYS  11           2HE      LYS  11  -0.941  -9.761   1.889
   56    HZ1  LYS  11           3HZ      LYS  11   0.813  -9.334   3.315
   57    HZ2  LYS  11           1HZ      LYS  11  -0.047  -9.789   4.699
   58    HZ3  LYS  11           2HZ      LYS  11  -0.402  -8.327   3.927
   59    HA   PRO  12           HA       PRO  12  -6.089  -6.953  -2.253
   60    HB2  PRO  12           1HB      PRO  12  -7.508  -4.747  -1.555
   61    HB3  PRO  12           2HB      PRO  12  -8.253  -6.331  -1.795
   62    HG2  PRO  12           1HG      PRO  12  -7.463  -4.977   0.755
   63    HG3  PRO  12           2HG      PRO  12  -8.938  -5.888   0.382
   64    HD2  PRO  12           1HD      PRO  12  -6.875  -6.961   1.769
   65    HD3  PRO  12           2HD      PRO  12  -7.910  -7.926   0.698
   66    H    TYR  13           H        TYR  13  -4.950  -5.464   0.693
   67    HA   TYR  13           HA       TYR  13  -3.232  -3.695  -0.919
   68    HB2  TYR  13           1HB      TYR  13  -4.094  -2.942   1.854
   69    HB3  TYR  13           2HB      TYR  13  -3.526  -1.907   0.549
   70    HD1  TYR  13           HD2      TYR  13  -5.072  -1.659  -1.501
   71    HD2  TYR  13           HD1      TYR  13  -6.380  -3.181   2.251
   72    HE1  TYR  13           HE2      TYR  13  -7.398  -1.144  -2.110
   73    HE2  TYR  13           HE1      TYR  13  -8.710  -2.671   1.652
   74    HH   TYR  13           HH       TYR  13  -9.798  -0.827  -0.104
   75    H    GLU  14           H        GLU  14  -1.217  -4.414  -0.788
   76    HA   GLU  14           HA       GLU  14  -0.107  -5.038   1.843
   77    HB2  GLU  14           1HB      GLU  14  -0.655  -7.220   1.064
   78    HB3  GLU  14           2HB      GLU  14  -0.040  -6.874  -0.547
   79    HG2  GLU  14           1HG      GLU  14   1.853  -6.691   1.728
   80    HG3  GLU  14           2HG      GLU  14   1.330  -8.293   1.208
   81    H    CYS  15           H        CYS  15   1.612  -3.792   2.104
   82    HA   CYS  15           HA       CYS  15   2.800  -2.135   0.313
   83    HB2  CYS  15           1HB      CYS  15   3.217  -2.501   2.877
   84    HB3  CYS  15           2HB      CYS  15   4.554  -3.502   2.320
   85    H    ASP  16           H        ASP  16   5.053  -2.220  -0.590
   86    HA   ASP  16           HA       ASP  16   5.447  -4.805  -1.935
   87    HB2  ASP  16           1HB      ASP  16   6.298  -2.020  -2.755
   88    HB3  ASP  16           2HB      ASP  16   6.683  -3.489  -3.648
   89    H    VAL  17           H        VAL  17   7.047  -2.295  -0.081
   90    HA   VAL  17           HA       VAL  17   9.656  -3.498  -0.307
   91    HB   VAL  17           HB       VAL  17   8.683  -1.317   1.544
   92   HG11  VAL  17          1HG1      VAL  17  11.500  -2.138   0.845
   93   HG12  VAL  17          2HG1      VAL  17  11.027  -0.812   1.909
   94   HG13  VAL  17          3HG1      VAL  17  10.687  -2.480   2.372
   95   HG21  VAL  17          3HG2      VAL  17  10.446  -0.310  -0.395
   96   HG22  VAL  17          1HG2      VAL  17   9.293  -1.329  -1.258
   97   HG23  VAL  17          2HG2      VAL  17   8.715  -0.004  -0.249
   98    H    CYS  18           H        CYS  18   7.560  -2.842   2.508
   99    HA   CYS  18           HA       CYS  18   8.920  -4.895   4.035
  100    HB2  CYS  18           1HB      CYS  18   7.628  -4.122   5.912
  101    HB3  CYS  18           2HB      CYS  18   8.226  -2.713   5.042
  102    H    ARG  19           H        ARG  19   6.096  -4.591   2.112
  103    HA   ARG  19           HA       ARG  19   4.446  -6.047   1.537
  104    HB2  ARG  19           1HB      ARG  19   6.373  -7.993   2.807
  105    HB3  ARG  19           2HB      ARG  19   4.883  -8.494   2.018
  106    HG2  ARG  19           1HG      ARG  19   6.384  -8.760   0.317
  107    HG3  ARG  19           2HG      ARG  19   5.837  -7.111   0.012
  108    HD2  ARG  19           1HD      ARG  19   8.102  -6.814  -0.112
  109    HD3  ARG  19           2HD      ARG  19   7.841  -6.505   1.604
  110    HE   ARG  19           HE       ARG  19   8.362  -9.122   1.612
  111   HH11  ARG  19          1HH1      ARG  19   9.967  -6.474   0.021
  112   HH12  ARG  19          2HH1      ARG  19  11.529  -7.222   0.068
  113   HH21  ARG  19          1HH2      ARG  19  10.414 -10.117   1.681
  114   HH22  ARG  19          2HH2      ARG  19  11.782  -9.294   1.012
  115    H    LYS  20           H        LYS  20   3.960  -4.565   3.783
  116    HA   LYS  20           HA       LYS  20   2.916  -6.364   5.827
  117    HB2  LYS  20           1HB      LYS  20   4.152  -4.212   6.364
  118    HB3  LYS  20           2HB      LYS  20   2.736  -3.353   5.773
  119    HG2  LYS  20           1HG      LYS  20   1.363  -4.432   7.479
  120    HG3  LYS  20           2HG      LYS  20   2.782  -5.300   8.071
  121    HD2  LYS  20           1HD      LYS  20   3.841  -3.239   8.714
  122    HD3  LYS  20           2HD      LYS  20   2.552  -2.294   7.964
  123    HE2  LYS  20           1HE      LYS  20   1.049  -3.713   9.614
  124    HE3  LYS  20           2HE      LYS  20   2.560  -3.824  10.515
  125    HZ1  LYS  20           3HZ      LYS  20   1.464  -1.237   9.584
  126    HZ2  LYS  20           1HZ      LYS  20   2.659  -1.507  10.751
  127    HZ3  LYS  20           2HZ      LYS  20   1.049  -1.905  11.081
  128    H    ALA  21           H        ALA  21   0.704  -6.188   6.566
  129    HA   ALA  21           HA       ALA  21  -1.132  -5.662   4.335
  130    HB1  ALA  21           3HB      ALA  21  -2.346  -7.434   4.986
  131    HB2  ALA  21           1HB      ALA  21  -0.885  -7.891   5.863
  132    HB3  ALA  21           2HB      ALA  21  -2.187  -7.044   6.699
  133    H    PHE  22           H        PHE  22  -2.943  -4.381   4.572
  134    HA   PHE  22           HA       PHE  22  -3.239  -2.937   7.114
  135    HB2  PHE  22           1HB      PHE  22  -3.264  -1.673   4.365
  136    HB3  PHE  22           2HB      PHE  22  -3.604  -0.838   5.877
  137    HD1  PHE  22           HD1      PHE  22  -0.958  -2.756   4.114
  138    HD2  PHE  22           HD2      PHE  22  -1.885   0.150   7.082
  139    HE1  PHE  22           HE1      PHE  22   1.439  -2.260   4.371
  140    HE2  PHE  22           HE2      PHE  22   0.509   0.652   7.343
  141    HZ   PHE  22           HZ       PHE  22   2.175  -0.552   5.986
  142    H    SER  23           H        SER  23  -5.344  -1.974   7.435
  143    HA   SER  23           HA       SER  23  -7.443  -3.683   6.458
  144    HB2  SER  23           1HB      SER  23  -7.198  -1.558   8.529
  145    HB3  SER  23           2HB      SER  23  -8.806  -1.881   7.883
  146    HG   SER  23           HG       SER  23  -8.735  -3.905   8.669
  147    H    HIS  24           H        HIS  24  -6.642  -0.234   6.208
  148    HA   HIS  24           HA       HIS  24  -8.623   0.001   4.042
  149    HB2  HIS  24           1HB      HIS  24  -8.089   2.562   4.560
  150    HB3  HIS  24           2HB      HIS  24  -9.292   1.656   5.474
  151    HD1  HIS  24           HD1      HIS  24  -6.677   3.920   6.046
  152    HD2  HIS  24           HD2      HIS  24  -7.819   0.358   7.854
  153    HE1  HIS  24           HE1      HIS  24  -5.628   3.959   8.331
  154    H    HIS  25           H        HIS  25  -8.027   0.765   2.057
  155    HA   HIS  25           HA       HIS  25  -5.515   0.288   1.062
  156    HB2  HIS  25           1HB      HIS  25  -7.455   0.612  -0.379
  157    HB3  HIS  25           2HB      HIS  25  -7.533   2.313   0.070
  158    HD1  HIS  25           HD1      HIS  25  -5.475   3.812  -0.770
  159    HD2  HIS  25           HD2      HIS  25  -5.818   0.048  -2.495
  160    HE1  HIS  25           HE1      HIS  25  -4.047   3.888  -2.838
  161    H    ALA  26           H        ALA  26  -6.824   3.451   2.046
  162    HA   ALA  26           HA       ALA  26  -4.734   5.105   1.494
  163    HB1  ALA  26           3HB      ALA  26  -5.469   6.096   3.905
  164    HB2  ALA  26           1HB      ALA  26  -6.363   6.356   2.407
  165    HB3  ALA  26           2HB      ALA  26  -6.860   5.082   3.522
  166    H    SER  27           H        SER  27  -5.131   3.409   4.613
  167    HA   SER  27           HA       SER  27  -2.896   4.083   5.940
  168    HB2  SER  27           1HB      SER  27  -4.722   2.219   6.403
  169    HB3  SER  27           2HB      SER  27  -3.455   1.149   5.804
  170    HG   SER  27           HG       SER  27  -2.181   2.620   7.440
  171    H    LEU  28           H        LEU  28  -3.013   2.211   3.023
  172    HA   LEU  28           HA       LEU  28  -0.282   1.295   3.218
  173    HB2  LEU  28           1HB      LEU  28  -2.083   0.016   2.070
  174    HB3  LEU  28           2HB      LEU  28  -2.128   1.273   0.835
  175    HG   LEU  28           HG       LEU  28   0.267   0.729   0.325
  176   HD11  LEU  28          1HD1      LEU  28  -0.072  -1.897   1.653
  177   HD12  LEU  28          2HD1      LEU  28   0.362  -0.522   2.667
  178   HD13  LEU  28          3HD1      LEU  28   1.393  -0.977   1.311
  179   HD21  LEU  28          3HD2      LEU  28  -1.689  -0.127  -0.968
  180   HD22  LEU  28          1HD2      LEU  28  -1.623  -1.596   0.006
  181   HD23  LEU  28          2HD2      LEU  28  -0.264  -1.165  -1.034
  182    H    THR  29           H        THR  29  -2.016   3.432   0.944
  183    HA   THR  29           HA       THR  29   0.167   4.412  -0.434
  184    HB   THR  29           HB       THR  29  -2.350   4.839  -0.839
  185    HG1  THR  29           HG1      THR  29  -0.206   6.610  -1.292
  186   HG21  THR  29          3HG2      THR  29  -1.665   7.135   0.995
  187   HG22  THR  29          1HG2      THR  29  -2.921   5.920   1.230
  188   HG23  THR  29          2HG2      THR  29  -3.070   7.104  -0.069
  189    H    GLN  30           H        GLN  30  -0.981   5.243   2.749
  190    HA   GLN  30           HA       GLN  30   0.609   7.631   2.971
  191    HB2  GLN  30           1HB      GLN  30  -1.213   6.092   4.747
  192    HB3  GLN  30           2HB      GLN  30  -0.010   7.118   5.519
  193    HG2  GLN  30           1HG      GLN  30  -0.867   9.062   4.444
  194    HG3  GLN  30           2HG      GLN  30  -1.930   8.095   3.423
  195   HE21  GLN  30          1HE2      GLN  30  -2.745  10.230   5.086
  196   HE22  GLN  30          2HE2      GLN  30  -3.803   9.589   6.291
  197    H    HIS  31           H        HIS  31   0.701   4.490   4.665
  198    HA   HIS  31           HA       HIS  31   3.120   4.831   5.965
  199    HB2  HIS  31           1HB      HIS  31   2.015   2.948   6.692
  200    HB3  HIS  31           2HB      HIS  31   1.557   2.457   5.064
  201    HD1  HIS  31           HD1      HIS  31   4.514   2.406   7.410
  202    HD2  HIS  31           HD2      HIS  31   3.233   0.633   3.877
  203    HE1  HIS  31           HE1      HIS  31   6.177   0.580   6.932
  204    H    GLN  32           H        GLN  32   2.531   3.400   2.764
  205    HA   GLN  32           HA       GLN  32   4.899   2.495   1.949
  206    HB2  GLN  32           1HB      GLN  32   2.916   4.218   0.514
  207    HB3  GLN  32           2HB      GLN  32   4.411   3.764  -0.294
  208    HG2  GLN  32           1HG      GLN  32   3.843   1.377   0.184
  209    HG3  GLN  32           2HG      GLN  32   2.272   1.933   0.758
  210   HE21  GLN  32          1HE2      GLN  32   2.456   0.149  -1.304
  211   HE22  GLN  32          2HE2      GLN  32   1.962   0.905  -2.776
  212    H    ARG  33           H        ARG  33   4.171   5.876   2.531
  213    HA   ARG  33           HA       ARG  33   6.186   7.239   1.352
  214    HB2  ARG  33           1HB      ARG  33   4.884   7.531   4.026
  215    HB3  ARG  33           2HB      ARG  33   6.258   8.556   3.636
  216    HG2  ARG  33           1HG      ARG  33   4.947   9.106   1.483
  217    HG3  ARG  33           2HG      ARG  33   3.559   8.456   2.358
  218    HD2  ARG  33           1HD      ARG  33   3.388  10.643   2.972
  219    HD3  ARG  33           2HD      ARG  33   4.460  10.072   4.250
  220    HE   ARG  33           HE       ARG  33   6.184  11.296   3.326
  221   HH11  ARG  33          1HH1      ARG  33   3.443  11.271   1.178
  222   HH12  ARG  33          2HH1      ARG  33   4.077  12.508   0.144
  223   HH21  ARG  33          1HH2      ARG  33   7.029  12.926   1.971
  224   HH22  ARG  33          2HH2      ARG  33   6.117  13.448   0.596
  225    H    VAL  34           H        VAL  34   6.467   5.498   4.443
  226    HA   VAL  34           HA       VAL  34   8.999   6.039   5.218
  227    HB   VAL  34           HB       VAL  34   9.159   3.819   6.188
  228   HG11  VAL  34          1HG1      VAL  34   6.328   4.856   6.269
  229   HG12  VAL  34          2HG1      VAL  34   7.077   3.792   7.461
  230   HG13  VAL  34          3HG1      VAL  34   7.670   5.440   7.252
  231   HG21  VAL  34          3HG2      VAL  34   8.425   2.524   4.250
  232   HG22  VAL  34          1HG2      VAL  34   7.512   2.083   5.692
  233   HG23  VAL  34          2HG2      VAL  34   6.780   3.119   4.467
  234    H    HIS  35           H        HIS  35   8.071   3.835   2.614
  235    HA   HIS  35           HA       HIS  35  10.849   3.216   2.027
  236    HB2  HIS  35           1HB      HIS  35   8.434   2.386   0.421
  237    HB3  HIS  35           2HB      HIS  35  10.020   1.622   0.465
  238    HD1  HIS  35           HD1      HIS  35  10.602   0.783   3.118
  239    HD2  HIS  35           HD2      HIS  35   6.646   0.986   1.865
  240    HE1  HIS  35           HE1      HIS  35   9.321  -0.703   4.691
  241    H    SER  36           H        SER  36  10.311   5.926   1.781
  242    HA   SER  36           HA       SER  36  10.492   6.302  -1.136
  243    HB2  SER  36           1HB      SER  36   9.274   8.206   0.880
  244    HB3  SER  36           2HB      SER  36   9.457   8.521  -0.845
  245    HG   SER  36           HG       SER  36   7.368   7.760  -0.369
  246    H    GLY  37           H        GLY  37  12.387   7.064  -1.791
  247    HA2  GLY  37           1HA      GLY  37  14.341   8.290  -1.830
  248    HA3  GLY  37           2HA      GLY  37  13.772   9.150  -0.407
  249    H    GLU  38           H        GLU  38  15.490   9.085   0.924
  250    HA   GLU  38           HA       GLU  38  17.159   6.772   1.179
  251    HB2  GLU  38           1HB      GLU  38  18.267   8.050   2.977
  252    HB3  GLU  38           2HB      GLU  38  18.104   8.984   1.496
  253    HG2  GLU  38           1HG      GLU  38  17.548  10.487   3.172
  254    HG3  GLU  38           2HG      GLU  38  15.988   9.950   2.551
  255    H    LYS  39           H        LYS  39  17.437   5.475   3.048
  256    HA   LYS  39           HA       LYS  39  15.100   5.409   4.842
  257    HB2  LYS  39           1HB      LYS  39  15.319   2.947   4.889
  258    HB3  LYS  39           2HB      LYS  39  14.941   3.558   3.284
  259    HG2  LYS  39           1HG      LYS  39  17.796   3.135   3.981
  260    HG3  LYS  39           2HG      LYS  39  16.788   1.719   3.675
  261    HD2  LYS  39           1HD      LYS  39  16.098   2.800   1.516
  262    HD3  LYS  39           2HD      LYS  39  17.325   4.032   1.817
  263    HE2  LYS  39           1HE      LYS  39  17.850   1.068   1.616
  264    HE3  LYS  39           2HE      LYS  39  18.111   2.232   0.318
  265    HZ1  LYS  39           3HZ      LYS  39  19.569   1.970   2.872
  266    HZ2  LYS  39           1HZ      LYS  39  19.602   3.415   1.993
  267    HZ3  LYS  39           2HZ      LYS  39  20.187   1.989   1.297
  268    HA   PRO  40           HA       PRO  40  17.987   5.647   8.155
  269    HB2  PRO  40           1HB      PRO  40  16.471   4.566  10.131
  270    HB3  PRO  40           2HB      PRO  40  16.192   6.186   9.484
  271    HG2  PRO  40           1HG      PRO  40  14.783   3.623   8.846
  272    HG3  PRO  40           2HG      PRO  40  14.101   5.237   9.117
  273    HD2  PRO  40           1HD      PRO  40  14.462   4.206   6.640
  274    HD3  PRO  40           2HD      PRO  40  14.596   5.943   6.980
  275    H    SER  41           H        SER  41  17.183   2.849   6.619
  276    HA   SER  41           HA       SER  41  18.146   0.907   8.481
  277    HB2  SER  41           1HB      SER  41  16.578   0.330   6.657
  278    HB3  SER  41           2HB      SER  41  17.836   0.694   5.475
  279    HG   SER  41           HG       SER  41  17.660  -1.439   7.293
  280    H    GLY  42           H        GLY  42  20.111  -0.230   8.440
  281    HA2  GLY  42           1HA      GLY  42  22.407   1.327   7.974
  282    HA3  GLY  42           2HA      GLY  42  22.396  -0.398   8.312
  283    HA   PRO  43           HA       PRO  43  24.078   0.112   4.055
  284    HB2  PRO  43           1HB      PRO  43  25.967  -1.817   4.337
  285    HB3  PRO  43           2HB      PRO  43  26.220  -0.143   4.844
  286    HG2  PRO  43           1HG      PRO  43  25.470  -2.528   6.491
  287    HG3  PRO  43           2HG      PRO  43  26.636  -1.242   6.851
  288    HD2  PRO  43           1HD      PRO  43  24.143  -1.285   7.907
  289    HD3  PRO  43           2HD      PRO  43  24.996   0.226   7.535
  290    H    SER  44           H        SER  44  23.113  -0.917   2.428
  291    HA   SER  44           HA       SER  44  21.357  -3.010   2.642
  292    HB2  SER  44           1HB      SER  44  23.024  -2.114   0.290
  293    HB3  SER  44           2HB      SER  44  21.786  -3.362   0.154
  294    HG   SER  44           HG       SER  44  21.519  -0.651   0.344
  295    H    SER  45           H        SER  45  21.491  -5.225   1.791
  296    HA   SER  45           HA       SER  45  24.131  -6.452   1.830
  297    HB2  SER  45           1HB      SER  45  23.263  -6.418   4.205
  298    HB3  SER  45           2HB      SER  45  21.958  -7.474   3.666
  299    HG   SER  45           HG       SER  45  24.486  -8.109   4.309
  300    H    GLY  46           H        GLY  46  23.932  -8.871   1.371
  301    HA2  GLY  46           1HA      GLY  46  22.131 -10.476   0.486
  302    HA3  GLY  46           2HA      GLY  46  21.865  -9.208  -0.701
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1   2.912 -33.854   5.890
    2    HA2  GLY   1           1HA      GLY   1   2.720 -34.604   3.078
    3    HA3  GLY   1           2HA      GLY   1   1.238 -34.045   3.840
    4    H    SER   2           H        SER   2   0.967 -32.158   2.741
    5    HA   SER   2           HA       SER   2   3.110 -30.316   2.291
    6    HB2  SER   2           1HB      SER   2   0.114 -30.024   1.988
    7    HB3  SER   2           2HB      SER   2   1.282 -28.798   1.496
    8    HG   SER   2           HG       SER   2   2.214 -30.447   0.127
    9    H    SER   3           H        SER   3   3.940 -29.925   4.380
   10    HA   SER   3           HA       SER   3   2.209 -28.262   6.091
   11    HB2  SER   3           1HB      SER   3   3.584 -28.966   7.992
   12    HB3  SER   3           2HB      SER   3   2.916 -30.372   7.164
   13    HG   SER   3           HG       SER   3   5.010 -30.877   7.396
   14    H    GLY   4           H        GLY   4   2.695 -26.280   5.183
   15    HA2  GLY   4           1HA      GLY   4   5.014 -24.974   6.125
   16    HA3  GLY   4           2HA      GLY   4   5.224 -25.369   4.425
   17    H    SER   5           H        SER   5   5.280 -23.180   3.842
   18    HA   SER   5           HA       SER   5   3.729 -21.092   4.483
   19    HB2  SER   5           1HB      SER   5   5.474 -21.072   2.708
   20    HB3  SER   5           2HB      SER   5   4.330 -21.849   1.614
   21    HG   SER   5           HG       SER   5   4.595 -19.364   1.768
   22    H    SER   6           H        SER   6   1.730 -20.211   3.910
   23    HA   SER   6           HA       SER   6  -0.298 -22.209   3.272
   24    HB2  SER   6           1HB      SER   6  -1.910 -20.533   4.057
   25    HB3  SER   6           2HB      SER   6  -0.636 -20.780   5.252
   26    HG   SER   6           HG       SER   6   0.369 -18.890   4.029
   27    H    GLY   7           H        GLY   7   0.759 -18.998   2.172
   28    HA2  GLY   7           1HA      GLY   7   0.471 -19.469  -0.538
   29    HA3  GLY   7           2HA      GLY   7  -1.086 -18.866   0.008
   30    H    THR   8           H        THR   8  -0.241 -17.256  -1.727
   31    HA   THR   8           HA       THR   8   1.159 -15.085  -0.306
   32    HB   THR   8           HB       THR   8   2.620 -15.909  -2.050
   33    HG1  THR   8           HG1      THR   8   1.442 -13.541  -3.082
   34   HG21  THR   8          3HG2      THR   8   0.152 -16.159  -3.517
   35   HG22  THR   8          1HG2      THR   8   1.735 -16.852  -3.867
   36   HG23  THR   8          2HG2      THR   8   1.334 -15.235  -4.444
   37    H    GLY   9           H        GLY   9  -0.895 -14.278   0.381
   38    HA2  GLY   9           1HA      GLY   9  -1.933 -12.134  -0.818
   39    HA3  GLY   9           2HA      GLY   9  -2.775 -13.420  -1.669
   40    H    GLU  10           H        GLU  10  -2.826 -11.388   0.996
   41    HA   GLU  10           HA       GLU  10  -4.973 -12.990   2.219
   42    HB2  GLU  10           1HB      GLU  10  -4.299 -12.231   4.420
   43    HB3  GLU  10           2HB      GLU  10  -2.944 -13.026   3.630
   44    HG2  GLU  10           1HG      GLU  10  -1.890 -10.945   3.168
   45    HG3  GLU  10           2HG      GLU  10  -3.315 -10.044   3.682
   46    H    LYS  11           H        LYS  11  -3.755  -9.875   1.269
   47    HA   LYS  11           HA       LYS  11  -6.446  -8.781   1.433
   48    HB2  LYS  11           1HB      LYS  11  -4.112  -7.771   3.017
   49    HB3  LYS  11           2HB      LYS  11  -5.321  -6.634   2.436
   50    HG2  LYS  11           1HG      LYS  11  -7.000  -7.550   3.751
   51    HG3  LYS  11           2HG      LYS  11  -6.132  -9.072   3.969
   52    HD2  LYS  11           1HD      LYS  11  -4.397  -7.746   5.248
   53    HD3  LYS  11           2HD      LYS  11  -5.535  -6.397   5.219
   54    HE2  LYS  11           1HE      LYS  11  -7.218  -7.894   6.295
   55    HE3  LYS  11           2HE      LYS  11  -5.956  -9.115   6.454
   56    HZ1  LYS  11           3HZ      LYS  11  -4.803  -7.839   7.985
   57    HZ2  LYS  11           1HZ      LYS  11  -6.414  -7.570   8.424
   58    HZ3  LYS  11           2HZ      LYS  11  -5.572  -6.399   7.540
   59    HA   PRO  12           HA       PRO  12  -5.292  -6.894  -2.363
   60    HB2  PRO  12           1HB      PRO  12  -6.964  -4.756  -2.375
   61    HB3  PRO  12           2HB      PRO  12  -7.520  -6.411  -2.647
   62    HG2  PRO  12           1HG      PRO  12  -7.618  -4.768  -0.147
   63    HG3  PRO  12           2HG      PRO  12  -8.860  -5.826  -0.840
   64    HD2  PRO  12           1HD      PRO  12  -7.271  -6.595   1.213
   65    HD3  PRO  12           2HD      PRO  12  -7.879  -7.736  -0.003
   66    H    TYR  13           H        TYR  13  -5.009  -5.204   0.636
   67    HA   TYR  13           HA       TYR  13  -3.368  -3.118  -0.631
   68    HB2  TYR  13           1HB      TYR  13  -4.355  -3.082   2.215
   69    HB3  TYR  13           2HB      TYR  13  -3.787  -1.731   1.240
   70    HD1  TYR  13           HD2      TYR  13  -5.244  -1.650  -1.127
   71    HD2  TYR  13           HD1      TYR  13  -6.604  -2.987   2.676
   72    HE1  TYR  13           HE2      TYR  13  -7.560  -1.146  -1.785
   73    HE2  TYR  13           HE1      TYR  13  -8.924  -2.488   2.029
   74    HH   TYR  13           HH       TYR  13 -10.208  -2.305  -0.219
   75    H    GLU  14           H        GLU  14  -1.497  -4.387  -0.860
   76    HA   GLU  14           HA       GLU  14  -0.128  -4.980   1.682
   77    HB2  GLU  14           1HB      GLU  14  -0.697  -7.061   0.551
   78    HB3  GLU  14           2HB      GLU  14   0.062  -6.491  -0.929
   79    HG2  GLU  14           1HG      GLU  14   2.227  -6.409   0.271
   80    HG3  GLU  14           2HG      GLU  14   1.432  -7.120   1.673
   81    H    CYS  15           H        CYS  15   1.912  -4.226   1.930
   82    HA   CYS  15           HA       CYS  15   2.825  -2.208   0.118
   83    HB2  CYS  15           1HB      CYS  15   3.089  -2.276   2.681
   84    HB3  CYS  15           2HB      CYS  15   4.445  -3.359   2.380
   85    H    ASP  16           H        ASP  16   4.286  -2.347  -1.468
   86    HA   ASP  16           HA       ASP  16   5.375  -4.958  -2.116
   87    HB2  ASP  16           1HB      ASP  16   5.807  -2.413  -3.672
   88    HB3  ASP  16           2HB      ASP  16   5.870  -4.073  -4.258
   89    H    VAL  17           H        VAL  17   6.357  -3.172   0.148
   90    HA   VAL  17           HA       VAL  17   9.199  -3.148  -0.639
   91    HB   VAL  17           HB       VAL  17   7.826  -1.344   1.359
   92   HG11  VAL  17          1HG1      VAL  17   9.896  -1.433   2.285
   93   HG12  VAL  17          2HG1      VAL  17  10.671  -1.922   0.777
   94   HG13  VAL  17          3HG1      VAL  17  10.231  -0.234   1.037
   95   HG21  VAL  17          3HG2      VAL  17   7.530   0.120  -0.288
   96   HG22  VAL  17          1HG2      VAL  17   9.219  -0.017  -0.778
   97   HG23  VAL  17          2HG2      VAL  17   8.019  -1.135  -1.426
   98    H    CYS  18           H        CYS  18   7.071  -3.358   2.216
   99    HA   CYS  18           HA       CYS  18   9.040  -5.169   3.446
  100    HB2  CYS  18           1HB      CYS  18   7.867  -4.587   5.598
  101    HB3  CYS  18           2HB      CYS  18   8.707  -3.244   4.827
  102    H    ARG  19           H        ARG  19   6.153  -5.179   1.833
  103    HA   ARG  19           HA       ARG  19   4.532  -6.739   1.501
  104    HB2  ARG  19           1HB      ARG  19   6.672  -8.350   2.840
  105    HB3  ARG  19           2HB      ARG  19   5.097  -9.077   2.550
  106    HG2  ARG  19           1HG      ARG  19   6.615  -9.628   0.758
  107    HG3  ARG  19           2HG      ARG  19   5.324  -8.585   0.157
  108    HD2  ARG  19           1HD      ARG  19   6.898  -6.644   0.493
  109    HD3  ARG  19           2HD      ARG  19   8.169  -7.830   0.789
  110    HE   ARG  19           HE       ARG  19   6.722  -8.157  -1.695
  111   HH11  ARG  19          1HH1      ARG  19   9.482  -6.773  -0.088
  112   HH12  ARG  19          2HH1      ARG  19  10.410  -6.608  -1.542
  113   HH21  ARG  19          1HH2      ARG  19   7.933  -7.946  -3.616
  114   HH22  ARG  19          2HH2      ARG  19   9.528  -7.275  -3.548
  115    H    LYS  20           H        LYS  20   3.963  -4.972   3.458
  116    HA   LYS  20           HA       LYS  20   3.064  -6.437   5.811
  117    HB2  LYS  20           1HB      LYS  20   3.377  -3.571   5.079
  118    HB3  LYS  20           2HB      LYS  20   2.138  -3.970   6.262
  119    HG2  LYS  20           1HG      LYS  20   3.901  -5.170   7.572
  120    HG3  LYS  20           2HG      LYS  20   5.091  -4.508   6.449
  121    HD2  LYS  20           1HD      LYS  20   5.165  -2.911   8.084
  122    HD3  LYS  20           2HD      LYS  20   3.891  -2.237   7.065
  123    HE2  LYS  20           1HE      LYS  20   2.351  -3.715   8.615
  124    HE3  LYS  20           2HE      LYS  20   3.707  -3.553   9.730
  125    HZ1  LYS  20           3HZ      LYS  20   1.836  -1.820   9.804
  126    HZ2  LYS  20           1HZ      LYS  20   2.558  -1.177   8.415
  127    HZ3  LYS  20           2HZ      LYS  20   3.436  -1.274   9.857
  128    H    ALA  21           H        ALA  21   0.772  -5.439   6.577
  129    HA   ALA  21           HA       ALA  21  -1.100  -5.614   4.320
  130    HB1  ALA  21           3HB      ALA  21  -2.577  -7.038   5.797
  131    HB2  ALA  21           1HB      ALA  21  -1.130  -7.820   5.161
  132    HB3  ALA  21           2HB      ALA  21  -1.168  -7.262   6.834
  133    H    PHE  22           H        PHE  22  -2.823  -4.273   4.439
  134    HA   PHE  22           HA       PHE  22  -3.311  -2.864   6.972
  135    HB2  PHE  22           1HB      PHE  22  -3.224  -1.536   4.255
  136    HB3  PHE  22           2HB      PHE  22  -3.547  -0.746   5.795
  137    HD1  PHE  22           HD1      PHE  22  -0.954  -2.544   3.863
  138    HD2  PHE  22           HD2      PHE  22  -1.797   0.034   7.143
  139    HE1  PHE  22           HE1      PHE  22   1.453  -2.117   4.141
  140    HE2  PHE  22           HE2      PHE  22   0.608   0.467   7.425
  141    HZ   PHE  22           HZ       PHE  22   2.237  -0.608   5.923
  142    H    SER  23           H        SER  23  -5.438  -2.119   7.290
  143    HA   SER  23           HA       SER  23  -7.439  -3.757   6.066
  144    HB2  SER  23           1HB      SER  23  -7.547  -1.537   8.108
  145    HB3  SER  23           2HB      SER  23  -9.000  -2.336   7.509
  146    HG   SER  23           HG       SER  23  -7.850  -3.173   9.503
  147    H    HIS  24           H        HIS  24  -6.884  -0.238   6.160
  148    HA   HIS  24           HA       HIS  24  -8.782   0.121   3.973
  149    HB2  HIS  24           1HB      HIS  24  -8.680   1.613   6.060
  150    HB3  HIS  24           2HB      HIS  24  -7.227   2.306   5.347
  151    HD1  HIS  24           HD1      HIS  24  -8.453   4.600   5.151
  152    HD2  HIS  24           HD2      HIS  24 -10.151   1.531   2.923
  153    HE1  HIS  24           HE1      HIS  24 -10.037   5.725   3.554
  154    H    HIS  25           H        HIS  25  -8.248   0.997   1.980
  155    HA   HIS  25           HA       HIS  25  -5.839   0.241   0.828
  156    HB2  HIS  25           1HB      HIS  25  -6.564   1.319  -1.128
  157    HB3  HIS  25           2HB      HIS  25  -8.059   0.890  -0.302
  158    HD1  HIS  25           HD1      HIS  25  -9.355   2.869   0.873
  159    HD2  HIS  25           HD2      HIS  25  -6.170   4.016  -1.535
  160    HE1  HIS  25           HE1      HIS  25  -9.660   5.334   0.484
  161    H    ALA  26           H        ALA  26  -6.844   3.443   1.993
  162    HA   ALA  26           HA       ALA  26  -4.557   4.865   1.265
  163    HB1  ALA  26           3HB      ALA  26  -5.502   6.594   2.352
  164    HB2  ALA  26           1HB      ALA  26  -6.898   5.520   2.443
  165    HB3  ALA  26           2HB      ALA  26  -5.795   5.653   3.814
  166    H    SER  27           H        SER  27  -5.311   3.253   4.349
  167    HA   SER  27           HA       SER  27  -3.165   3.864   5.876
  168    HB2  SER  27           1HB      SER  27  -4.785   1.381   5.582
  169    HB3  SER  27           2HB      SER  27  -3.309   1.283   6.543
  170    HG   SER  27           HG       SER  27  -5.310   1.893   7.680
  171    H    LEU  28           H        LEU  28  -3.129   2.028   2.955
  172    HA   LEU  28           HA       LEU  28  -0.477   0.947   3.413
  173    HB2  LEU  28           1HB      LEU  28  -2.041  -0.424   2.213
  174    HB3  LEU  28           2HB      LEU  28  -2.330   0.859   1.040
  175    HG   LEU  28           HG       LEU  28   0.028   0.609   0.279
  176   HD11  LEU  28          1HD1      LEU  28  -0.006  -1.454   2.419
  177   HD12  LEU  28          2HD1      LEU  28   1.277  -0.346   1.934
  178   HD13  LEU  28          3HD1      LEU  28   0.929  -1.772   0.957
  179   HD21  LEU  28          3HD2      LEU  28  -2.156  -0.761  -0.477
  180   HD22  LEU  28          1HD2      LEU  28  -1.105  -2.100  -0.013
  181   HD23  LEU  28          2HD2      LEU  28  -0.576  -0.949  -1.240
  182    H    THR  29           H        THR  29  -1.974   3.164   1.056
  183    HA   THR  29           HA       THR  29   0.394   3.975  -0.192
  184    HB   THR  29           HB       THR  29  -2.004   4.411  -0.956
  185    HG1  THR  29           HG1      THR  29  -0.299   6.685  -1.049
  186   HG21  THR  29          3HG2      THR  29  -3.296   5.935   0.058
  187   HG22  THR  29          1HG2      THR  29  -1.970   7.089   0.196
  188   HG23  THR  29          2HG2      THR  29  -2.165   5.821   1.406
  189    H    GLN  30           H        GLN  30  -1.068   4.962   2.807
  190    HA   GLN  30           HA       GLN  30   0.435   7.376   3.105
  191    HB2  GLN  30           1HB      GLN  30  -0.596   7.602   5.183
  192    HB3  GLN  30           2HB      GLN  30  -1.786   6.706   4.247
  193    HG2  GLN  30           1HG      GLN  30  -1.246   4.675   5.327
  194    HG3  GLN  30           2HG      GLN  30   0.203   5.367   6.054
  195   HE21  GLN  30          1HE2      GLN  30  -3.314   5.752   5.966
  196   HE22  GLN  30          2HE2      GLN  30  -3.479   6.224   7.620
  197    H    HIS  31           H        HIS  31   0.798   4.046   4.215
  198    HA   HIS  31           HA       HIS  31   3.076   4.566   5.851
  199    HB2  HIS  31           1HB      HIS  31   2.043   2.615   6.506
  200    HB3  HIS  31           2HB      HIS  31   1.668   2.132   4.855
  201    HD1  HIS  31           HD1      HIS  31   4.256   1.832   7.495
  202    HD2  HIS  31           HD2      HIS  31   3.765   0.783   3.506
  203    HE1  HIS  31           HE1      HIS  31   6.101   0.197   6.998
  204    H    GLN  32           H        GLN  32   2.639   3.253   2.582
  205    HA   GLN  32           HA       GLN  32   5.053   2.440   1.804
  206    HB2  GLN  32           1HB      GLN  32   3.108   4.223   0.376
  207    HB3  GLN  32           2HB      GLN  32   4.619   3.762  -0.397
  208    HG2  GLN  32           1HG      GLN  32   4.044   1.439  -0.271
  209    HG3  GLN  32           2HG      GLN  32   2.606   1.804   0.681
  210   HE21  GLN  32          1HE2      GLN  32   1.937   0.381  -1.293
  211   HE22  GLN  32          2HE2      GLN  32   1.307   1.267  -2.635
  212    H    ARG  33           H        ARG  33   4.228   5.768   2.534
  213    HA   ARG  33           HA       ARG  33   6.325   7.173   1.481
  214    HB2  ARG  33           1HB      ARG  33   4.761   7.473   4.015
  215    HB3  ARG  33           2HB      ARG  33   6.133   8.533   3.720
  216    HG2  ARG  33           1HG      ARG  33   5.081   9.176   1.555
  217    HG3  ARG  33           2HG      ARG  33   3.662   8.240   2.030
  218    HD2  ARG  33           1HD      ARG  33   3.107  10.397   2.683
  219    HD3  ARG  33           2HD      ARG  33   3.714   9.675   4.173
  220    HE   ARG  33           HE       ARG  33   5.676  11.108   2.601
  221   HH11  ARG  33          1HH1      ARG  33   3.347  11.240   5.186
  222   HH12  ARG  33          2HH1      ARG  33   4.066  12.626   5.937
  223   HH21  ARG  33          1HH2      ARG  33   6.631  12.933   3.581
  224   HH22  ARG  33          2HH2      ARG  33   5.933  13.589   5.023
  225    H    VAL  34           H        VAL  34   6.295   5.494   4.621
  226    HA   VAL  34           HA       VAL  34   8.698   6.065   5.679
  227    HB   VAL  34           HB       VAL  34   8.836   3.775   6.568
  228   HG11  VAL  34          1HG1      VAL  34   6.000   4.800   6.539
  229   HG12  VAL  34          2HG1      VAL  34   6.747   3.783   7.772
  230   HG13  VAL  34          3HG1      VAL  34   7.294   5.446   7.548
  231   HG21  VAL  34          3HG2      VAL  34   7.894   1.995   5.597
  232   HG22  VAL  34          1HG2      VAL  34   6.356   2.828   5.372
  233   HG23  VAL  34          2HG2      VAL  34   7.652   3.035   4.194
  234    H    HIS  35           H        HIS  35   8.161   4.304   2.735
  235    HA   HIS  35           HA       HIS  35  10.997   3.594   2.548
  236    HB2  HIS  35           1HB      HIS  35   8.825   2.858   0.589
  237    HB3  HIS  35           2HB      HIS  35  10.401   2.100   0.793
  238    HD1  HIS  35           HD1      HIS  35  10.625   1.142   3.481
  239    HD2  HIS  35           HD2      HIS  35   6.899   1.310   1.653
  240    HE1  HIS  35           HE1      HIS  35   9.174  -0.461   4.765
  241    H    SER  36           H        SER  36  12.294   5.037   1.641
  242    HA   SER  36           HA       SER  36  11.765   7.379   0.452
  243    HB2  SER  36           1HB      SER  36  13.901   7.114  -0.848
  244    HB3  SER  36           2HB      SER  36  14.046   6.729   0.866
  245    HG   SER  36           HG       SER  36  14.401   5.130  -1.312
  246    H    GLY  37           H        GLY  37  10.881   8.143  -1.370
  247    HA2  GLY  37           1HA      GLY  37  10.210   6.179  -3.472
  248    HA3  GLY  37           2HA      GLY  37   9.220   7.574  -3.072
  249    H    GLU  38           H        GLU  38   9.361   7.962  -5.412
  250    HA   GLU  38           HA       GLU  38  10.313   8.849  -7.309
  251    HB2  GLU  38           1HB      GLU  38  11.250  10.772  -5.173
  252    HB3  GLU  38           2HB      GLU  38  11.260  11.112  -6.898
  253    HG2  GLU  38           1HG      GLU  38   8.997  11.354  -7.011
  254    HG3  GLU  38           2HG      GLU  38   8.702  10.270  -5.653
  255    H    LYS  39           H        LYS  39  11.881   6.750  -6.391
  256    HA   LYS  39           HA       LYS  39  14.615   7.440  -6.092
  257    HB2  LYS  39           1HB      LYS  39  15.026   5.036  -6.613
  258    HB3  LYS  39           2HB      LYS  39  13.852   5.292  -5.329
  259    HG2  LYS  39           1HG      LYS  39  12.752   3.705  -6.515
  260    HG3  LYS  39           2HG      LYS  39  12.153   5.138  -7.353
  261    HD2  LYS  39           1HD      LYS  39  14.069   4.836  -8.974
  262    HD3  LYS  39           2HD      LYS  39  14.345   3.264  -8.220
  263    HE2  LYS  39           1HE      LYS  39  11.882   2.796  -8.709
  264    HE3  LYS  39           2HE      LYS  39  11.946   4.208  -9.763
  265    HZ1  LYS  39           3HZ      LYS  39  14.136   2.514 -10.305
  266    HZ2  LYS  39           1HZ      LYS  39  12.880   2.987 -11.336
  267    HZ3  LYS  39           2HZ      LYS  39  12.706   1.611 -10.368
  268    HA   PRO  40           HA       PRO  40  15.767   8.370 -10.237
  269    HB2  PRO  40           1HB      PRO  40  18.418   7.803 -10.088
  270    HB3  PRO  40           2HB      PRO  40  17.699   9.238  -9.348
  271    HG2  PRO  40           1HG      PRO  40  18.447   6.629  -8.086
  272    HG3  PRO  40           2HG      PRO  40  18.698   8.276  -7.481
  273    HD2  PRO  40           1HD      PRO  40  16.679   6.697  -6.609
  274    HD3  PRO  40           2HD      PRO  40  16.531   8.462  -6.719
  275    H    SER  41           H        SER  41  15.917   5.249  -8.899
  276    HA   SER  41           HA       SER  41  15.862   3.169  -9.824
  277    HB2  SER  41           1HB      SER  41  14.322   4.238 -11.474
  278    HB3  SER  41           2HB      SER  41  15.717   4.593 -12.493
  279    HG   SER  41           HG       SER  41  16.112   2.280 -12.477
  280    H    GLY  42           H        GLY  42  18.326   4.217  -9.146
  281    HA2  GLY  42           1HA      GLY  42  20.354   4.289 -10.986
  282    HA3  GLY  42           2HA      GLY  42  20.541   3.629  -9.368
  283    HA   PRO  43           HA       PRO  43  20.648   0.340 -12.890
  284    HB2  PRO  43           1HB      PRO  43  23.274   0.372 -13.575
  285    HB3  PRO  43           2HB      PRO  43  22.052   1.339 -14.410
  286    HG2  PRO  43           1HG      PRO  43  23.987   2.161 -12.279
  287    HG3  PRO  43           2HG      PRO  43  23.523   3.019 -13.760
  288    HD2  PRO  43           1HD      PRO  43  22.501   3.647 -11.332
  289    HD3  PRO  43           2HD      PRO  43  21.570   3.821 -12.834
  290    H    SER  44           H        SER  44  21.887   1.036  -9.917
  291    HA   SER  44           HA       SER  44  22.910  -0.143  -8.251
  292    HB2  SER  44           1HB      SER  44  21.682  -2.518  -9.671
  293    HB3  SER  44           2HB      SER  44  22.131  -2.422  -7.968
  294    HG   SER  44           HG       SER  44  20.163  -1.750  -7.699
  295    H    SER  45           H        SER  45  24.621   0.432 -10.384
  296    HA   SER  45           HA       SER  45  26.531  -0.232 -11.470
  297    HB2  SER  45           1HB      SER  45  26.828  -1.500  -8.741
  298    HB3  SER  45           2HB      SER  45  28.143  -1.390  -9.911
  299    HG   SER  45           HG       SER  45  26.826   0.665  -8.512
  300    H    GLY  46           H        GLY  46  24.394  -1.846 -12.232
  301    HA2  GLY  46           1HA      GLY  46  25.798  -4.398 -12.683
  302    HA3  GLY  46           2HA      GLY  46  24.106  -4.390 -12.210
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1   8.054 -18.984   5.311
    2    HA2  GLY   1           1HA      GLY   1   5.696 -20.135   6.552
    3    HA3  GLY   1           2HA      GLY   1   6.107 -18.428   6.471
    4    H    SER   2           H        SER   2   3.556 -18.975   6.050
    5    HA   SER   2           HA       SER   2   3.123 -18.084   3.373
    6    HB2  SER   2           1HB      SER   2   3.372 -20.466   2.888
    7    HB3  SER   2           2HB      SER   2   2.162 -20.861   4.109
    8    HG   SER   2           HG       SER   2   0.652 -19.653   2.844
    9    H    SER   3           H        SER   3   1.052 -17.251   3.058
   10    HA   SER   3           HA       SER   3  -0.946 -17.573   5.140
   11    HB2  SER   3           1HB      SER   3  -1.110 -15.236   5.694
   12    HB3  SER   3           2HB      SER   3   0.571 -15.721   5.914
   13    HG   SER   3           HG       SER   3  -0.220 -13.717   4.529
   14    H    GLY   4           H        GLY   4  -2.869 -15.986   4.578
   15    HA2  GLY   4           1HA      GLY   4  -3.699 -14.813   2.442
   16    HA3  GLY   4           2HA      GLY   4  -3.372 -16.373   1.702
   17    H    SER   5           H        SER   5  -5.429 -14.614   3.914
   18    HA   SER   5           HA       SER   5  -7.104 -16.848   4.549
   19    HB2  SER   5           1HB      SER   5  -8.582 -15.163   5.578
   20    HB3  SER   5           2HB      SER   5  -6.906 -14.946   6.084
   21    HG   SER   5           HG       SER   5  -7.631 -13.547   3.820
   22    H    SER   6           H        SER   6  -9.289 -17.152   3.898
   23    HA   SER   6           HA       SER   6  -9.879 -16.030   1.237
   24    HB2  SER   6           1HB      SER   6 -11.124 -18.125   0.789
   25    HB3  SER   6           2HB      SER   6  -9.418 -18.424   1.119
   26    HG   SER   6           HG       SER   6 -10.619 -18.519   3.439
   27    H    GLY   7           H        GLY   7 -10.634 -14.633   3.516
   28    HA2  GLY   7           1HA      GLY   7 -13.128 -13.788   3.149
   29    HA3  GLY   7           2HA      GLY   7 -13.429 -15.271   4.043
   30    H    THR   8           H        THR   8 -14.435 -13.750   5.577
   31    HA   THR   8           HA       THR   8 -14.448 -12.430   7.447
   32    HB   THR   8           HB       THR   8 -11.895 -13.909   8.097
   33    HG1  THR   8           HG1      THR   8 -14.026 -15.084   7.424
   34   HG21  THR   8          3HG2      THR   8 -13.196 -13.758  10.413
   35   HG22  THR   8          1HG2      THR   8 -13.876 -12.325   9.644
   36   HG23  THR   8          2HG2      THR   8 -12.131 -12.468   9.854
   37    H    GLY   9           H        GLY   9 -13.281 -11.116   5.255
   38    HA2  GLY   9           1HA      GLY   9 -12.449  -8.795   5.698
   39    HA3  GLY   9           2HA      GLY   9 -11.131  -9.569   6.565
   40    H    GLU  10           H        GLU  10 -11.009  -7.750   4.290
   41    HA   GLU  10           HA       GLU  10  -9.714  -9.540   2.337
   42    HB2  GLU  10           1HB      GLU  10 -10.216  -7.909   0.603
   43    HB3  GLU  10           2HB      GLU  10 -11.695  -8.413   1.409
   44    HG2  GLU  10           1HG      GLU  10 -11.526  -6.340   2.807
   45    HG3  GLU  10           2HG      GLU  10 -10.209  -5.825   1.755
   46    H    LYS  11           H        LYS  11  -7.589  -9.331   2.174
   47    HA   LYS  11           HA       LYS  11  -6.359  -6.757   2.905
   48    HB2  LYS  11           1HB      LYS  11  -4.417  -8.101   3.781
   49    HB3  LYS  11           2HB      LYS  11  -5.891  -8.213   4.733
   50    HG2  LYS  11           1HG      LYS  11  -6.397 -10.363   3.625
   51    HG3  LYS  11           2HG      LYS  11  -4.850 -10.257   2.782
   52    HD2  LYS  11           1HD      LYS  11  -4.849  -9.984   5.742
   53    HD3  LYS  11           2HD      LYS  11  -5.117 -11.589   5.058
   54    HE2  LYS  11           1HE      LYS  11  -3.028 -11.617   4.012
   55    HE3  LYS  11           2HE      LYS  11  -2.837  -9.870   4.143
   56    HZ1  LYS  11           3HZ      LYS  11  -1.435 -11.062   5.722
   57    HZ2  LYS  11           1HZ      LYS  11  -2.801 -11.773   6.423
   58    HZ3  LYS  11           2HZ      LYS  11  -2.573 -10.100   6.523
   59    HA   PRO  12           HA       PRO  12  -5.029  -8.519  -1.303
   60    HB2  PRO  12           1HB      PRO  12  -6.271  -6.684  -2.872
   61    HB3  PRO  12           2HB      PRO  12  -7.033  -8.202  -2.381
   62    HG2  PRO  12           1HG      PRO  12  -7.366  -5.458  -1.233
   63    HG3  PRO  12           2HG      PRO  12  -8.600  -6.684  -1.577
   64    HD2  PRO  12           1HD      PRO  12  -7.628  -6.254   0.913
   65    HD3  PRO  12           2HD      PRO  12  -8.155  -7.856   0.357
   66    H    TYR  13           H        TYR  13  -4.644  -5.881   0.646
   67    HA   TYR  13           HA       TYR  13  -2.930  -4.419  -1.227
   68    HB2  TYR  13           1HB      TYR  13  -3.690  -3.630   1.589
   69    HB3  TYR  13           2HB      TYR  13  -2.967  -2.607   0.352
   70    HD1  TYR  13           HD1      TYR  13  -6.056  -4.300   1.421
   71    HD2  TYR  13           HD2      TYR  13  -4.308  -1.599  -1.363
   72    HE1  TYR  13           HE1      TYR  13  -8.301  -3.605   0.695
   73    HE2  TYR  13           HE2      TYR  13  -6.548  -0.895  -2.095
   74    HH   TYR  13           HH       TYR  13  -9.477  -2.253  -0.612
   75    H    GLU  14           H        GLU  14  -0.758  -4.293  -1.010
   76    HA   GLU  14           HA       GLU  14   0.557  -5.184   1.410
   77    HB2  GLU  14           1HB      GLU  14   0.196  -7.299   0.232
   78    HB3  GLU  14           2HB      GLU  14   0.962  -6.642  -1.207
   79    HG2  GLU  14           1HG      GLU  14   3.067  -6.418   0.030
   80    HG3  GLU  14           2HG      GLU  14   2.293  -7.119   1.450
   81    H    CYS  15           H        CYS  15   2.689  -4.487   1.579
   82    HA   CYS  15           HA       CYS  15   3.352  -2.212  -0.026
   83    HB2  CYS  15           1HB      CYS  15   3.868  -2.757   2.511
   84    HB3  CYS  15           2HB      CYS  15   5.332  -3.460   1.831
   85    H    ASP  16           H        ASP  16   5.858  -2.083  -0.618
   86    HA   ASP  16           HA       ASP  16   6.477  -4.476  -2.224
   87    HB2  ASP  16           1HB      ASP  16   7.047  -1.604  -2.984
   88    HB3  ASP  16           2HB      ASP  16   7.363  -3.032  -3.966
   89    H    VAL  17           H        VAL  17   7.577  -2.115   0.011
   90    HA   VAL  17           HA       VAL  17  10.388  -2.767  -0.383
   91    HB   VAL  17           HB       VAL  17   9.061  -0.895   1.582
   92   HG11  VAL  17          1HG1      VAL  17  11.518  -2.074   1.867
   93   HG12  VAL  17          2HG1      VAL  17  11.914  -0.555   1.061
   94   HG13  VAL  17          3HG1      VAL  17  11.028  -0.541   2.587
   95   HG21  VAL  17          3HG2      VAL  17   9.322  -0.529  -1.085
   96   HG22  VAL  17          1HG2      VAL  17   9.332   0.779   0.098
   97   HG23  VAL  17          2HG2      VAL  17  10.854   0.133  -0.515
   98    H    CYS  18           H        CYS  18   7.891  -3.079   2.118
   99    HA   CYS  18           HA       CYS  18   9.614  -5.043   3.482
  100    HB2  CYS  18           1HB      CYS  18   8.334  -4.504   5.540
  101    HB3  CYS  18           2HB      CYS  18   9.208  -3.116   4.898
  102    H    ARG  19           H        ARG  19   7.001  -4.790   1.511
  103    HA   ARG  19           HA       ARG  19   5.204  -6.100   1.004
  104    HB2  ARG  19           1HB      ARG  19   6.879  -8.268   2.281
  105    HB3  ARG  19           2HB      ARG  19   5.589  -8.493   1.108
  106    HG2  ARG  19           1HG      ARG  19   8.226  -7.124   0.620
  107    HG3  ARG  19           2HG      ARG  19   7.746  -8.723   0.047
  108    HD2  ARG  19           1HD      ARG  19   5.856  -7.610  -1.173
  109    HD3  ARG  19           2HD      ARG  19   6.578  -6.061  -0.741
  110    HE   ARG  19           HE       ARG  19   8.218  -6.411  -2.317
  111   HH11  ARG  19          1HH1      ARG  19   6.407  -9.344  -1.827
  112   HH12  ARG  19          2HH1      ARG  19   7.108 -10.158  -3.187
  113   HH21  ARG  19          1HH2      ARG  19   9.148  -7.472  -4.109
  114   HH22  ARG  19          2HH2      ARG  19   8.668  -9.092  -4.483
  115    H    LYS  20           H        LYS  20   4.745  -4.697   3.289
  116    HA   LYS  20           HA       LYS  20   3.865  -6.431   5.414
  117    HB2  LYS  20           1HB      LYS  20   4.713  -4.012   5.631
  118    HB3  LYS  20           2HB      LYS  20   3.111  -3.534   5.085
  119    HG2  LYS  20           1HG      LYS  20   2.089  -4.254   7.013
  120    HG3  LYS  20           2HG      LYS  20   3.367  -5.413   7.385
  121    HD2  LYS  20           1HD      LYS  20   4.872  -3.597   7.972
  122    HD3  LYS  20           2HD      LYS  20   3.642  -2.410   7.531
  123    HE2  LYS  20           1HE      LYS  20   3.304  -4.491   9.687
  124    HE3  LYS  20           2HE      LYS  20   3.832  -2.835   9.983
  125    HZ1  LYS  20           3HZ      LYS  20   1.324  -3.329   8.525
  126    HZ2  LYS  20           1HZ      LYS  20   1.775  -1.990   9.457
  127    HZ3  LYS  20           2HZ      LYS  20   1.346  -3.441  10.213
  128    H    ALA  21           H        ALA  21   1.555  -6.089   6.261
  129    HA   ALA  21           HA       ALA  21  -0.315  -6.237   3.985
  130    HB1  ALA  21           3HB      ALA  21  -0.055  -7.919   6.429
  131    HB2  ALA  21           1HB      ALA  21  -1.655  -7.672   5.728
  132    HB3  ALA  21           2HB      ALA  21  -0.369  -8.393   4.759
  133    H    PHE  22           H        PHE  22  -2.234  -5.151   4.114
  134    HA   PHE  22           HA       PHE  22  -2.837  -3.700   6.590
  135    HB2  PHE  22           1HB      PHE  22  -2.844  -2.425   3.846
  136    HB3  PHE  22           2HB      PHE  22  -3.263  -1.638   5.364
  137    HD1  PHE  22           HD1      PHE  22  -0.509  -3.079   3.393
  138    HD2  PHE  22           HD2      PHE  22  -1.589  -0.806   6.826
  139    HE1  PHE  22           HE1      PHE  22   1.842  -2.417   3.690
  140    HE2  PHE  22           HE2      PHE  22   0.760  -0.140   7.128
  141    HZ   PHE  22           HZ       PHE  22   2.479  -0.945   5.559
  142    H    SER  23           H        SER  23  -5.062  -2.696   6.491
  143    HA   SER  23           HA       SER  23  -6.883  -4.410   4.931
  144    HB2  SER  23           1HB      SER  23  -8.456  -4.314   6.841
  145    HB3  SER  23           2HB      SER  23  -6.929  -5.079   7.280
  146    HG   SER  23           HG       SER  23  -6.535  -2.588   7.798
  147    H    HIS  24           H        HIS  24  -5.895  -1.851   4.138
  148    HA   HIS  24           HA       HIS  24  -8.318  -0.592   3.421
  149    HB2  HIS  24           1HB      HIS  24  -7.805   0.094   5.929
  150    HB3  HIS  24           2HB      HIS  24  -6.717   1.241   5.151
  151    HD1  HIS  24           HD1      HIS  24  -8.277   2.308   2.864
  152    HD2  HIS  24           HD2      HIS  24 -10.047   1.466   6.527
  153    HE1  HIS  24           HE1      HIS  24 -10.369   3.702   2.936
  154    H    HIS  25           H        HIS  25  -7.842  -0.011   1.416
  155    HA   HIS  25           HA       HIS  25  -5.526   0.122   0.105
  156    HB2  HIS  25           1HB      HIS  25  -7.704   0.559  -0.953
  157    HB3  HIS  25           2HB      HIS  25  -7.736   2.163  -0.224
  158    HD1  HIS  25           HD1      HIS  25  -7.407   0.996  -3.376
  159    HD2  HIS  25           HD2      HIS  25  -4.823   3.273  -1.053
  160    HE1  HIS  25           HE1      HIS  25  -5.905   2.181  -5.007
  161    H    ALA  26           H        ALA  26  -6.860   2.882   1.912
  162    HA   ALA  26           HA       ALA  26  -4.700   4.628   1.426
  163    HB1  ALA  26           3HB      ALA  26  -5.749   5.445   3.839
  164    HB2  ALA  26           1HB      ALA  26  -6.298   5.952   2.242
  165    HB3  ALA  26           2HB      ALA  26  -7.099   4.614   3.067
  166    H    SER  27           H        SER  27  -5.432   2.497   4.175
  167    HA   SER  27           HA       SER  27  -3.384   3.140   5.881
  168    HB2  SER  27           1HB      SER  27  -4.721   0.510   5.285
  169    HB3  SER  27           2HB      SER  27  -3.450   0.629   6.502
  170    HG   SER  27           HG       SER  27  -5.500   2.504   6.631
  171    H    LEU  28           H        LEU  28  -3.146   1.721   2.781
  172    HA   LEU  28           HA       LEU  28  -0.503   0.604   3.236
  173    HB2  LEU  28           1HB      LEU  28  -2.057  -0.572   1.777
  174    HB3  LEU  28           2HB      LEU  28  -2.161   0.840   0.728
  175    HG   LEU  28           HG       LEU  28   0.290   0.540   0.252
  176   HD11  LEU  28          1HD1      LEU  28   0.385  -1.049   2.380
  177   HD12  LEU  28          2HD1      LEU  28   1.491  -1.226   1.018
  178   HD13  LEU  28          3HD1      LEU  28   0.080  -2.275   1.149
  179   HD21  LEU  28          3HD2      LEU  28  -0.135  -0.869  -1.512
  180   HD22  LEU  28          1HD2      LEU  28  -1.772  -0.378  -1.075
  181   HD23  LEU  28          2HD2      LEU  28  -1.152  -1.944  -0.552
  182    H    THR  29           H        THR  29  -1.931   3.106   1.137
  183    HA   THR  29           HA       THR  29   0.465   4.108   0.109
  184    HB   THR  29           HB       THR  29  -2.001   4.635  -0.559
  185    HG1  THR  29           HG1      THR  29  -0.842   5.774  -1.904
  186   HG21  THR  29          3HG2      THR  29  -2.648   5.634   1.584
  187   HG22  THR  29          1HG2      THR  29  -2.801   6.795   0.266
  188   HG23  THR  29          2HG2      THR  29  -1.428   6.888   1.370
  189    H    GLN  30           H        GLN  30  -1.355   5.033   3.003
  190    HA   GLN  30           HA       GLN  30   0.119   7.268   3.752
  191    HB2  GLN  30           1HB      GLN  30  -0.936   7.127   5.810
  192    HB3  GLN  30           2HB      GLN  30  -2.038   6.229   4.774
  193    HG2  GLN  30           1HG      GLN  30  -1.232   4.146   5.588
  194    HG3  GLN  30           2HG      GLN  30   0.095   4.929   6.445
  195   HE21  GLN  30          1HE2      GLN  30  -0.363   6.135   8.319
  196   HE22  GLN  30          2HE2      GLN  30  -1.815   5.878   9.218
  197    H    HIS  31           H        HIS  31   0.714   3.843   4.389
  198    HA   HIS  31           HA       HIS  31   2.991   4.305   6.053
  199    HB2  HIS  31           1HB      HIS  31   2.084   2.238   6.501
  200    HB3  HIS  31           2HB      HIS  31   1.693   1.924   4.812
  201    HD1  HIS  31           HD1      HIS  31   4.618   1.865   7.198
  202    HD2  HIS  31           HD2      HIS  31   3.567   0.463   3.431
  203    HE1  HIS  31           HE1      HIS  31   6.469   0.303   6.521
  204    H    GLN  32           H        GLN  32   2.574   3.259   2.680
  205    HA   GLN  32           HA       GLN  32   5.078   2.757   1.846
  206    HB2  GLN  32           1HB      GLN  32   2.842   4.245   0.529
  207    HB3  GLN  32           2HB      GLN  32   4.394   4.127  -0.289
  208    HG2  GLN  32           1HG      GLN  32   4.228   1.631   0.016
  209    HG3  GLN  32           2HG      GLN  32   2.561   1.894   0.525
  210   HE21  GLN  32          1HE2      GLN  32   3.168   0.327  -1.647
  211   HE22  GLN  32          2HE2      GLN  32   2.625   1.107  -3.090
  212    H    ARG  33           H        ARG  33   3.838   5.892   2.766
  213    HA   ARG  33           HA       ARG  33   5.673   7.627   1.705
  214    HB2  ARG  33           1HB      ARG  33   4.209   7.596   4.321
  215    HB3  ARG  33           2HB      ARG  33   5.378   8.867   3.986
  216    HG2  ARG  33           1HG      ARG  33   4.130   9.521   2.006
  217    HG3  ARG  33           2HG      ARG  33   2.976   8.217   2.291
  218    HD2  ARG  33           1HD      ARG  33   1.925  10.108   3.168
  219    HD3  ARG  33           2HD      ARG  33   2.605   9.300   4.580
  220    HE   ARG  33           HE       ARG  33   4.509  11.112   3.730
  221   HH11  ARG  33          1HH1      ARG  33   1.224  11.205   4.879
  222   HH12  ARG  33          2HH1      ARG  33   1.379  12.778   5.588
  223   HH21  ARG  33          1HH2      ARG  33   4.725  13.184   4.660
  224   HH22  ARG  33          2HH2      ARG  33   3.370  13.903   5.462
  225    H    VAL  34           H        VAL  34   6.014   5.722   4.683
  226    HA   VAL  34           HA       VAL  34   8.374   6.622   5.688
  227    HB   VAL  34           HB       VAL  34   8.809   4.385   6.557
  228   HG11  VAL  34          1HG1      VAL  34   5.933   5.267   6.548
  229   HG12  VAL  34          2HG1      VAL  34   6.531   3.956   7.568
  230   HG13  VAL  34          3HG1      VAL  34   7.169   5.589   7.764
  231   HG21  VAL  34          3HG2      VAL  34   6.927   2.664   5.824
  232   HG22  VAL  34          1HG2      VAL  34   7.006   3.601   4.333
  233   HG23  VAL  34          2HG2      VAL  34   8.453   2.805   4.952
  234    H    HIS  35           H        HIS  35   7.953   4.477   2.916
  235    HA   HIS  35           HA       HIS  35  10.822   4.257   2.522
  236    HB2  HIS  35           1HB      HIS  35   8.665   3.251   0.669
  237    HB3  HIS  35           2HB      HIS  35  10.327   2.686   0.805
  238    HD1  HIS  35           HD1      HIS  35  10.719   1.906   3.587
  239    HD2  HIS  35           HD2      HIS  35   7.044   1.380   1.722
  240    HE1  HIS  35           HE1      HIS  35   9.540   0.125   4.915
  241    H    SER  36           H        SER  36   9.777   6.892   2.377
  242    HA   SER  36           HA       SER  36   9.711   7.556  -0.460
  243    HB2  SER  36           1HB      SER  36   9.182   9.829   0.285
  244    HB3  SER  36           2HB      SER  36   8.115   8.662   1.065
  245    HG   SER  36           HG       SER  36   9.785  10.419   2.196
  246    H    GLY  37           H        GLY  37  11.712   8.129   2.403
  247    HA2  GLY  37           1HA      GLY  37  14.102   8.181   2.238
  248    HA3  GLY  37           2HA      GLY  37  13.939   8.793   0.599
  249    H    GLU  38           H        GLU  38  14.551   9.605   3.791
  250    HA   GLU  38           HA       GLU  38  13.680  12.373   3.525
  251    HB2  GLU  38           1HB      GLU  38  13.615  10.831   5.672
  252    HB3  GLU  38           2HB      GLU  38  15.269  11.398   5.857
  253    HG2  GLU  38           1HG      GLU  38  12.995  13.307   5.461
  254    HG3  GLU  38           2HG      GLU  38  13.412  12.678   7.054
  255    H    LYS  39           H        LYS  39  15.626  11.615   1.674
  256    HA   LYS  39           HA       LYS  39  17.653  13.574   2.243
  257    HB2  LYS  39           1HB      LYS  39  19.571  12.097   1.980
  258    HB3  LYS  39           2HB      LYS  39  18.597  11.590   3.354
  259    HG2  LYS  39           1HG      LYS  39  17.632   9.796   2.052
  260    HG3  LYS  39           2HG      LYS  39  18.508  10.335   0.617
  261    HD2  LYS  39           1HD      LYS  39  20.632   9.885   1.751
  262    HD3  LYS  39           2HD      LYS  39  19.754   9.345   3.183
  263    HE2  LYS  39           1HE      LYS  39  18.951   7.433   2.114
  264    HE3  LYS  39           2HE      LYS  39  19.269   8.085   0.507
  265    HZ1  LYS  39           3HZ      LYS  39  20.900   6.419   1.994
  266    HZ2  LYS  39           1HZ      LYS  39  21.672   7.924   1.987
  267    HZ3  LYS  39           2HZ      LYS  39  21.272   7.173   0.526
  268    HA   PRO  40           HA       PRO  40  17.490  14.044  -2.121
  269    HB2  PRO  40           1HB      PRO  40  19.954  15.071  -2.616
  270    HB3  PRO  40           2HB      PRO  40  18.669  15.995  -1.829
  271    HG2  PRO  40           1HG      PRO  40  20.994  14.560  -0.604
  272    HG3  PRO  40           2HG      PRO  40  20.335  16.159  -0.214
  273    HD2  PRO  40           1HD      PRO  40  19.793  13.959   1.269
  274    HD3  PRO  40           2HD      PRO  40  18.628  15.283   1.064
  275    H    SER  41           H        SER  41  19.441  11.768  -0.639
  276    HA   SER  41           HA       SER  41  20.541  10.789  -3.181
  277    HB2  SER  41           1HB      SER  41  21.242  10.101  -0.319
  278    HB3  SER  41           2HB      SER  41  21.948   9.310  -1.728
  279    HG   SER  41           HG       SER  41  23.228  11.055  -0.916
  280    H    GLY  42           H        GLY  42  20.542   8.392  -3.469
  281    HA2  GLY  42           1HA      GLY  42  19.477   6.283  -2.716
  282    HA3  GLY  42           2HA      GLY  42  18.029   7.236  -2.427
  283    HA   PRO  43           HA       PRO  43  18.400   5.524  -6.900
  284    HB2  PRO  43           1HB      PRO  43  17.041   3.187  -6.644
  285    HB3  PRO  43           2HB      PRO  43  18.796   3.303  -6.463
  286    HG2  PRO  43           1HG      PRO  43  16.676   3.206  -4.351
  287    HG3  PRO  43           2HG      PRO  43  18.238   2.367  -4.409
  288    HD2  PRO  43           1HD      PRO  43  17.842   4.610  -2.944
  289    HD3  PRO  43           2HD      PRO  43  19.403   4.223  -3.695
  290    H    SER  44           H        SER  44  16.325   4.570  -8.137
  291    HA   SER  44           HA       SER  44  13.963   6.008  -7.120
  292    HB2  SER  44           1HB      SER  44  15.125   7.221  -8.991
  293    HB3  SER  44           2HB      SER  44  14.771   5.841 -10.031
  294    HG   SER  44           HG       SER  44  12.996   7.686  -8.858
  295    H    SER  45           H        SER  45  11.928   5.304  -8.321
  296    HA   SER  45           HA       SER  45  12.000   2.509  -9.166
  297    HB2  SER  45           1HB      SER  45  10.535   3.559  -6.759
  298    HB3  SER  45           2HB      SER  45   9.934   2.151  -7.635
  299    HG   SER  45           HG       SER  45  11.359   1.629  -5.879
  300    H    GLY  46           H        GLY  46   9.973   1.802 -10.162
  301    HA2  GLY  46           1HA      GLY  46   7.673   2.891 -10.738
  302    HA3  GLY  46           2HA      GLY  46   8.707   4.046 -11.566
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -10.912 -31.591  -6.041
    2    HA2  GLY   1           1HA      GLY   1 -10.807 -29.313  -4.500
    3    HA3  GLY   1           2HA      GLY   1 -11.104 -30.918  -3.851
    4    H    SER   2           H        SER   2  -9.933 -30.957  -2.025
    5    HA   SER   2           HA       SER   2  -8.164 -30.763  -0.589
    6    HB2  SER   2           1HB      SER   2  -7.592 -32.678  -2.285
    7    HB3  SER   2           2HB      SER   2  -6.361 -31.550  -2.852
    8    HG   SER   2           HG       SER   2  -6.567 -32.896  -0.417
    9    H    SER   3           H        SER   3  -8.827 -28.314  -1.723
   10    HA   SER   3           HA       SER   3  -6.563 -26.970  -2.803
   11    HB2  SER   3           1HB      SER   3  -8.795 -26.113  -3.222
   12    HB3  SER   3           2HB      SER   3  -9.072 -25.895  -1.494
   13    HG   SER   3           HG       SER   3  -6.843 -24.640  -2.590
   14    H    GLY   4           H        GLY   4  -5.057 -25.659  -1.830
   15    HA2  GLY   4           1HA      GLY   4  -5.085 -24.700   0.781
   16    HA3  GLY   4           2HA      GLY   4  -4.327 -26.285   0.837
   17    H    SER   5           H        SER   5  -3.679 -23.094   0.673
   18    HA   SER   5           HA       SER   5  -1.055 -23.593  -0.549
   19    HB2  SER   5           1HB      SER   5  -2.865 -21.230  -1.090
   20    HB3  SER   5           2HB      SER   5  -1.159 -21.277  -1.532
   21    HG   SER   5           HG       SER   5  -1.804 -23.328  -2.651
   22    H    SER   6           H        SER   6   0.459 -21.676  -0.046
   23    HA   SER   6           HA       SER   6   0.435 -21.332   2.821
   24    HB2  SER   6           1HB      SER   6   2.408 -20.682   0.642
   25    HB3  SER   6           2HB      SER   6   2.636 -20.082   2.284
   26    HG   SER   6           HG       SER   6   3.209 -22.010   2.893
   27    H    GLY   7           H        GLY   7  -1.427 -19.968   3.016
   28    HA2  GLY   7           1HA      GLY   7  -0.976 -17.322   3.472
   29    HA3  GLY   7           2HA      GLY   7  -1.444 -17.368   1.779
   30    H    THR   8           H        THR   8  -2.517 -17.469   5.026
   31    HA   THR   8           HA       THR   8  -5.175 -18.423   4.407
   32    HB   THR   8           HB       THR   8  -4.203 -17.139   6.966
   33    HG1  THR   8           HG1      THR   8  -4.222 -19.545   7.528
   34   HG21  THR   8          3HG2      THR   8  -6.362 -19.171   6.890
   35   HG22  THR   8          1HG2      THR   8  -6.753 -17.563   6.282
   36   HG23  THR   8          2HG2      THR   8  -6.168 -17.763   7.934
   37    H    GLY   9           H        GLY   9  -6.693 -17.182   3.535
   38    HA2  GLY   9           1HA      GLY   9  -7.795 -15.297   2.799
   39    HA3  GLY   9           2HA      GLY   9  -7.667 -14.812   4.484
   40    H    GLU  10           H        GLU  10  -6.446 -14.383   1.275
   41    HA   GLU  10           HA       GLU  10  -4.152 -12.863   1.847
   42    HB2  GLU  10           1HB      GLU  10  -4.371 -12.025  -0.466
   43    HB3  GLU  10           2HB      GLU  10  -4.539 -13.772  -0.367
   44    HG2  GLU  10           1HG      GLU  10  -6.928 -13.606  -0.583
   45    HG3  GLU  10           2HG      GLU  10  -6.844 -11.846  -0.529
   46    H    LYS  11           H        LYS  11  -4.232 -10.464   0.723
   47    HA   LYS  11           HA       LYS  11  -6.402  -8.979   2.038
   48    HB2  LYS  11           1HB      LYS  11  -4.832  -7.335   2.878
   49    HB3  LYS  11           2HB      LYS  11  -4.386  -8.930   3.469
   50    HG2  LYS  11           1HG      LYS  11  -3.108  -7.937   0.975
   51    HG3  LYS  11           2HG      LYS  11  -2.590  -7.263   2.522
   52    HD2  LYS  11           1HD      LYS  11  -2.773 -10.228   2.108
   53    HD3  LYS  11           2HD      LYS  11  -1.346  -9.323   1.596
   54    HE2  LYS  11           1HE      LYS  11  -0.944  -8.571   3.834
   55    HE3  LYS  11           2HE      LYS  11  -2.479  -9.238   4.388
   56    HZ1  LYS  11           3HZ      LYS  11  -1.453 -11.447   3.520
   57    HZ2  LYS  11           1HZ      LYS  11  -1.012 -10.851   5.040
   58    HZ3  LYS  11           2HZ      LYS  11   0.017 -10.632   3.715
   59    HA   PRO  12           HA       PRO  12  -6.721  -6.887  -1.823
   60    HB2  PRO  12           1HB      PRO  12  -7.989  -4.636  -0.987
   61    HB3  PRO  12           2HB      PRO  12  -8.796  -6.204  -1.110
   62    HG2  PRO  12           1HG      PRO  12  -7.663  -4.841   1.302
   63    HG3  PRO  12           2HG      PRO  12  -9.195  -5.718   1.128
   64    HD2  PRO  12           1HD      PRO  12  -7.003  -6.828   2.265
   65    HD3  PRO  12           2HD      PRO  12  -8.186  -7.779   1.344
   66    H    TYR  13           H        TYR  13  -4.901  -5.710   0.814
   67    HA   TYR  13           HA       TYR  13  -3.373  -3.993  -0.984
   68    HB2  TYR  13           1HB      TYR  13  -4.123  -2.961   1.741
   69    HB3  TYR  13           2HB      TYR  13  -3.449  -2.073   0.379
   70    HD1  TYR  13           HD2      TYR  13  -4.907  -1.638  -1.628
   71    HD2  TYR  13           HD1      TYR  13  -6.458  -3.168   2.027
   72    HE1  TYR  13           HE2      TYR  13  -7.171  -0.965  -2.314
   73    HE2  TYR  13           HE1      TYR  13  -8.727  -2.500   1.351
   74    HH   TYR  13           HH       TYR  13  -9.712  -0.701  -0.262
   75    H    GLU  14           H        GLU  14  -1.275  -4.391  -0.770
   76    HA   GLU  14           HA       GLU  14  -0.107  -4.956   1.814
   77    HB2  GLU  14           1HB      GLU  14  -0.811  -7.183   1.204
   78    HB3  GLU  14           2HB      GLU  14  -0.106  -7.014  -0.397
   79    HG2  GLU  14           1HG      GLU  14   2.117  -6.679   0.859
   80    HG3  GLU  14           2HG      GLU  14   1.265  -7.380   2.233
   81    H    CYS  15           H        CYS  15   1.703  -3.820   1.893
   82    HA   CYS  15           HA       CYS  15   2.841  -2.431  -0.207
   83    HB2  CYS  15           1HB      CYS  15   3.229  -2.175   2.323
   84    HB3  CYS  15           2HB      CYS  15   4.468  -3.412   2.131
   85    H    ASP  16           H        ASP  16   5.179  -2.698  -0.951
   86    HA   ASP  16           HA       ASP  16   5.634  -5.517  -1.684
   87    HB2  ASP  16           1HB      ASP  16   5.925  -2.986  -3.277
   88    HB3  ASP  16           2HB      ASP  16   6.853  -4.422  -3.702
   89    H    VAL  17           H        VAL  17   7.036  -2.531  -0.560
   90    HA   VAL  17           HA       VAL  17   9.760  -3.408  -0.728
   91    HB   VAL  17           HB       VAL  17   8.525  -1.129   0.824
   92   HG11  VAL  17          1HG1      VAL  17  11.193  -2.250   0.868
   93   HG12  VAL  17          2HG1      VAL  17  11.201  -0.560   0.359
   94   HG13  VAL  17          3HG1      VAL  17  10.471  -1.015   1.900
   95   HG21  VAL  17          3HG2      VAL  17  10.145  -1.006  -1.710
   96   HG22  VAL  17          1HG2      VAL  17   8.383  -1.085  -1.696
   97   HG23  VAL  17          2HG2      VAL  17   9.211   0.284  -0.952
   98    H    CYS  18           H        CYS  18   7.266  -3.379   1.753
   99    HA   CYS  18           HA       CYS  18   9.092  -4.876   3.519
  100    HB2  CYS  18           1HB      CYS  18   7.983  -3.940   5.430
  101    HB3  CYS  18           2HB      CYS  18   8.420  -2.610   4.364
  102    H    ARG  19           H        ARG  19   6.159  -4.876   1.786
  103    HA   ARG  19           HA       ARG  19   4.564  -6.467   1.462
  104    HB2  ARG  19           1HB      ARG  19   6.308  -8.225   3.197
  105    HB3  ARG  19           2HB      ARG  19   5.021  -8.763   2.127
  106    HG2  ARG  19           1HG      ARG  19   7.451  -7.295   1.144
  107    HG3  ARG  19           2HG      ARG  19   7.371  -9.053   1.275
  108    HD2  ARG  19           1HD      ARG  19   5.161  -8.744  -0.099
  109    HD3  ARG  19           2HD      ARG  19   5.903  -7.212  -0.557
  110    HE   ARG  19           HE       ARG  19   7.465  -8.362  -1.806
  111   HH11  ARG  19          1HH1      ARG  19   5.596 -10.581   0.119
  112   HH12  ARG  19          2HH1      ARG  19   6.184 -11.990  -0.699
  113   HH21  ARG  19          1HH2      ARG  19   8.246 -10.210  -2.892
  114   HH22  ARG  19          2HH2      ARG  19   7.692 -11.778  -2.411
  115    H    LYS  20           H        LYS  20   4.338  -4.589   3.606
  116    HA   LYS  20           HA       LYS  20   3.338  -5.897   5.943
  117    HB2  LYS  20           1HB      LYS  20   3.507  -3.102   4.949
  118    HB3  LYS  20           2HB      LYS  20   2.284  -3.443   6.167
  119    HG2  LYS  20           1HG      LYS  20   5.061  -4.394   6.640
  120    HG3  LYS  20           2HG      LYS  20   4.705  -2.676   6.832
  121    HD2  LYS  20           1HD      LYS  20   3.315  -3.026   8.625
  122    HD3  LYS  20           2HD      LYS  20   2.891  -4.661   8.114
  123    HE2  LYS  20           1HE      LYS  20   5.590  -3.846   9.183
  124    HE3  LYS  20           2HE      LYS  20   4.313  -4.579  10.152
  125    HZ1  LYS  20           3HZ      LYS  20   6.204  -5.994   8.980
  126    HZ2  LYS  20           1HZ      LYS  20   5.080  -5.981   7.716
  127    HZ3  LYS  20           2HZ      LYS  20   4.644  -6.599   9.229
  128    H    ALA  21           H        ALA  21   1.016  -5.060   6.680
  129    HA   ALA  21           HA       ALA  21  -0.858  -5.650   4.482
  130    HB1  ALA  21           3HB      ALA  21  -2.272  -6.615   6.474
  131    HB2  ALA  21           1HB      ALA  21  -1.035  -7.592   5.684
  132    HB3  ALA  21           2HB      ALA  21  -0.686  -6.803   7.223
  133    H    PHE  22           H        PHE  22  -2.806  -4.545   4.458
  134    HA   PHE  22           HA       PHE  22  -3.490  -2.714   6.582
  135    HB2  PHE  22           1HB      PHE  22  -2.955  -1.547   3.851
  136    HB3  PHE  22           2HB      PHE  22  -3.316  -0.684   5.342
  137    HD1  PHE  22           HD2      PHE  22  -1.618  -0.454   7.087
  138    HD2  PHE  22           HD1      PHE  22  -0.750  -2.324   3.363
  139    HE1  PHE  22           HE2      PHE  22   0.790  -0.225   7.537
  140    HE2  PHE  22           HE1      PHE  22   1.660  -2.099   3.807
  141    HZ   PHE  22           HZ       PHE  22   2.433  -1.047   5.896
  142    H    SER  23           H        SER  23  -5.586  -3.095   6.806
  143    HA   SER  23           HA       SER  23  -7.252  -4.281   4.916
  144    HB2  SER  23           1HB      SER  23  -9.085  -3.740   6.388
  145    HB3  SER  23           2HB      SER  23  -7.686  -4.140   7.384
  146    HG   SER  23           HG       SER  23  -7.317  -1.787   7.427
  147    H    HIS  24           H        HIS  24  -6.762  -0.863   5.687
  148    HA   HIS  24           HA       HIS  24  -8.460  -0.138   3.400
  149    HB2  HIS  24           1HB      HIS  24  -8.999   0.851   5.639
  150    HB3  HIS  24           2HB      HIS  24  -7.439   1.667   5.601
  151    HD1  HIS  24           HD1      HIS  24  -8.704   3.956   5.669
  152    HD2  HIS  24           HD2      HIS  24  -9.442   1.658   2.287
  153    HE1  HIS  24           HE1      HIS  24  -9.796   5.513   4.024
  154    H    HIS  25           H        HIS  25  -7.569   0.637   1.602
  155    HA   HIS  25           HA       HIS  25  -4.943   0.556   0.939
  156    HB2  HIS  25           1HB      HIS  25  -7.094   1.197  -0.455
  157    HB3  HIS  25           2HB      HIS  25  -6.529   2.839  -0.160
  158    HD1  HIS  25           HD1      HIS  25  -3.470   2.271  -0.454
  159    HD2  HIS  25           HD2      HIS  25  -6.409   0.996  -3.100
  160    HE1  HIS  25           HE1      HIS  25  -2.290   1.906  -2.644
  161    H    ALA  26           H        ALA  26  -6.603   3.555   1.934
  162    HA   ALA  26           HA       ALA  26  -4.704   5.407   1.960
  163    HB1  ALA  26           3HB      ALA  26  -6.964   5.685   2.935
  164    HB2  ALA  26           1HB      ALA  26  -6.396   4.882   4.399
  165    HB3  ALA  26           2HB      ALA  26  -5.690   6.422   3.908
  166    H    SER  27           H        SER  27  -5.045   3.182   4.733
  167    HA   SER  27           HA       SER  27  -2.883   3.880   6.218
  168    HB2  SER  27           1HB      SER  27  -4.039   1.152   5.661
  169    HB3  SER  27           2HB      SER  27  -2.716   1.382   6.805
  170    HG   SER  27           HG       SER  27  -5.147   2.827   6.952
  171    H    LEU  28           H        LEU  28  -2.858   1.761   3.379
  172    HA   LEU  28           HA       LEU  28  -0.032   1.295   3.512
  173    HB2  LEU  28           1HB      LEU  28  -1.194  -0.431   2.490
  174    HB3  LEU  28           2HB      LEU  28  -2.201   0.671   1.552
  175    HG   LEU  28           HG       LEU  28  -0.135   1.221   0.208
  176   HD11  LEU  28          1HD1      LEU  28   1.296   0.098   2.116
  177   HD12  LEU  28          2HD1      LEU  28   1.816   0.061   0.431
  178   HD13  LEU  28          3HD1      LEU  28   1.029  -1.348   1.142
  179   HD21  LEU  28          3HD2      LEU  28  -1.570  -1.382   0.228
  180   HD22  LEU  28          1HD2      LEU  28  -0.190  -1.196  -0.855
  181   HD23  LEU  28          2HD2      LEU  28  -1.566  -0.099  -0.984
  182    H    THR  29           H        THR  29  -2.163   3.355   1.577
  183    HA   THR  29           HA       THR  29  -0.317   4.384  -0.218
  184    HB   THR  29           HB       THR  29  -2.763   5.640   1.017
  185    HG1  THR  29           HG1      THR  29  -2.428   4.988  -1.700
  186   HG21  THR  29          3HG2      THR  29  -2.102   6.978  -1.373
  187   HG22  THR  29          1HG2      THR  29  -0.643   6.966  -0.385
  188   HG23  THR  29          2HG2      THR  29  -2.139   7.640   0.261
  189    H    GLN  30           H        GLN  30  -1.182   5.605   3.008
  190    HA   GLN  30           HA       GLN  30   0.719   7.739   2.917
  191    HB2  GLN  30           1HB      GLN  30  -1.199   8.045   4.300
  192    HB3  GLN  30           2HB      GLN  30  -0.909   6.533   5.150
  193    HG2  GLN  30           1HG      GLN  30   1.064   7.451   6.192
  194    HG3  GLN  30           2HG      GLN  30   0.886   8.944   5.273
  195   HE21  GLN  30          1HE2      GLN  30  -0.143  10.549   6.225
  196   HE22  GLN  30          2HE2      GLN  30  -1.199  10.413   7.586
  197    H    HIS  31           H        HIS  31   0.674   4.479   4.244
  198    HA   HIS  31           HA       HIS  31   3.007   4.612   5.785
  199    HB2  HIS  31           1HB      HIS  31   1.841   2.678   6.210
  200    HB3  HIS  31           2HB      HIS  31   1.435   2.423   4.515
  201    HD1  HIS  31           HD1      HIS  31   3.998   1.629   7.081
  202    HD2  HIS  31           HD2      HIS  31   3.410   1.067   3.007
  203    HE1  HIS  31           HE1      HIS  31   5.707  -0.080   6.385
  204    H    GLN  32           H        GLN  32   2.553   3.663   2.392
  205    HA   GLN  32           HA       GLN  32   4.967   2.805   1.606
  206    HB2  GLN  32           1HB      GLN  32   3.084   4.717   0.263
  207    HB3  GLN  32           2HB      GLN  32   4.594   4.265  -0.516
  208    HG2  GLN  32           1HG      GLN  32   2.630   2.221   0.463
  209    HG3  GLN  32           2HG      GLN  32   2.517   2.948  -1.139
  210   HE21  GLN  32          1HE2      GLN  32   3.393   1.779  -2.674
  211   HE22  GLN  32          2HE2      GLN  32   4.743   0.714  -2.509
  212    H    ARG  33           H        ARG  33   4.216   6.073   2.595
  213    HA   ARG  33           HA       ARG  33   6.366   7.496   1.638
  214    HB2  ARG  33           1HB      ARG  33   4.949   7.710   4.295
  215    HB3  ARG  33           2HB      ARG  33   6.133   8.883   3.737
  216    HG2  ARG  33           1HG      ARG  33   4.754   9.514   1.898
  217    HG3  ARG  33           2HG      ARG  33   3.633   8.189   2.218
  218    HD2  ARG  33           1HD      ARG  33   2.589  10.104   3.094
  219    HD3  ARG  33           2HD      ARG  33   3.257   9.261   4.491
  220    HE   ARG  33           HE       ARG  33   5.163  11.097   3.636
  221   HH11  ARG  33          1HH1      ARG  33   1.940  11.104   4.951
  222   HH12  ARG  33          2HH1      ARG  33   2.122  12.639   5.734
  223   HH21  ARG  33          1HH2      ARG  33   5.416  13.118   4.662
  224   HH22  ARG  33          2HH2      ARG  33   4.099  13.784   5.568
  225    H    VAL  34           H        VAL  34   6.212   5.615   4.654
  226    HA   VAL  34           HA       VAL  34   8.610   6.079   5.799
  227    HB   VAL  34           HB       VAL  34   8.669   3.678   6.501
  228   HG11  VAL  34          1HG1      VAL  34   6.155   5.299   6.749
  229   HG12  VAL  34          2HG1      VAL  34   6.360   3.765   7.597
  230   HG13  VAL  34          3HG1      VAL  34   7.464   5.104   7.915
  231   HG21  VAL  34          3HG2      VAL  34   6.968   3.412   4.203
  232   HG22  VAL  34          1HG2      VAL  34   7.715   2.157   5.191
  233   HG23  VAL  34          2HG2      VAL  34   6.142   2.815   5.642
  234    H    HIS  35           H        HIS  35   8.080   4.503   2.757
  235    HA   HIS  35           HA       HIS  35  10.896   3.701   2.595
  236    HB2  HIS  35           1HB      HIS  35   8.697   3.101   0.613
  237    HB3  HIS  35           2HB      HIS  35  10.279   2.334   0.722
  238    HD1  HIS  35           HD1      HIS  35  10.336   1.665   3.718
  239    HD2  HIS  35           HD2      HIS  35   7.050   1.034   1.255
  240    HE1  HIS  35           HE1      HIS  35   8.985  -0.131   4.846
  241    H    SER  36           H        SER  36  11.711   5.842   2.362
  242    HA   SER  36           HA       SER  36  11.149   7.053  -0.266
  243    HB2  SER  36           1HB      SER  36  10.484   8.499   1.613
  244    HB3  SER  36           2HB      SER  36  12.124   8.416   2.257
  245    HG   SER  36           HG       SER  36  11.290  10.215   0.666
  246    H    GLY  37           H        GLY  37  12.756   7.039  -1.691
  247    HA2  GLY  37           1HA      GLY  37  15.508   6.688  -0.669
  248    HA3  GLY  37           2HA      GLY  37  14.923   5.907  -2.130
  249    H    GLU  38           H        GLU  38  16.350   8.703  -0.793
  250    HA   GLU  38           HA       GLU  38  16.515   9.881  -3.471
  251    HB2  GLU  38           1HB      GLU  38  15.713  11.350  -0.957
  252    HB3  GLU  38           2HB      GLU  38  16.225  12.155  -2.434
  253    HG2  GLU  38           1HG      GLU  38  14.327  10.676  -3.499
  254    HG3  GLU  38           2HG      GLU  38  13.714  10.684  -1.846
  255    H    LYS  39           H        LYS  39  18.374  11.121  -3.856
  256    HA   LYS  39           HA       LYS  39  20.295  11.750  -1.881
  257    HB2  LYS  39           1HB      LYS  39  22.057  10.133  -2.590
  258    HB3  LYS  39           2HB      LYS  39  20.703   9.383  -1.753
  259    HG2  LYS  39           1HG      LYS  39  20.974   7.919  -3.476
  260    HG3  LYS  39           2HG      LYS  39  19.809   9.031  -4.200
  261    HD2  LYS  39           1HD      LYS  39  21.376   9.978  -5.593
  262    HD3  LYS  39           2HD      LYS  39  22.723   9.576  -4.525
  263    HE2  LYS  39           1HE      LYS  39  21.200   7.346  -5.767
  264    HE3  LYS  39           2HE      LYS  39  22.293   8.274  -6.792
  265    HZ1  LYS  39           3HZ      LYS  39  22.925   6.599  -4.453
  266    HZ2  LYS  39           1HZ      LYS  39  23.969   7.853  -4.902
  267    HZ3  LYS  39           2HZ      LYS  39  23.636   6.600  -5.988
  268    HA   PRO  40           HA       PRO  40  21.712  14.309  -5.157
  269    HB2  PRO  40           1HB      PRO  40  24.274  14.757  -4.380
  270    HB3  PRO  40           2HB      PRO  40  22.883  15.482  -3.566
  271    HG2  PRO  40           1HG      PRO  40  24.490  13.079  -2.790
  272    HG3  PRO  40           2HG      PRO  40  23.882  14.396  -1.769
  273    HD2  PRO  40           1HD      PRO  40  22.660  11.984  -1.918
  274    HD3  PRO  40           2HD      PRO  40  21.765  13.494  -1.650
  275    H    SER  41           H        SER  41  23.895  14.572  -6.519
  276    HA   SER  41           HA       SER  41  24.031  12.451  -8.283
  277    HB2  SER  41           1HB      SER  41  26.165  14.522  -7.713
  278    HB3  SER  41           2HB      SER  41  26.098  13.501  -9.149
  279    HG   SER  41           HG       SER  41  25.173  15.640  -9.398
  280    H    GLY  42           H        GLY  42  26.156  13.176  -5.537
  281    HA2  GLY  42           1HA      GLY  42  26.796  10.386  -5.235
  282    HA3  GLY  42           2HA      GLY  42  28.148  11.341  -5.824
  283    HA   PRO  43           HA       PRO  43  26.993  12.820  -1.331
  284    HB2  PRO  43           1HB      PRO  43  25.700  10.950   0.154
  285    HB3  PRO  43           2HB      PRO  43  24.853  12.177  -0.796
  286    HG2  PRO  43           1HG      PRO  43  25.406   9.312  -1.465
  287    HG3  PRO  43           2HG      PRO  43  23.918  10.249  -1.699
  288    HD2  PRO  43           1HD      PRO  43  25.663   9.759  -3.710
  289    HD3  PRO  43           2HD      PRO  43  24.702  11.249  -3.622
  290    H    SER  44           H        SER  44  28.610  12.656   0.113
  291    HA   SER  44           HA       SER  44  29.591  10.250   1.199
  292    HB2  SER  44           1HB      SER  44  30.457  10.328  -1.299
  293    HB3  SER  44           2HB      SER  44  31.658  11.424  -0.616
  294    HG   SER  44           HG       SER  44  32.247   9.150  -0.613
  295    H    SER  45           H        SER  45  30.028  10.986   3.163
  296    HA   SER  45           HA       SER  45  30.605  12.428   4.853
  297    HB2  SER  45           1HB      SER  45  32.996  13.059   4.792
  298    HB3  SER  45           2HB      SER  45  32.749  11.378   4.319
  299    HG   SER  45           HG       SER  45  33.510  13.579   2.767
  300    H    GLY  46           H        GLY  46  28.940  13.723   3.058
  301    HA2  GLY  46           1HA      GLY  46  30.159  16.399   2.799
  302    HA3  GLY  46           2HA      GLY  46  28.815  15.815   1.828
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1   3.439 -27.811  -2.431
    2    HA2  GLY   1           1HA      GLY   1   4.395 -27.551  -0.255
    3    HA3  GLY   1           2HA      GLY   1   5.610 -26.490  -0.953
    4    H    SER   2           H        SER   2   2.255 -26.737   0.056
    5    HA   SER   2           HA       SER   2   1.343 -24.196  -0.544
    6    HB2  SER   2           1HB      SER   2  -0.199 -25.825   0.298
    7    HB3  SER   2           2HB      SER   2   0.705 -25.992   1.803
    8    HG   SER   2           HG       SER   2  -0.222 -23.450   1.146
    9    H    SER   3           H        SER   3   3.073 -25.284   2.361
   10    HA   SER   3           HA       SER   3   4.007 -24.117   4.095
   11    HB2  SER   3           1HB      SER   3   5.650 -23.789   2.266
   12    HB3  SER   3           2HB      SER   3   4.830 -22.293   1.822
   13    HG   SER   3           HG       SER   3   6.409 -22.868   4.060
   14    H    GLY   4           H        GLY   4   1.306 -23.526   3.859
   15    HA2  GLY   4           1HA      GLY   4   0.761 -21.531   5.521
   16    HA3  GLY   4           2HA      GLY   4   1.039 -20.627   4.040
   17    H    SER   5           H        SER   5  -0.660 -23.664   4.818
   18    HA   SER   5           HA       SER   5  -2.824 -22.898   3.042
   19    HB2  SER   5           1HB      SER   5  -2.037 -25.206   2.969
   20    HB3  SER   5           2HB      SER   5  -2.389 -25.404   4.686
   21    HG   SER   5           HG       SER   5  -4.176 -25.139   2.524
   22    H    SER   6           H        SER   6  -2.358 -23.606   6.484
   23    HA   SER   6           HA       SER   6  -5.096 -22.873   7.097
   24    HB2  SER   6           1HB      SER   6  -4.467 -23.410   9.431
   25    HB3  SER   6           2HB      SER   6  -4.085 -24.728   8.323
   26    HG   SER   6           HG       SER   6  -2.450 -23.532   9.979
   27    H    GLY   7           H        GLY   7  -5.757 -21.057   8.196
   28    HA2  GLY   7           1HA      GLY   7  -5.042 -19.161   9.649
   29    HA3  GLY   7           2HA      GLY   7  -3.704 -18.957   8.529
   30    H    THR   8           H        THR   8  -5.787 -17.056   9.321
   31    HA   THR   8           HA       THR   8  -6.912 -16.528   6.648
   32    HB   THR   8           HB       THR   8  -8.223 -15.753   9.259
   33    HG1  THR   8           HG1      THR   8  -9.339 -17.581   9.149
   34   HG21  THR   8          3HG2      THR   8  -9.305 -15.765   6.440
   35   HG22  THR   8          1HG2      THR   8  -8.722 -14.331   7.284
   36   HG23  THR   8          2HG2      THR   8 -10.134 -15.197   7.889
   37    H    GLY   9           H        GLY   9  -5.920 -14.830   5.782
   38    HA2  GLY   9           1HA      GLY   9  -5.940 -12.269   6.890
   39    HA3  GLY   9           2HA      GLY   9  -4.372 -12.976   7.248
   40    H    GLU  10           H        GLU  10  -6.559 -12.020   4.661
   41    HA   GLU  10           HA       GLU  10  -4.254 -11.438   2.981
   42    HB2  GLU  10           1HB      GLU  10  -4.889 -13.743   2.381
   43    HB3  GLU  10           2HB      GLU  10  -6.524 -13.197   2.035
   44    HG2  GLU  10           1HG      GLU  10  -5.682 -11.785   0.236
   45    HG3  GLU  10           2HG      GLU  10  -4.037 -12.312   0.588
   46    H    LYS  11           H        LYS  11  -4.507  -9.425   2.307
   47    HA   LYS  11           HA       LYS  11  -7.230  -8.466   1.713
   48    HB2  LYS  11           1HB      LYS  11  -4.985  -7.178   3.205
   49    HB3  LYS  11           2HB      LYS  11  -6.067  -6.157   2.267
   50    HG2  LYS  11           1HG      LYS  11  -6.965  -6.154   4.420
   51    HG3  LYS  11           2HG      LYS  11  -7.966  -7.300   3.525
   52    HD2  LYS  11           1HD      LYS  11  -7.535  -8.411   5.525
   53    HD3  LYS  11           2HD      LYS  11  -6.335  -9.086   4.421
   54    HE2  LYS  11           1HE      LYS  11  -5.234  -8.600   6.481
   55    HE3  LYS  11           2HE      LYS  11  -4.704  -7.406   5.297
   56    HZ1  LYS  11           3HZ      LYS  11  -6.760  -6.989   7.400
   57    HZ2  LYS  11           1HZ      LYS  11  -6.318  -5.846   6.233
   58    HZ3  LYS  11           2HZ      LYS  11  -5.194  -6.349   7.392
   59    HA   PRO  12           HA       PRO  12  -5.888  -7.347  -2.312
   60    HB2  PRO  12           1HB      PRO  12  -7.291  -5.065  -2.752
   61    HB3  PRO  12           2HB      PRO  12  -8.043  -6.664  -2.725
   62    HG2  PRO  12           1HG      PRO  12  -7.936  -4.585  -0.574
   63    HG3  PRO  12           2HG      PRO  12  -9.299  -5.599  -1.083
   64    HD2  PRO  12           1HD      PRO  12  -7.808  -6.156   1.107
   65    HD3  PRO  12           2HD      PRO  12  -8.551  -7.423   0.111
   66    H    TYR  13           H        TYR  13  -4.910  -5.681   0.360
   67    HA   TYR  13           HA       TYR  13  -3.245  -3.852  -1.244
   68    HB2  TYR  13           1HB      TYR  13  -4.225  -3.380   1.579
   69    HB3  TYR  13           2HB      TYR  13  -3.262  -2.273   0.607
   70    HD1  TYR  13           HD2      TYR  13  -4.278  -1.100  -1.308
   71    HD2  TYR  13           HD1      TYR  13  -6.595  -3.581   1.258
   72    HE1  TYR  13           HE2      TYR  13  -6.335  -0.077  -2.186
   73    HE2  TYR  13           HE1      TYR  13  -8.658  -2.565   0.386
   74    HH   TYR  13           HH       TYR  13  -9.095  -1.206  -2.186
   75    H    GLU  14           H        GLU  14  -1.089  -3.895  -0.905
   76    HA   GLU  14           HA       GLU  14   0.097  -4.944   1.476
   77    HB2  GLU  14           1HB      GLU  14  -0.624  -7.006   0.172
   78    HB3  GLU  14           2HB      GLU  14   0.571  -6.547  -1.034
   79    HG2  GLU  14           1HG      GLU  14   2.276  -6.588   0.830
   80    HG3  GLU  14           2HG      GLU  14   1.036  -7.359   1.818
   81    H    CYS  15           H        CYS  15   2.226  -4.362   1.674
   82    HA   CYS  15           HA       CYS  15   3.193  -2.428  -0.240
   83    HB2  CYS  15           1HB      CYS  15   3.363  -2.303   2.337
   84    HB3  CYS  15           2HB      CYS  15   4.725  -3.404   2.158
   85    H    ASP  16           H        ASP  16   4.535  -2.832  -1.862
   86    HA   ASP  16           HA       ASP  16   5.672  -5.471  -2.175
   87    HB2  ASP  16           1HB      ASP  16   4.625  -4.053  -4.035
   88    HB3  ASP  16           2HB      ASP  16   6.117  -3.117  -4.004
   89    H    VAL  17           H        VAL  17   6.635  -3.407  -0.133
   90    HA   VAL  17           HA       VAL  17   9.483  -3.477  -0.893
   91    HB   VAL  17           HB       VAL  17   8.089  -1.474   0.889
   92   HG11  VAL  17          1HG1      VAL  17  10.335  -1.944   1.687
   93   HG12  VAL  17          2HG1      VAL  17  10.986  -1.676   0.068
   94   HG13  VAL  17          3HG1      VAL  17  10.265  -0.338   0.963
   95   HG21  VAL  17          3HG2      VAL  17   8.046  -0.016  -0.839
   96   HG22  VAL  17          1HG2      VAL  17   9.545  -0.630  -1.535
   97   HG23  VAL  17          2HG2      VAL  17   8.031  -1.494  -1.800
   98    H    CYS  18           H        CYS  18   7.273  -3.506   1.898
   99    HA   CYS  18           HA       CYS  18   9.257  -5.140   3.340
  100    HB2  CYS  18           1HB      CYS  18   8.139  -4.327   5.420
  101    HB3  CYS  18           2HB      CYS  18   8.910  -3.049   4.486
  102    H    ARG  19           H        ARG  19   6.389  -5.306   1.716
  103    HA   ARG  19           HA       ARG  19   4.752  -6.876   1.544
  104    HB2  ARG  19           1HB      ARG  19   6.747  -8.417   3.200
  105    HB3  ARG  19           2HB      ARG  19   5.239  -9.122   2.635
  106    HG2  ARG  19           1HG      ARG  19   6.726  -9.802   1.019
  107    HG3  ARG  19           2HG      ARG  19   6.047  -8.341   0.297
  108    HD2  ARG  19           1HD      ARG  19   8.320  -8.059  -0.041
  109    HD3  ARG  19           2HD      ARG  19   8.036  -7.145   1.440
  110    HE   ARG  19           HE       ARG  19   9.364  -8.628   2.564
  111   HH11  ARG  19          1HH1      ARG  19   8.432 -10.025  -0.485
  112   HH12  ARG  19          2HH1      ARG  19   9.478 -11.397  -0.326
  113   HH21  ARG  19          1HH2      ARG  19  10.747 -10.429   2.786
  114   HH22  ARG  19          2HH2      ARG  19  10.794 -11.626   1.536
  115    H    LYS  20           H        LYS  20   4.033  -4.961   3.194
  116    HA   LYS  20           HA       LYS  20   3.106  -6.201   5.686
  117    HB2  LYS  20           1HB      LYS  20   4.317  -3.897   5.537
  118    HB3  LYS  20           2HB      LYS  20   2.751  -3.300   5.006
  119    HG2  LYS  20           1HG      LYS  20   1.764  -3.665   7.049
  120    HG3  LYS  20           2HG      LYS  20   2.926  -4.912   7.507
  121    HD2  LYS  20           1HD      LYS  20   4.630  -2.917   7.400
  122    HD3  LYS  20           2HD      LYS  20   3.177  -1.940   7.623
  123    HE2  LYS  20           1HE      LYS  20   4.213  -2.430   9.765
  124    HE3  LYS  20           2HE      LYS  20   2.640  -3.217   9.646
  125    HZ1  LYS  20           3HZ      LYS  20   4.825  -4.853   8.734
  126    HZ2  LYS  20           1HZ      LYS  20   3.560  -5.229   9.793
  127    HZ3  LYS  20           2HZ      LYS  20   4.937  -4.436  10.370
  128    H    ALA  21           H        ALA  21   0.977  -6.482   6.146
  129    HA   ALA  21           HA       ALA  21  -0.902  -5.996   3.943
  130    HB1  ALA  21           3HB      ALA  21  -0.423  -8.262   5.456
  131    HB2  ALA  21           1HB      ALA  21  -1.926  -7.618   6.117
  132    HB3  ALA  21           2HB      ALA  21  -1.804  -7.982   4.395
  133    H    PHE  22           H        PHE  22  -2.775  -4.854   4.219
  134    HA   PHE  22           HA       PHE  22  -3.339  -3.746   6.875
  135    HB2  PHE  22           1HB      PHE  22  -3.354  -2.050   4.376
  136    HB3  PHE  22           2HB      PHE  22  -3.567  -1.511   6.038
  137    HD1  PHE  22           HD1      PHE  22  -1.117  -2.945   3.667
  138    HD2  PHE  22           HD2      PHE  22  -1.725  -0.929   7.366
  139    HE1  PHE  22           HE1      PHE  22   1.303  -2.530   3.834
  140    HE2  PHE  22           HE2      PHE  22   0.693  -0.510   7.538
  141    HZ   PHE  22           HZ       PHE  22   2.211  -1.309   5.771
  142    H    SER  23           H        SER  23  -5.488  -2.338   6.602
  143    HA   SER  23           HA       SER  23  -7.443  -4.207   5.504
  144    HB2  SER  23           1HB      SER  23  -7.819  -1.794   7.295
  145    HB3  SER  23           2HB      SER  23  -9.090  -2.920   6.819
  146    HG   SER  23           HG       SER  23  -8.178  -4.485   8.034
  147    H    HIS  24           H        HIS  24  -7.013  -0.664   5.568
  148    HA   HIS  24           HA       HIS  24  -8.508  -0.502   3.047
  149    HB2  HIS  24           1HB      HIS  24  -8.980   0.912   5.233
  150    HB3  HIS  24           2HB      HIS  24  -7.694   1.927   4.587
  151    HD1  HIS  24           HD1      HIS  24  -9.320   3.869   4.117
  152    HD2  HIS  24           HD2      HIS  24 -10.263   0.355   2.111
  153    HE1  HIS  24           HE1      HIS  24 -11.039   4.516   2.399
  154    H    HIS  25           H        HIS  25  -7.715   1.497   1.686
  155    HA   HIS  25           HA       HIS  25  -5.048   0.848   0.843
  156    HB2  HIS  25           1HB      HIS  25  -5.439   2.361  -0.986
  157    HB3  HIS  25           2HB      HIS  25  -6.907   1.422  -0.733
  158    HD1  HIS  25           HD1      HIS  25  -5.843   4.770  -1.305
  159    HD2  HIS  25           HD2      HIS  25  -8.820   3.003   0.993
  160    HE1  HIS  25           HE1      HIS  25  -7.501   6.600  -0.829
  161    H    ALA  26           H        ALA  26  -6.610   3.825   2.029
  162    HA   ALA  26           HA       ALA  26  -4.608   5.611   2.080
  163    HB1  ALA  26           3HB      ALA  26  -6.083   5.334   4.645
  164    HB2  ALA  26           1HB      ALA  26  -5.763   6.770   3.671
  165    HB3  ALA  26           2HB      ALA  26  -7.011   5.626   3.174
  166    H    SER  27           H        SER  27  -4.943   2.897   4.316
  167    HA   SER  27           HA       SER  27  -2.855   3.565   6.063
  168    HB2  SER  27           1HB      SER  27  -2.914   1.239   6.768
  169    HB3  SER  27           2HB      SER  27  -4.562   1.809   6.505
  170    HG   SER  27           HG       SER  27  -4.638   0.036   5.343
  171    H    LEU  28           H        LEU  28  -2.852   1.440   3.208
  172    HA   LEU  28           HA       LEU  28  -0.071   0.894   3.315
  173    HB2  LEU  28           1HB      LEU  28  -1.402  -0.652   2.152
  174    HB3  LEU  28           2HB      LEU  28  -2.165   0.608   1.185
  175    HG   LEU  28           HG       LEU  28  -0.052   0.929  -0.033
  176   HD11  LEU  28          1HD1      LEU  28   1.430   0.182   1.814
  177   HD12  LEU  28          2HD1      LEU  28   1.804  -0.558   0.258
  178   HD13  LEU  28          3HD1      LEU  28   0.935  -1.479   1.486
  179   HD21  LEU  28          3HD2      LEU  28  -0.061  -1.287  -1.198
  180   HD22  LEU  28          1HD2      LEU  28  -1.649  -0.539  -1.022
  181   HD23  LEU  28          2HD2      LEU  28  -1.177  -1.865   0.041
  182    H    THR  29           H        THR  29  -2.016   3.204   1.462
  183    HA   THR  29           HA       THR  29   0.041   4.256  -0.121
  184    HB   THR  29           HB       THR  29  -2.583   5.377   0.819
  185    HG1  THR  29           HG1      THR  29  -2.822   5.322  -1.578
  186   HG21  THR  29          3HG2      THR  29  -1.766   7.081  -1.176
  187   HG22  THR  29          1HG2      THR  29  -0.297   6.870  -0.223
  188   HG23  THR  29          2HG2      THR  29  -1.773   7.452   0.548
  189    H    GLN  30           H        GLN  30  -1.277   5.452   2.967
  190    HA   GLN  30           HA       GLN  30   0.553   7.586   3.230
  191    HB2  GLN  30           1HB      GLN  30  -1.341   6.177   5.055
  192    HB3  GLN  30           2HB      GLN  30  -0.125   7.230   5.766
  193    HG2  GLN  30           1HG      GLN  30  -2.288   7.968   3.818
  194    HG3  GLN  30           2HG      GLN  30  -2.095   8.510   5.484
  195   HE21  GLN  30          1HE2      GLN  30  -0.286   9.891   5.970
  196   HE22  GLN  30          2HE2      GLN  30   0.345  10.938   4.749
  197    H    HIS  31           H        HIS  31   0.680   4.209   4.132
  198    HA   HIS  31           HA       HIS  31   2.857   4.335   5.912
  199    HB2  HIS  31           1HB      HIS  31   1.783   2.302   6.036
  200    HB3  HIS  31           2HB      HIS  31   1.563   2.190   4.292
  201    HD1  HIS  31           HD1      HIS  31   4.016   1.443   7.012
  202    HD2  HIS  31           HD2      HIS  31   3.675   0.997   2.895
  203    HE1  HIS  31           HE1      HIS  31   5.884  -0.103   6.346
  204    H    GLN  32           H        GLN  32   2.790   3.446   2.458
  205    HA   GLN  32           HA       GLN  32   5.369   2.979   1.891
  206    HB2  GLN  32           1HB      GLN  32   3.452   4.698   0.317
  207    HB3  GLN  32           2HB      GLN  32   5.003   4.159  -0.312
  208    HG2  GLN  32           1HG      GLN  32   4.180   1.795   0.234
  209    HG3  GLN  32           2HG      GLN  32   2.584   2.531   0.364
  210   HE21  GLN  32          1HE2      GLN  32   1.899   1.258  -1.400
  211   HE22  GLN  32          2HE2      GLN  32   2.321   1.677  -3.021
  212    H    ARG  33           H        ARG  33   4.014   6.108   2.696
  213    HA   ARG  33           HA       ARG  33   5.862   7.913   1.911
  214    HB2  ARG  33           1HB      ARG  33   4.693   7.778   4.697
  215    HB3  ARG  33           2HB      ARG  33   5.366   9.209   3.928
  216    HG2  ARG  33           1HG      ARG  33   3.136   7.789   2.571
  217    HG3  ARG  33           2HG      ARG  33   2.778   8.775   3.990
  218    HD2  ARG  33           1HD      ARG  33   3.335  10.728   2.944
  219    HD3  ARG  33           2HD      ARG  33   4.503   9.950   1.878
  220    HE   ARG  33           HE       ARG  33   1.931   9.060   1.204
  221   HH11  ARG  33          1HH1      ARG  33   3.874  11.947   1.091
  222   HH12  ARG  33          2HH1      ARG  33   3.064  12.593  -0.298
  223   HH21  ARG  33          1HH2      ARG  33   0.858   9.901  -0.625
  224   HH22  ARG  33          2HH2      ARG  33   1.349  11.429  -1.272
  225    H    VAL  34           H        VAL  34   6.184   5.751   4.705
  226    HA   VAL  34           HA       VAL  34   8.541   6.662   5.792
  227    HB   VAL  34           HB       VAL  34   8.917   4.435   6.666
  228   HG11  VAL  34          1HG1      VAL  34   6.116   5.468   6.587
  229   HG12  VAL  34          2HG1      VAL  34   6.471   3.959   7.431
  230   HG13  VAL  34          3HG1      VAL  34   7.270   5.453   7.920
  231   HG21  VAL  34          3HG2      VAL  34   6.907   3.571   4.593
  232   HG22  VAL  34          1HG2      VAL  34   8.598   3.086   4.719
  233   HG23  VAL  34          2HG2      VAL  34   7.435   2.557   5.936
  234    H    HIS  35           H        HIS  35   8.141   4.376   3.104
  235    HA   HIS  35           HA       HIS  35  10.961   4.070   2.698
  236    HB2  HIS  35           1HB      HIS  35   8.747   3.399   0.756
  237    HB3  HIS  35           2HB      HIS  35  10.374   2.726   0.796
  238    HD1  HIS  35           HD1      HIS  35  10.746   1.707   3.526
  239    HD2  HIS  35           HD2      HIS  35   7.060   1.488   1.622
  240    HE1  HIS  35           HE1      HIS  35   9.492  -0.131   4.698
  241    H    SER  36           H        SER  36  11.882   4.494   0.445
  242    HA   SER  36           HA       SER  36  10.907   7.040  -0.647
  243    HB2  SER  36           1HB      SER  36  12.779   7.481   0.941
  244    HB3  SER  36           2HB      SER  36  13.817   6.458  -0.051
  245    HG   SER  36           HG       SER  36  14.075   8.630  -0.624
  246    H    GLY  37           H        GLY  37  11.012   7.218  -2.828
  247    HA2  GLY  37           1HA      GLY  37  11.434   4.869  -4.367
  248    HA3  GLY  37           2HA      GLY  37  11.127   6.479  -5.002
  249    H    GLU  38           H        GLU  38  13.294   7.885  -4.065
  250    HA   GLU  38           HA       GLU  38  15.532   6.521  -5.413
  251    HB2  GLU  38           1HB      GLU  38  14.775   9.441  -5.344
  252    HB3  GLU  38           2HB      GLU  38  16.342   8.873  -5.903
  253    HG2  GLU  38           1HG      GLU  38  13.903   7.686  -7.112
  254    HG3  GLU  38           2HG      GLU  38  14.356   9.327  -7.568
  255    H    LYS  39           H        LYS  39  17.513   6.494  -4.456
  256    HA   LYS  39           HA       LYS  39  17.703   7.718  -1.781
  257    HB2  LYS  39           1HB      LYS  39  17.647   5.395  -1.406
  258    HB3  LYS  39           2HB      LYS  39  18.664   5.057  -2.801
  259    HG2  LYS  39           1HG      LYS  39  20.582   6.021  -1.656
  260    HG3  LYS  39           2HG      LYS  39  19.567   6.404  -0.263
  261    HD2  LYS  39           1HD      LYS  39  19.384   4.200   0.380
  262    HD3  LYS  39           2HD      LYS  39  19.674   3.591  -1.251
  263    HE2  LYS  39           1HE      LYS  39  21.789   4.977   0.381
  264    HE3  LYS  39           2HE      LYS  39  21.533   3.233   0.430
  265    HZ1  LYS  39           3HZ      LYS  39  22.174   4.798  -2.011
  266    HZ2  LYS  39           1HZ      LYS  39  21.978   3.120  -1.929
  267    HZ3  LYS  39           2HZ      LYS  39  23.276   3.860  -1.136
  268    HA   PRO  40           HA       PRO  40  21.134   9.974  -3.414
  269    HB2  PRO  40           1HB      PRO  40  22.155  10.835  -1.050
  270    HB3  PRO  40           2HB      PRO  40  20.693  11.518  -1.771
  271    HG2  PRO  40           1HG      PRO  40  20.957   9.476   0.402
  272    HG3  PRO  40           2HG      PRO  40  19.857  10.862   0.298
  273    HD2  PRO  40           1HD      PRO  40  19.073   8.334  -0.274
  274    HD3  PRO  40           2HD      PRO  40  18.390   9.754  -1.092
  275    H    SER  41           H        SER  41  22.210   8.025  -4.179
  276    HA   SER  41           HA       SER  41  23.887   6.480  -2.481
  277    HB2  SER  41           1HB      SER  41  24.044   6.806  -5.487
  278    HB3  SER  41           2HB      SER  41  24.753   5.500  -4.537
  279    HG   SER  41           HG       SER  41  21.991   6.014  -4.394
  280    H    GLY  42           H        GLY  42  25.203   7.897  -1.323
  281    HA2  GLY  42           1HA      GLY  42  27.476   8.927  -2.870
  282    HA3  GLY  42           2HA      GLY  42  26.628  10.029  -1.794
  283    HA   PRO  43           HA       PRO  43  30.073   7.676   0.430
  284    HB2  PRO  43           1HB      PRO  43  31.686   9.808   0.899
  285    HB3  PRO  43           2HB      PRO  43  31.813   8.809  -0.554
  286    HG2  PRO  43           1HG      PRO  43  30.467  11.458  -0.188
  287    HG3  PRO  43           2HG      PRO  43  31.488  10.897  -1.525
  288    HD2  PRO  43           1HD      PRO  43  28.785  10.946  -1.678
  289    HD3  PRO  43           2HD      PRO  43  29.767   9.727  -2.515
  290    H    SER  44           H        SER  44  28.559  10.823   0.956
  291    HA   SER  44           HA       SER  44  28.950  10.734   3.810
  292    HB2  SER  44           1HB      SER  44  27.909  12.854   3.875
  293    HB3  SER  44           2HB      SER  44  28.795  12.844   2.350
  294    HG   SER  44           HG       SER  44  26.076  12.890   2.821
  295    H    SER  45           H        SER  45  27.730   8.415   3.115
  296    HA   SER  45           HA       SER  45  25.098   8.724   4.368
  297    HB2  SER  45           1HB      SER  45  23.977   7.378   2.782
  298    HB3  SER  45           2HB      SER  45  24.944   8.492   1.815
  299    HG   SER  45           HG       SER  45  25.682   6.732   0.939
  300    H    GLY  46           H        GLY  46  24.881   7.404   6.050
  301    HA2  GLY  46           1HA      GLY  46  26.481   4.921   6.086
  302    HA3  GLY  46           2HA      GLY  46  26.351   5.959   7.499
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -10.922 -33.620   8.760
    2    HA2  GLY   1           1HA      GLY   1 -11.059 -33.232   6.068
    3    HA3  GLY   1           2HA      GLY   1 -12.715 -32.983   6.600
    4    H    SER   2           H        SER   2 -10.064 -31.362   5.762
    5    HA   SER   2           HA       SER   2  -9.048 -29.383   6.397
    6    HB2  SER   2           1HB      SER   2 -10.706 -27.523   6.384
    7    HB3  SER   2           2HB      SER   2 -10.936 -28.658   5.054
    8    HG   SER   2           HG       SER   2 -12.334 -29.139   7.417
    9    H    SER   3           H        SER   3  -9.106 -31.015   8.618
   10    HA   SER   3           HA       SER   3 -10.281 -29.663  10.861
   11    HB2  SER   3           1HB      SER   3  -8.218 -31.878  10.779
   12    HB3  SER   3           2HB      SER   3  -9.091 -31.343  12.215
   13    HG   SER   3           HG       SER   3 -10.715 -32.520  11.614
   14    H    GLY   4           H        GLY   4  -9.429 -27.560  10.779
   15    HA2  GLY   4           1HA      GLY   4  -7.899 -26.229  12.096
   16    HA3  GLY   4           2HA      GLY   4  -6.639 -27.394  11.718
   17    H    SER   5           H        SER   5  -8.965 -25.501   9.786
   18    HA   SER   5           HA       SER   5  -6.704 -24.667   8.091
   19    HB2  SER   5           1HB      SER   5  -8.636 -26.071   7.106
   20    HB3  SER   5           2HB      SER   5  -9.590 -24.594   7.232
   21    HG   SER   5           HG       SER   5  -7.409 -25.178   5.583
   22    H    SER   6           H        SER   6  -6.322 -22.545   7.752
   23    HA   SER   6           HA       SER   6  -8.295 -20.532   8.374
   24    HB2  SER   6           1HB      SER   6  -5.740 -20.679   9.992
   25    HB3  SER   6           2HB      SER   6  -6.929 -19.380  10.062
   26    HG   SER   6           HG       SER   6  -7.780 -20.573  11.571
   27    H    GLY   7           H        GLY   7  -7.364 -18.292   8.020
   28    HA2  GLY   7           1HA      GLY   7  -5.095 -18.317   6.151
   29    HA3  GLY   7           2HA      GLY   7  -6.628 -17.641   5.620
   30    H    THR   8           H        THR   8  -3.715 -16.721   6.530
   31    HA   THR   8           HA       THR   8  -4.712 -14.272   7.824
   32    HB   THR   8           HB       THR   8  -2.575 -14.145   9.099
   33    HG1  THR   8           HG1      THR   8  -1.676 -16.497   9.248
   34   HG21  THR   8          3HG2      THR   8  -3.201 -15.737  10.810
   35   HG22  THR   8          1HG2      THR   8  -4.156 -16.659   9.650
   36   HG23  THR   8          2HG2      THR   8  -4.658 -15.032  10.111
   37    H    GLY   9           H        GLY   9  -3.904 -12.370   7.068
   38    HA2  GLY   9           1HA      GLY   9  -2.665 -10.908   5.787
   39    HA3  GLY   9           2HA      GLY   9  -1.490 -12.193   5.547
   40    H    GLU  10           H        GLU  10  -4.931 -12.169   4.705
   41    HA   GLU  10           HA       GLU  10  -4.138 -12.491   1.885
   42    HB2  GLU  10           1HB      GLU  10  -5.199 -14.491   2.997
   43    HB3  GLU  10           2HB      GLU  10  -6.666 -13.537   3.163
   44    HG2  GLU  10           1HG      GLU  10  -6.983 -14.841   1.248
   45    HG3  GLU  10           2HG      GLU  10  -6.586 -13.230   0.653
   46    H    LYS  11           H        LYS  11  -4.197 -10.194   1.619
   47    HA   LYS  11           HA       LYS  11  -6.895  -9.228   1.072
   48    HB2  LYS  11           1HB      LYS  11  -6.651  -7.185   2.258
   49    HB3  LYS  11           2HB      LYS  11  -6.205  -8.463   3.381
   50    HG2  LYS  11           1HG      LYS  11  -3.908  -7.966   3.190
   51    HG3  LYS  11           2HG      LYS  11  -4.173  -6.936   1.782
   52    HD2  LYS  11           1HD      LYS  11  -3.800  -5.517   3.671
   53    HD3  LYS  11           2HD      LYS  11  -5.511  -5.413   3.246
   54    HE2  LYS  11           1HE      LYS  11  -4.651  -7.425   5.269
   55    HE3  LYS  11           2HE      LYS  11  -4.736  -5.729   5.744
   56    HZ1  LYS  11           3HZ      LYS  11  -6.900  -7.542   4.937
   57    HZ2  LYS  11           1HZ      LYS  11  -7.071  -5.885   4.641
   58    HZ3  LYS  11           2HZ      LYS  11  -6.842  -6.442   6.221
   59    HA   PRO  12           HA       PRO  12  -5.043  -7.596  -2.560
   60    HB2  PRO  12           1HB      PRO  12  -6.664  -5.475  -3.053
   61    HB3  PRO  12           2HB      PRO  12  -7.173  -7.150  -3.296
   62    HG2  PRO  12           1HG      PRO  12  -7.725  -5.317  -0.995
   63    HG3  PRO  12           2HG      PRO  12  -8.825  -6.433  -1.825
   64    HD2  PRO  12           1HD      PRO  12  -7.658  -7.030   0.545
   65    HD3  PRO  12           2HD      PRO  12  -8.036  -8.267  -0.672
   66    H    TYR  13           H        TYR  13  -4.980  -5.957   0.374
   67    HA   TYR  13           HA       TYR  13  -3.438  -3.711  -0.726
   68    HB2  TYR  13           1HB      TYR  13  -4.414  -3.995   2.114
   69    HB3  TYR  13           2HB      TYR  13  -3.864  -2.535   1.301
   70    HD1  TYR  13           HD1      TYR  13  -6.641  -4.901   1.685
   71    HD2  TYR  13           HD2      TYR  13  -5.325  -1.318  -0.196
   72    HE1  TYR  13           HE1      TYR  13  -8.963  -4.381   1.063
   73    HE2  TYR  13           HE2      TYR  13  -7.644  -0.788  -0.821
   74    HH   TYR  13           HH       TYR  13  -9.978  -2.749  -1.058
   75    H    GLU  14           H        GLU  14  -1.322  -4.041  -0.799
   76    HA   GLU  14           HA       GLU  14   0.052  -5.035   1.564
   77    HB2  GLU  14           1HB      GLU  14  -0.044  -6.468  -1.052
   78    HB3  GLU  14           2HB      GLU  14   1.465  -6.477  -0.150
   79    HG2  GLU  14           1HG      GLU  14   0.309  -7.430   1.778
   80    HG3  GLU  14           2HG      GLU  14  -1.203  -7.423   0.873
   81    H    CYS  15           H        CYS  15   2.404  -4.718   1.434
   82    HA   CYS  15           HA       CYS  15   3.009  -2.303  -0.110
   83    HB2  CYS  15           1HB      CYS  15   3.332  -2.414   2.413
   84    HB3  CYS  15           2HB      CYS  15   4.676  -3.507   2.099
   85    H    ASP  16           H        ASP  16   4.813  -2.125  -1.426
   86    HA   ASP  16           HA       ASP  16   5.783  -4.649  -2.500
   87    HB2  ASP  16           1HB      ASP  16   4.971  -2.595  -3.870
   88    HB3  ASP  16           2HB      ASP  16   6.570  -1.938  -3.529
   89    H    VAL  17           H        VAL  17   6.655  -3.414   0.135
   90    HA   VAL  17           HA       VAL  17   9.541  -3.662  -0.365
   91    HB   VAL  17           HB       VAL  17   8.267  -1.627   1.469
   92   HG11  VAL  17          1HG1      VAL  17  11.195  -1.973   0.869
   93   HG12  VAL  17          2HG1      VAL  17  10.447  -0.944   2.092
   94   HG13  VAL  17          3HG1      VAL  17  10.408  -2.699   2.270
   95   HG21  VAL  17          3HG2      VAL  17   9.884  -1.245  -1.050
   96   HG22  VAL  17          1HG2      VAL  17   8.139  -1.028  -0.906
   97   HG23  VAL  17          2HG2      VAL  17   9.236   0.035  -0.023
   98    H    CYS  18           H        CYS  18   7.228  -3.344   2.337
   99    HA   CYS  18           HA       CYS  18   8.690  -5.470   3.741
  100    HB2  CYS  18           1HB      CYS  18   7.459  -4.655   5.760
  101    HB3  CYS  18           2HB      CYS  18   8.517  -3.447   5.036
  102    H    ARG  19           H        ARG  19   6.231  -5.295   1.685
  103    HA   ARG  19           HA       ARG  19   4.327  -6.480   1.266
  104    HB2  ARG  19           1HB      ARG  19   5.715  -8.545   2.984
  105    HB3  ARG  19           2HB      ARG  19   4.431  -8.853   1.823
  106    HG2  ARG  19           1HG      ARG  19   7.185  -7.822   1.175
  107    HG3  ARG  19           2HG      ARG  19   6.604  -9.470   0.926
  108    HD2  ARG  19           1HD      ARG  19   4.708  -8.190  -0.419
  109    HD3  ARG  19           2HD      ARG  19   5.983  -6.981  -0.572
  110    HE   ARG  19           HE       ARG  19   7.108  -8.386  -1.997
  111   HH11  ARG  19          1HH1      ARG  19   4.566 -10.145  -0.396
  112   HH12  ARG  19          2HH1      ARG  19   4.734 -11.552  -1.392
  113   HH21  ARG  19          1HH2      ARG  19   7.339 -10.233  -3.315
  114   HH22  ARG  19          2HH2      ARG  19   6.312 -11.601  -3.052
  115    H    LYS  20           H        LYS  20   4.146  -4.706   3.477
  116    HA   LYS  20           HA       LYS  20   2.732  -6.071   5.595
  117    HB2  LYS  20           1HB      LYS  20   4.174  -4.035   5.945
  118    HB3  LYS  20           2HB      LYS  20   2.941  -3.097   5.112
  119    HG2  LYS  20           1HG      LYS  20   1.358  -3.474   6.817
  120    HG3  LYS  20           2HG      LYS  20   2.341  -4.743   7.551
  121    HD2  LYS  20           1HD      LYS  20   3.291  -1.899   7.329
  122    HD3  LYS  20           2HD      LYS  20   2.339  -2.470   8.701
  123    HE2  LYS  20           1HE      LYS  20   4.852  -3.861   7.825
  124    HE3  LYS  20           2HE      LYS  20   4.891  -2.485   8.926
  125    HZ1  LYS  20           3HZ      LYS  20   4.520  -5.104   9.618
  126    HZ2  LYS  20           1HZ      LYS  20   2.970  -4.436   9.728
  127    HZ3  LYS  20           2HZ      LYS  20   4.246  -3.760  10.608
  128    H    ALA  21           H        ALA  21   0.599  -6.375   5.745
  129    HA   ALA  21           HA       ALA  21  -1.089  -5.412   3.570
  130    HB1  ALA  21           3HB      ALA  21  -1.435  -7.515   5.682
  131    HB2  ALA  21           1HB      ALA  21  -2.788  -6.956   4.697
  132    HB3  ALA  21           2HB      ALA  21  -1.386  -7.704   3.929
  133    H    PHE  22           H        PHE  22  -2.720  -3.977   3.794
  134    HA   PHE  22           HA       PHE  22  -3.291  -2.969   6.501
  135    HB2  PHE  22           1HB      PHE  22  -3.162  -1.265   4.007
  136    HB3  PHE  22           2HB      PHE  22  -3.398  -0.709   5.661
  137    HD1  PHE  22           HD1      PHE  22  -0.955  -2.367   3.420
  138    HD2  PHE  22           HD2      PHE  22  -1.575  -0.163   7.008
  139    HE1  PHE  22           HE1      PHE  22   1.478  -2.098   3.671
  140    HE2  PHE  22           HE2      PHE  22   0.856   0.111   7.264
  141    HZ   PHE  22           HZ       PHE  22   2.386  -0.856   5.594
  142    H    SER  23           H        SER  23  -5.386  -2.781   7.029
  143    HA   SER  23           HA       SER  23  -7.379  -3.961   5.437
  144    HB2  SER  23           1HB      SER  23  -7.755  -2.066   7.769
  145    HB3  SER  23           2HB      SER  23  -8.953  -3.196   7.138
  146    HG   SER  23           HG       SER  23  -6.889  -4.671   7.614
  147    H    HIS  24           H        HIS  24  -6.691  -0.549   6.151
  148    HA   HIS  24           HA       HIS  24  -8.613   0.242   4.081
  149    HB2  HIS  24           1HB      HIS  24  -8.677   1.263   6.411
  150    HB3  HIS  24           2HB      HIS  24  -7.168   2.072   5.998
  151    HD1  HIS  24           HD1      HIS  24  -9.951   3.493   6.596
  152    HD2  HIS  24           HD2      HIS  24  -8.290   2.801   2.850
  153    HE1  HIS  24           HE1      HIS  24 -10.992   5.201   5.072
  154    H    HIS  25           H        HIS  25  -7.905   0.761   2.128
  155    HA   HIS  25           HA       HIS  25  -5.467   0.562   1.072
  156    HB2  HIS  25           1HB      HIS  25  -7.659   1.315  -0.053
  157    HB3  HIS  25           2HB      HIS  25  -7.130   2.954   0.314
  158    HD1  HIS  25           HD1      HIS  25  -6.088  -0.071  -1.695
  159    HD2  HIS  25           HD2      HIS  25  -5.272   3.994  -1.417
  160    HE1  HIS  25           HE1      HIS  25  -4.641   0.462  -3.682
  161    H    ALA  26           H        ALA  26  -6.640   3.760   2.141
  162    HA   ALA  26           HA       ALA  26  -4.498   5.324   1.911
  163    HB1  ALA  26           3HB      ALA  26  -6.349   6.310   2.921
  164    HB2  ALA  26           1HB      ALA  26  -6.410   5.105   4.208
  165    HB3  ALA  26           2HB      ALA  26  -5.131   6.321   4.197
  166    H    SER  27           H        SER  27  -4.958   3.511   4.951
  167    HA   SER  27           HA       SER  27  -2.631   3.911   6.214
  168    HB2  SER  27           1HB      SER  27  -4.186   1.349   5.907
  169    HB3  SER  27           2HB      SER  27  -2.759   1.440   6.939
  170    HG   SER  27           HG       SER  27  -4.501   1.906   8.216
  171    H    LEU  28           H        LEU  28  -3.066   1.664   3.513
  172    HA   LEU  28           HA       LEU  28  -0.349   0.776   3.524
  173    HB2  LEU  28           1HB      LEU  28  -1.836  -0.752   2.602
  174    HB3  LEU  28           2HB      LEU  28  -2.667   0.482   1.657
  175    HG   LEU  28           HG       LEU  28  -0.692   0.618   0.171
  176   HD11  LEU  28          1HD1      LEU  28   0.586  -0.732   2.242
  177   HD12  LEU  28          2HD1      LEU  28   1.247  -0.349   0.653
  178   HD13  LEU  28          3HD1      LEU  28   0.472  -1.908   0.932
  179   HD21  LEU  28          3HD2      LEU  28  -1.319  -2.253   0.104
  180   HD22  LEU  28          1HD2      LEU  28  -1.509  -1.017  -1.139
  181   HD23  LEU  28          2HD2      LEU  28  -2.717  -1.178   0.137
  182    H    THR  29           H        THR  29  -2.196   3.149   1.667
  183    HA   THR  29           HA       THR  29  -0.139   3.819  -0.152
  184    HB   THR  29           HB       THR  29  -2.647   5.215   0.732
  185    HG1  THR  29           HG1      THR  29  -3.126   3.786  -0.817
  186   HG21  THR  29          3HG2      THR  29  -1.707   7.191   0.232
  187   HG22  THR  29          1HG2      THR  29  -1.788   6.652  -1.445
  188   HG23  THR  29          2HG2      THR  29  -0.303   6.434  -0.519
  189    H    GLN  30           H        GLN  30  -1.350   5.663   2.658
  190    HA   GLN  30           HA       GLN  30   0.618   7.615   2.683
  191    HB2  GLN  30           1HB      GLN  30  -1.334   7.883   4.041
  192    HB3  GLN  30           2HB      GLN  30  -0.981   6.415   4.943
  193    HG2  GLN  30           1HG      GLN  30   1.216   7.697   5.566
  194    HG3  GLN  30           2HG      GLN  30   0.252   9.113   5.151
  195   HE21  GLN  30          1HE2      GLN  30   1.206   7.246   7.634
  196   HE22  GLN  30          2HE2      GLN  30  -0.100   7.509   8.735
  197    H    HIS  31           H        HIS  31   0.610   4.418   4.187
  198    HA   HIS  31           HA       HIS  31   2.898   4.601   5.734
  199    HB2  HIS  31           1HB      HIS  31   1.809   2.611   6.087
  200    HB3  HIS  31           2HB      HIS  31   1.468   2.370   4.376
  201    HD1  HIS  31           HD1      HIS  31   4.156   1.854   6.946
  202    HD2  HIS  31           HD2      HIS  31   3.367   0.904   2.979
  203    HE1  HIS  31           HE1      HIS  31   5.912   0.175   6.294
  204    H    GLN  32           H        GLN  32   2.618   3.691   2.311
  205    HA   GLN  32           HA       GLN  32   5.063   2.932   1.576
  206    HB2  GLN  32           1HB      GLN  32   3.449   5.076   0.187
  207    HB3  GLN  32           2HB      GLN  32   4.786   4.199  -0.545
  208    HG2  GLN  32           1HG      GLN  32   2.117   3.125   0.312
  209    HG3  GLN  32           2HG      GLN  32   2.798   3.188  -1.313
  210   HE21  GLN  32          1HE2      GLN  32   5.011   2.029  -1.427
  211   HE22  GLN  32          2HE2      GLN  32   5.053   0.457  -0.712
  212    H    ARG  33           H        ARG  33   4.231   6.170   2.630
  213    HA   ARG  33           HA       ARG  33   6.338   7.696   1.860
  214    HB2  ARG  33           1HB      ARG  33   4.865   7.595   4.479
  215    HB3  ARG  33           2HB      ARG  33   6.146   8.768   4.203
  216    HG2  ARG  33           1HG      ARG  33   4.836   9.435   2.112
  217    HG3  ARG  33           2HG      ARG  33   3.500   8.524   2.819
  218    HD2  ARG  33           1HD      ARG  33   3.044  10.589   3.676
  219    HD3  ARG  33           2HD      ARG  33   4.107   9.976   4.942
  220    HE   ARG  33           HE       ARG  33   5.616  11.315   2.963
  221   HH11  ARG  33          1HH1      ARG  33   3.416  11.915   5.594
  222   HH12  ARG  33          2HH1      ARG  33   4.052  13.489   5.939
  223   HH21  ARG  33          1HH2      ARG  33   6.462  13.386   3.407
  224   HH22  ARG  33          2HH2      ARG  33   5.784  14.325   4.694
  225    H    VAL  34           H        VAL  34   6.314   5.713   4.827
  226    HA   VAL  34           HA       VAL  34   8.727   6.075   5.893
  227    HB   VAL  34           HB       VAL  34   8.849   3.695   6.491
  228   HG11  VAL  34          1HG1      VAL  34   6.351   3.547   7.295
  229   HG12  VAL  34          2HG1      VAL  34   7.445   4.765   7.955
  230   HG13  VAL  34          3HG1      VAL  34   6.290   5.205   6.696
  231   HG21  VAL  34          3HG2      VAL  34   6.769   2.347   5.610
  232   HG22  VAL  34          1HG2      VAL  34   6.904   3.459   4.248
  233   HG23  VAL  34          2HG2      VAL  34   8.264   2.420   4.676
  234    H    HIS  35           H        HIS  35   8.169   4.110   2.989
  235    HA   HIS  35           HA       HIS  35  11.013   3.686   2.622
  236    HB2  HIS  35           1HB      HIS  35   8.859   2.977   0.641
  237    HB3  HIS  35           2HB      HIS  35  10.434   2.221   0.862
  238    HD1  HIS  35           HD1      HIS  35  10.591   1.211   3.545
  239    HD2  HIS  35           HD2      HIS  35   6.923   1.374   1.601
  240    HE1  HIS  35           HE1      HIS  35   9.119  -0.437   4.746
  241    H    SER  36           H        SER  36  12.097   5.462   2.004
  242    HA   SER  36           HA       SER  36  11.188   7.655   0.627
  243    HB2  SER  36           1HB      SER  36  13.621   7.910  -0.130
  244    HB3  SER  36           2HB      SER  36  13.341   7.796   1.607
  245    HG   SER  36           HG       SER  36  13.637   5.336   0.744
  246    H    GLY  37           H        GLY  37  12.365   4.598  -0.682
  247    HA2  GLY  37           1HA      GLY  37  11.192   3.914  -2.772
  248    HA3  GLY  37           2HA      GLY  37  11.543   5.531  -3.364
  249    H    GLU  38           H        GLU  38  12.388   3.912  -5.094
  250    HA   GLU  38           HA       GLU  38  14.882   2.631  -4.586
  251    HB2  GLU  38           1HB      GLU  38  13.301   3.274  -7.051
  252    HB3  GLU  38           2HB      GLU  38  14.955   2.696  -7.197
  253    HG2  GLU  38           1HG      GLU  38  14.388   0.669  -6.006
  254    HG3  GLU  38           2HG      GLU  38  12.744   1.253  -5.753
  255    H    LYS  39           H        LYS  39  14.111   5.831  -4.763
  256    HA   LYS  39           HA       LYS  39  16.886   6.544  -5.376
  257    HB2  LYS  39           1HB      LYS  39  16.109   8.514  -6.669
  258    HB3  LYS  39           2HB      LYS  39  15.697   6.985  -7.434
  259    HG2  LYS  39           1HG      LYS  39  13.414   7.194  -6.449
  260    HG3  LYS  39           2HG      LYS  39  13.862   8.812  -5.902
  261    HD2  LYS  39           1HD      LYS  39  14.113   7.986  -8.780
  262    HD3  LYS  39           2HD      LYS  39  12.601   8.615  -8.121
  263    HE2  LYS  39           1HE      LYS  39  15.131  10.128  -7.665
  264    HE3  LYS  39           2HE      LYS  39  14.352  10.216  -9.244
  265    HZ1  LYS  39           3HZ      LYS  39  12.342  11.000  -8.193
  266    HZ2  LYS  39           1HZ      LYS  39  13.636  11.996  -7.751
  267    HZ3  LYS  39           2HZ      LYS  39  13.037  10.853  -6.658
  268    HA   PRO  40           HA       PRO  40  16.503   8.928  -1.693
  269    HB2  PRO  40           1HB      PRO  40  18.578  10.636  -2.078
  270    HB3  PRO  40           2HB      PRO  40  18.800   8.937  -1.642
  271    HG2  PRO  40           1HG      PRO  40  18.985  10.243  -4.329
  272    HG3  PRO  40           2HG      PRO  40  20.043   9.018  -3.605
  273    HD2  PRO  40           1HD      PRO  40  18.129   8.401  -5.418
  274    HD3  PRO  40           2HD      PRO  40  18.604   7.291  -4.117
  275    H    SER  41           H        SER  41  14.641  10.115  -1.768
  276    HA   SER  41           HA       SER  41  14.883  12.833  -2.823
  277    HB2  SER  41           1HB      SER  41  12.759  12.765  -3.946
  278    HB3  SER  41           2HB      SER  41  13.709  11.399  -4.529
  279    HG   SER  41           HG       SER  41  11.550  11.397  -2.707
  280    H    GLY  42           H        GLY  42  14.251  14.283  -1.365
  281    HA2  GLY  42           1HA      GLY  42  12.177  13.539   0.579
  282    HA3  GLY  42           2HA      GLY  42  13.724  14.123   1.173
  283    HA   PRO  43           HA       PRO  43  10.650  17.619   0.123
  284    HB2  PRO  43           1HB      PRO  43   9.824  18.215   2.639
  285    HB3  PRO  43           2HB      PRO  43   8.983  17.059   1.600
  286    HG2  PRO  43           1HG      PRO  43  10.934  16.548   3.812
  287    HG3  PRO  43           2HG      PRO  43   9.416  15.708   3.443
  288    HD2  PRO  43           1HD      PRO  43  11.838  14.711   2.755
  289    HD3  PRO  43           2HD      PRO  43  10.380  14.434   1.781
  290    H    SER  44           H        SER  44  10.726  19.871   1.217
  291    HA   SER  44           HA       SER  44  13.275  20.390   2.544
  292    HB2  SER  44           1HB      SER  44  13.760  22.248   0.926
  293    HB3  SER  44           2HB      SER  44  13.875  20.635   0.223
  294    HG   SER  44           HG       SER  44  12.571  21.474  -1.209
  295    H    SER  45           H        SER  45  12.936  21.705   4.199
  296    HA   SER  45           HA       SER  45  10.742  23.663   4.020
  297    HB2  SER  45           1HB      SER  45  11.564  22.024   6.428
  298    HB3  SER  45           2HB      SER  45  10.382  23.331   6.461
  299    HG   SER  45           HG       SER  45   9.495  21.884   4.580
  300    H    GLY  46           H        GLY  46  11.011  25.593   5.305
  301    HA2  GLY  46           1HA      GLY  46  12.856  26.546   6.908
  302    HA3  GLY  46           2HA      GLY  46  13.833  26.367   5.458
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1  -5.361 -30.746  14.471
    2    HA2  GLY   1           1HA      GLY   1  -5.542 -32.417  12.042
    3    HA3  GLY   1           2HA      GLY   1  -6.815 -31.289  12.484
    4    H    SER   2           H        SER   2  -6.055 -30.807  10.099
    5    HA   SER   2           HA       SER   2  -3.700 -29.186   9.865
    6    HB2  SER   2           1HB      SER   2  -6.020 -29.627   7.971
    7    HB3  SER   2           2HB      SER   2  -4.561 -28.723   7.567
    8    HG   SER   2           HG       SER   2  -4.968 -31.388   7.569
    9    H    SER   3           H        SER   3  -3.575 -27.217  10.698
   10    HA   SER   3           HA       SER   3  -5.971 -25.636  11.135
   11    HB2  SER   3           1HB      SER   3  -3.089 -24.971  11.785
   12    HB3  SER   3           2HB      SER   3  -4.518 -24.121  12.373
   13    HG   SER   3           HG       SER   3  -5.102 -25.966  13.515
   14    H    GLY   4           H        GLY   4  -2.891 -25.309   9.382
   15    HA2  GLY   4           1HA      GLY   4  -3.032 -24.445   7.083
   16    HA3  GLY   4           2HA      GLY   4  -4.212 -23.287   7.679
   17    H    SER   5           H        SER   5  -3.220 -21.387   7.274
   18    HA   SER   5           HA       SER   5  -0.885 -20.750   8.878
   19    HB2  SER   5           1HB      SER   5   0.412 -19.862   7.015
   20    HB3  SER   5           2HB      SER   5   0.058 -21.566   6.731
   21    HG   SER   5           HG       SER   5  -1.591 -20.937   5.319
   22    H    SER   6           H        SER   6  -0.955 -18.714   9.628
   23    HA   SER   6           HA       SER   6  -2.900 -16.871   8.398
   24    HB2  SER   6           1HB      SER   6  -3.333 -15.974  10.662
   25    HB3  SER   6           2HB      SER   6  -3.744 -17.685  10.545
   26    HG   SER   6           HG       SER   6  -1.954 -18.202  11.700
   27    H    GLY   7           H        GLY   7  -1.224 -15.930   7.145
   28    HA2  GLY   7           1HA      GLY   7  -0.175 -13.581   7.870
   29    HA3  GLY   7           2HA      GLY   7   1.015 -14.695   8.529
   30    H    THR   8           H        THR   8  -0.815 -14.983   5.513
   31    HA   THR   8           HA       THR   8   1.709 -14.677   4.029
   32    HB   THR   8           HB       THR   8  -0.424 -16.699   3.331
   33    HG1  THR   8           HG1      THR   8   1.228 -16.878   5.315
   34   HG21  THR   8          3HG2      THR   8   0.711 -17.016   1.439
   35   HG22  THR   8          1HG2      THR   8   2.224 -17.212   2.323
   36   HG23  THR   8          2HG2      THR   8   1.685 -15.603   1.843
   37    H    GLY   9           H        GLY   9  -0.162 -12.626   4.420
   38    HA2  GLY   9           1HA      GLY   9  -1.135 -10.971   3.149
   39    HA3  GLY   9           2HA      GLY   9  -0.658 -11.871   1.717
   40    H    GLU  10           H        GLU  10  -3.188 -11.240   4.003
   41    HA   GLU  10           HA       GLU  10  -5.002 -13.003   2.503
   42    HB2  GLU  10           1HB      GLU  10  -4.888 -13.445   4.914
   43    HB3  GLU  10           2HB      GLU  10  -5.335 -11.777   5.247
   44    HG2  GLU  10           1HG      GLU  10  -7.518 -12.085   4.465
   45    HG3  GLU  10           2HG      GLU  10  -7.105 -13.593   3.651
   46    H    LYS  11           H        LYS  11  -4.342  -9.716   3.384
   47    HA   LYS  11           HA       LYS  11  -6.908  -8.757   2.410
   48    HB2  LYS  11           1HB      LYS  11  -4.576  -7.557   3.818
   49    HB3  LYS  11           2HB      LYS  11  -5.567  -6.490   2.832
   50    HG2  LYS  11           1HG      LYS  11  -6.648  -6.264   4.811
   51    HG3  LYS  11           2HG      LYS  11  -7.521  -7.662   4.178
   52    HD2  LYS  11           1HD      LYS  11  -5.055  -8.174   5.751
   53    HD3  LYS  11           2HD      LYS  11  -6.485  -7.623   6.628
   54    HE2  LYS  11           1HE      LYS  11  -7.775  -9.463   5.590
   55    HE3  LYS  11           2HE      LYS  11  -6.294 -10.035   4.826
   56    HZ1  LYS  11           3HZ      LYS  11  -5.393 -10.654   6.857
   57    HZ2  LYS  11           1HZ      LYS  11  -7.016 -11.106   7.014
   58    HZ3  LYS  11           2HZ      LYS  11  -6.456  -9.691   7.753
   59    HA   PRO  12           HA       PRO  12  -5.636  -7.956  -1.718
   60    HB2  PRO  12           1HB      PRO  12  -7.201  -5.816  -2.305
   61    HB3  PRO  12           2HB      PRO  12  -7.836  -7.460  -2.159
   62    HG2  PRO  12           1HG      PRO  12  -7.869  -5.231  -0.160
   63    HG3  PRO  12           2HG      PRO  12  -9.158  -6.373  -0.585
   64    HD2  PRO  12           1HD      PRO  12  -7.623  -6.666   1.626
   65    HD3  PRO  12           2HD      PRO  12  -8.278  -8.050   0.728
   66    H    TYR  13           H        TYR  13  -5.021  -5.813   0.822
   67    HA   TYR  13           HA       TYR  13  -3.469  -4.017  -0.918
   68    HB2  TYR  13           1HB      TYR  13  -4.369  -3.568   1.935
   69    HB3  TYR  13           2HB      TYR  13  -3.524  -2.406   0.918
   70    HD1  TYR  13           HD1      TYR  13  -6.723  -4.092   1.541
   71    HD2  TYR  13           HD2      TYR  13  -4.686  -1.207  -0.832
   72    HE1  TYR  13           HE1      TYR  13  -8.883  -3.252   0.719
   73    HE2  TYR  13           HE2      TYR  13  -6.840  -0.358  -1.660
   74    HH   TYR  13           HH       TYR  13  -9.052  -0.736  -1.759
   75    H    GLU  14           H        GLU  14  -1.366  -4.399  -0.996
   76    HA   GLU  14           HA       GLU  14   0.024  -5.240   1.445
   77    HB2  GLU  14           1HB      GLU  14  -0.404  -7.258   0.083
   78    HB3  GLU  14           2HB      GLU  14   0.437  -6.510  -1.268
   79    HG2  GLU  14           1HG      GLU  14   2.471  -6.384   0.186
   80    HG3  GLU  14           2HG      GLU  14   1.600  -7.357   1.371
   81    H    CYS  15           H        CYS  15   2.186  -4.595   1.590
   82    HA   CYS  15           HA       CYS  15   2.827  -2.255   0.021
   83    HB2  CYS  15           1HB      CYS  15   3.224  -2.745   2.595
   84    HB3  CYS  15           2HB      CYS  15   4.739  -3.414   1.999
   85    H    ASP  16           H        ASP  16   4.266  -2.111  -1.592
   86    HA   ASP  16           HA       ASP  16   5.414  -4.544  -2.637
   87    HB2  ASP  16           1HB      ASP  16   4.385  -2.542  -3.955
   88    HB3  ASP  16           2HB      ASP  16   5.975  -1.813  -3.749
   89    H    VAL  17           H        VAL  17   6.366  -3.095  -0.091
   90    HA   VAL  17           HA       VAL  17   9.228  -3.139  -0.795
   91    HB   VAL  17           HB       VAL  17   7.875  -1.307   1.191
   92   HG11  VAL  17          1HG1      VAL  17   9.930  -1.854   2.176
   93   HG12  VAL  17          2HG1      VAL  17  10.772  -1.859   0.625
   94   HG13  VAL  17          3HG1      VAL  17  10.234  -0.336   1.332
   95   HG21  VAL  17          3HG2      VAL  17   9.298  -0.755  -1.411
   96   HG22  VAL  17          1HG2      VAL  17   7.575  -0.562  -1.088
   97   HG23  VAL  17          2HG2      VAL  17   8.746   0.480  -0.279
   98    H    CYS  18           H        CYS  18   7.014  -3.274   2.001
   99    HA   CYS  18           HA       CYS  18   8.743  -5.372   3.141
  100    HB2  CYS  18           1HB      CYS  18   7.932  -4.650   5.361
  101    HB3  CYS  18           2HB      CYS  18   8.775  -3.358   4.511
  102    H    ARG  19           H        ARG  19   6.325  -5.461   1.307
  103    HA   ARG  19           HA       ARG  19   4.275  -6.504   1.150
  104    HB2  ARG  19           1HB      ARG  19   6.249  -8.406   2.314
  105    HB3  ARG  19           2HB      ARG  19   4.570  -8.921   2.227
  106    HG2  ARG  19           1HG      ARG  19   5.690  -9.699   0.275
  107    HG3  ARG  19           2HG      ARG  19   4.602  -8.395  -0.205
  108    HD2  ARG  19           1HD      ARG  19   6.320  -6.943  -0.655
  109    HD3  ARG  19           2HD      ARG  19   7.417  -7.720   0.485
  110    HE   ARG  19           HE       ARG  19   8.131  -9.094  -1.198
  111   HH11  ARG  19          1HH1      ARG  19   5.130  -7.604  -2.144
  112   HH12  ARG  19          2HH1      ARG  19   5.192  -8.205  -3.768
  113   HH21  ARG  19          1HH2      ARG  19   8.224  -9.891  -3.333
  114   HH22  ARG  19          2HH2      ARG  19   6.953  -9.507  -4.443
  115    H    LYS  20           H        LYS  20   3.827  -4.736   3.024
  116    HA   LYS  20           HA       LYS  20   2.905  -6.067   5.453
  117    HB2  LYS  20           1HB      LYS  20   4.163  -3.865   5.487
  118    HB3  LYS  20           2HB      LYS  20   2.727  -3.128   4.787
  119    HG2  LYS  20           1HG      LYS  20   1.486  -3.397   6.708
  120    HG3  LYS  20           2HG      LYS  20   2.494  -4.720   7.300
  121    HD2  LYS  20           1HD      LYS  20   4.353  -2.910   7.413
  122    HD3  LYS  20           2HD      LYS  20   3.006  -1.770   7.364
  123    HE2  LYS  20           1HE      LYS  20   2.184  -2.450   9.410
  124    HE3  LYS  20           2HE      LYS  20   2.943  -4.038   9.304
  125    HZ1  LYS  20           3HZ      LYS  20   4.151  -2.841  10.904
  126    HZ2  LYS  20           1HZ      LYS  20   4.226  -1.448   9.945
  127    HZ3  LYS  20           2HZ      LYS  20   5.120  -2.819   9.517
  128    H    ALA  21           H        ALA  21   0.832  -6.528   5.869
  129    HA   ALA  21           HA       ALA  21  -1.138  -5.997   3.801
  130    HB1  ALA  21           3HB      ALA  21  -2.554  -7.395   5.539
  131    HB2  ALA  21           1HB      ALA  21  -1.399  -8.167   4.453
  132    HB3  ALA  21           2HB      ALA  21  -0.951  -7.837   6.127
  133    H    PHE  22           H        PHE  22  -2.911  -4.714   4.000
  134    HA   PHE  22           HA       PHE  22  -3.365  -3.365   6.568
  135    HB2  PHE  22           1HB      PHE  22  -3.319  -1.940   3.901
  136    HB3  PHE  22           2HB      PHE  22  -3.598  -1.210   5.478
  137    HD1  PHE  22           HD1      PHE  22  -1.091  -2.706   3.258
  138    HD2  PHE  22           HD2      PHE  22  -1.784  -0.727   6.962
  139    HE1  PHE  22           HE1      PHE  22   1.325  -2.300   3.489
  140    HE2  PHE  22           HE2      PHE  22   0.630  -0.317   7.199
  141    HZ   PHE  22           HZ       PHE  22   2.188  -1.103   5.461
  142    H    SER  23           H        SER  23  -5.478  -1.995   6.364
  143    HA   SER  23           HA       SER  23  -7.522  -3.833   5.389
  144    HB2  SER  23           1HB      SER  23  -9.069  -2.584   6.778
  145    HB3  SER  23           2HB      SER  23  -7.625  -2.954   7.722
  146    HG   SER  23           HG       SER  23  -7.399  -0.896   8.002
  147    H    HIS  24           H        HIS  24  -6.908  -0.320   5.285
  148    HA   HIS  24           HA       HIS  24  -8.389  -0.236   2.738
  149    HB2  HIS  24           1HB      HIS  24  -9.575   1.060   4.362
  150    HB3  HIS  24           2HB      HIS  24  -8.097   1.852   4.900
  151    HD1  HIS  24           HD1      HIS  24  -9.160   1.476   1.293
  152    HD2  HIS  24           HD2      HIS  24  -8.737   4.422   4.191
  153    HE1  HIS  24           HE1      HIS  24  -9.507   3.657   0.090
  154    H    HIS  25           H        HIS  25  -7.494   0.806   0.998
  155    HA   HIS  25           HA       HIS  25  -4.877   0.733   0.437
  156    HB2  HIS  25           1HB      HIS  25  -6.873   1.547  -1.017
  157    HB3  HIS  25           2HB      HIS  25  -6.407   3.155  -0.468
  158    HD1  HIS  25           HD1      HIS  25  -4.743   0.167  -2.142
  159    HD2  HIS  25           HD2      HIS  25  -4.560   4.317  -2.062
  160    HE1  HIS  25           HE1      HIS  25  -3.034   0.798  -3.875
  161    H    ALA  26           H        ALA  26  -6.416   3.734   1.611
  162    HA   ALA  26           HA       ALA  26  -4.425   5.459   1.891
  163    HB1  ALA  26           3HB      ALA  26  -6.156   6.409   2.939
  164    HB2  ALA  26           1HB      ALA  26  -6.769   4.862   3.523
  165    HB3  ALA  26           2HB      ALA  26  -5.488   5.694   4.406
  166    H    SER  27           H        SER  27  -5.058   3.262   4.631
  167    HA   SER  27           HA       SER  27  -2.903   3.647   6.171
  168    HB2  SER  27           1HB      SER  27  -4.800   1.787   6.220
  169    HB3  SER  27           2HB      SER  27  -3.499   0.782   5.581
  170    HG   SER  27           HG       SER  27  -2.303   1.886   7.473
  171    H    LEU  28           H        LEU  28  -2.907   1.606   3.267
  172    HA   LEU  28           HA       LEU  28  -0.136   0.946   3.467
  173    HB2  LEU  28           1HB      LEU  28  -1.393  -0.615   2.295
  174    HB3  LEU  28           2HB      LEU  28  -2.247   0.621   1.374
  175    HG   LEU  28           HG       LEU  28  -0.188   1.039   0.079
  176   HD11  LEU  28          1HD1      LEU  28   1.623  -0.675   0.241
  177   HD12  LEU  28          2HD1      LEU  28   0.878  -1.236   1.738
  178   HD13  LEU  28          3HD1      LEU  28   1.508   0.407   1.630
  179   HD21  LEU  28          3HD2      LEU  28  -1.657  -1.515   0.116
  180   HD22  LEU  28          1HD2      LEU  28  -0.152  -1.507  -0.804
  181   HD23  LEU  28          2HD2      LEU  28  -1.428  -0.352  -1.190
  182    H    THR  29           H        THR  29  -2.005   3.332   1.657
  183    HA   THR  29           HA       THR  29   0.063   4.296   0.023
  184    HB   THR  29           HB       THR  29  -2.440   5.625   1.058
  185    HG1  THR  29           HG1      THR  29  -1.857   4.991  -1.628
  186   HG21  THR  29          3HG2      THR  29  -1.686   7.610   0.391
  187   HG22  THR  29          1HG2      THR  29  -1.457   6.967  -1.235
  188   HG23  THR  29          2HG2      THR  29  -0.141   6.891  -0.063
  189    H    GLN  30           H        GLN  30  -1.216   5.690   3.052
  190    HA   GLN  30           HA       GLN  30   0.702   7.701   3.317
  191    HB2  GLN  30           1HB      GLN  30  -0.754   6.250   5.532
  192    HB3  GLN  30           2HB      GLN  30   0.020   7.823   5.660
  193    HG2  GLN  30           1HG      GLN  30  -1.594   8.468   3.724
  194    HG3  GLN  30           2HG      GLN  30  -2.506   7.063   4.275
  195   HE21  GLN  30          1HE2      GLN  30  -1.213  10.180   5.228
  196   HE22  GLN  30          2HE2      GLN  30  -2.312  10.449   6.534
  197    H    HIS  31           H        HIS  31   0.721   4.346   4.396
  198    HA   HIS  31           HA       HIS  31   3.019   4.456   6.002
  199    HB2  HIS  31           1HB      HIS  31   1.797   2.500   6.275
  200    HB3  HIS  31           2HB      HIS  31   1.586   2.268   4.542
  201    HD1  HIS  31           HD1      HIS  31   4.309   2.015   7.172
  202    HD2  HIS  31           HD2      HIS  31   3.340   0.517   3.420
  203    HE1  HIS  31           HE1      HIS  31   6.041   0.260   6.681
  204    H    GLN  32           H        GLN  32   2.657   3.552   2.578
  205    HA   GLN  32           HA       GLN  32   5.093   2.818   1.793
  206    HB2  GLN  32           1HB      GLN  32   3.150   4.697   0.511
  207    HB3  GLN  32           2HB      GLN  32   4.710   4.424  -0.254
  208    HG2  GLN  32           1HG      GLN  32   4.092   1.909   0.031
  209    HG3  GLN  32           2HG      GLN  32   2.449   2.531   0.166
  210   HE21  GLN  32          1HE2      GLN  32   2.286   1.139  -1.803
  211   HE22  GLN  32          2HE2      GLN  32   2.608   1.885  -3.328
  212    H    ARG  33           H        ARG  33   4.234   6.089   2.758
  213    HA   ARG  33           HA       ARG  33   6.333   7.598   1.948
  214    HB2  ARG  33           1HB      ARG  33   4.776   7.571   4.505
  215    HB3  ARG  33           2HB      ARG  33   6.139   8.669   4.338
  216    HG2  ARG  33           1HG      ARG  33   5.061   9.539   2.249
  217    HG3  ARG  33           2HG      ARG  33   3.643   8.576   2.667
  218    HD2  ARG  33           1HD      ARG  33   3.145   9.870   4.513
  219    HD3  ARG  33           2HD      ARG  33   4.804  10.441   4.687
  220    HE   ARG  33           HE       ARG  33   2.743  11.712   3.246
  221   HH11  ARG  33          1HH1      ARG  33   6.137  10.967   3.035
  222   HH12  ARG  33          2HH1      ARG  33   6.509  12.337   2.042
  223   HH21  ARG  33          1HH2      ARG  33   3.220  13.520   1.940
  224   HH22  ARG  33          2HH2      ARG  33   4.850  13.789   1.421
  225    H    VAL  34           H        VAL  34   6.323   5.693   4.965
  226    HA   VAL  34           HA       VAL  34   8.742   6.110   6.013
  227    HB   VAL  34           HB       VAL  34   8.866   3.762   6.710
  228   HG11  VAL  34          1HG1      VAL  34   7.447   4.749   8.170
  229   HG12  VAL  34          2HG1      VAL  34   6.385   5.354   6.898
  230   HG13  VAL  34          3HG1      VAL  34   6.279   3.669   7.410
  231   HG21  VAL  34          3HG2      VAL  34   6.732   2.417   5.850
  232   HG22  VAL  34          1HG2      VAL  34   7.009   3.420   4.427
  233   HG23  VAL  34          2HG2      VAL  34   8.286   2.357   5.019
  234    H    HIS  35           H        HIS  35   8.152   4.192   3.104
  235    HA   HIS  35           HA       HIS  35  10.989   3.662   2.768
  236    HB2  HIS  35           1HB      HIS  35   8.804   2.994   0.802
  237    HB3  HIS  35           2HB      HIS  35  10.376   2.222   0.987
  238    HD1  HIS  35           HD1      HIS  35  10.553   1.253   3.711
  239    HD2  HIS  35           HD2      HIS  35   6.897   1.346   1.740
  240    HE1  HIS  35           HE1      HIS  35   9.096  -0.403   4.919
  241    H    SER  36           H        SER  36   8.405   5.411   1.071
  242    HA   SER  36           HA       SER  36   9.517   6.337  -1.165
  243    HB2  SER  36           1HB      SER  36   7.344   7.130  -0.457
  244    HB3  SER  36           2HB      SER  36   8.060   8.022   0.885
  245    HG   SER  36           HG       SER  36   8.828   8.546  -1.776
  246    H    GLY  37           H        GLY  37  10.042   8.032   1.937
  247    HA2  GLY  37           1HA      GLY  37  12.723   8.287   1.994
  248    HA3  GLY  37           2HA      GLY  37  12.269   9.499   0.805
  249    H    GLU  38           H        GLU  38  13.568  10.369   2.980
  250    HA   GLU  38           HA       GLU  38  11.448  11.653   4.572
  251    HB2  GLU  38           1HB      GLU  38  12.944  11.692   6.487
  252    HB3  GLU  38           2HB      GLU  38  12.729  10.040   5.924
  253    HG2  GLU  38           1HG      GLU  38  14.890  10.239   4.711
  254    HG3  GLU  38           2HG      GLU  38  15.111  11.818   5.463
  255    H    LYS  39           H        LYS  39  11.345  13.771   4.290
  256    HA   LYS  39           HA       LYS  39  13.788  15.320   3.926
  257    HB2  LYS  39           1HB      LYS  39  11.598  15.069   1.898
  258    HB3  LYS  39           2HB      LYS  39  12.468  16.590   2.049
  259    HG2  LYS  39           1HG      LYS  39  14.439  15.699   1.282
  260    HG3  LYS  39           2HG      LYS  39  14.012  14.057   1.770
  261    HD2  LYS  39           1HD      LYS  39  13.792  13.940  -0.527
  262    HD3  LYS  39           2HD      LYS  39  12.139  14.307  -0.027
  263    HE2  LYS  39           1HE      LYS  39  12.283  16.514  -0.734
  264    HE3  LYS  39           2HE      LYS  39  14.045  16.516  -0.692
  265    HZ1  LYS  39           3HZ      LYS  39  12.977  16.449  -2.957
  266    HZ2  LYS  39           1HZ      LYS  39  12.510  14.861  -2.607
  267    HZ3  LYS  39           2HZ      LYS  39  14.151  15.268  -2.661
  268    HA   PRO  40           HA       PRO  40  11.668  18.119   6.578
  269    HB2  PRO  40           1HB      PRO  40  13.046  20.390   6.018
  270    HB3  PRO  40           2HB      PRO  40  13.723  19.068   6.976
  271    HG2  PRO  40           1HG      PRO  40  14.132  19.712   4.081
  272    HG3  PRO  40           2HG      PRO  40  15.323  19.211   5.295
  273    HD2  PRO  40           1HD      PRO  40  14.280  17.492   3.482
  274    HD3  PRO  40           2HD      PRO  40  14.757  16.984   5.115
  275    H    SER  41           H        SER  41  10.053  19.652   6.544
  276    HA   SER  41           HA       SER  41   8.548  19.966   4.216
  277    HB2  SER  41           1HB      SER  41   7.933  20.309   6.753
  278    HB3  SER  41           2HB      SER  41   8.352  21.989   6.416
  279    HG   SER  41           HG       SER  41   6.849  21.376   4.443
  280    H    GLY  42           H        GLY  42   8.194  21.719   2.831
  281    HA2  GLY  42           1HA      GLY  42  10.479  23.141   2.026
  282    HA3  GLY  42           2HA      GLY  42   8.836  23.472   1.497
  283    HA   PRO  43           HA       PRO  43  10.550  26.946   4.198
  284    HB2  PRO  43           1HB      PRO  43  10.600  28.863   2.275
  285    HB3  PRO  43           2HB      PRO  43  11.972  27.798   2.606
  286    HG2  PRO  43           1HG      PRO  43   9.896  27.601   0.458
  287    HG3  PRO  43           2HG      PRO  43  11.648  27.352   0.347
  288    HD2  PRO  43           1HD      PRO  43   9.892  25.297   0.504
  289    HD3  PRO  43           2HD      PRO  43  11.525  25.213   1.195
  290    H    SER  44           H        SER  44   7.846  26.158   2.373
  291    HA   SER  44           HA       SER  44   6.257  28.401   2.309
  292    HB2  SER  44           1HB      SER  44   5.551  25.511   2.813
  293    HB3  SER  44           2HB      SER  44   4.321  26.765   2.651
  294    HG   SER  44           HG       SER  44   5.815  25.537   0.733
  295    H    SER  45           H        SER  45   6.309  26.005   4.953
  296    HA   SER  45           HA       SER  45   5.908  26.195   7.185
  297    HB2  SER  45           1HB      SER  45   7.621  27.965   7.111
  298    HB3  SER  45           2HB      SER  45   6.378  29.150   6.711
  299    HG   SER  45           HG       SER  45   5.418  28.142   8.808
  300    H    GLY  46           H        GLY  46   3.704  26.015   5.552
  301    HA2  GLY  46           1HA      GLY  46   1.719  27.909   5.704
  302    HA3  GLY  46           2HA      GLY  46   1.416  26.178   5.728
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1 -27.333 -13.384   2.870
    2    HA2  GLY   1           1HA      GLY   1 -26.555 -14.066   4.920
    3    HA3  GLY   1           2HA      GLY   1 -25.599 -15.228   4.012
    4    H    SER   2           H        SER   2 -24.707 -14.114   6.397
    5    HA   SER   2           HA       SER   2 -22.358 -12.649   5.434
    6    HB2  SER   2           1HB      SER   2 -24.113 -11.096   6.476
    7    HB3  SER   2           2HB      SER   2 -23.723 -11.873   8.010
    8    HG   SER   2           HG       SER   2 -21.598 -10.942   6.468
    9    H    SER   3           H        SER   3 -20.670 -13.878   5.903
   10    HA   SER   3           HA       SER   3 -20.506 -15.097   8.568
   11    HB2  SER   3           1HB      SER   3 -19.474 -17.129   7.519
   12    HB3  SER   3           2HB      SER   3 -21.179 -16.911   7.125
   13    HG   SER   3           HG       SER   3 -18.951 -16.791   5.496
   14    H    GLY   4           H        GLY   4 -18.587 -14.835   9.549
   15    HA2  GLY   4           1HA      GLY   4 -16.534 -13.345   8.115
   16    HA3  GLY   4           2HA      GLY   4 -16.598 -13.628   9.849
   17    H    SER   5           H        SER   5 -16.481 -15.710   6.954
   18    HA   SER   5           HA       SER   5 -14.269 -17.174   8.238
   19    HB2  SER   5           1HB      SER   5 -16.285 -18.547   7.978
   20    HB3  SER   5           2HB      SER   5 -16.315 -18.193   6.251
   21    HG   SER   5           HG       SER   5 -15.315 -20.239   6.888
   22    H    SER   6           H        SER   6 -15.580 -16.284   5.049
   23    HA   SER   6           HA       SER   6 -12.881 -15.696   4.128
   24    HB2  SER   6           1HB      SER   6 -14.652 -17.807   2.901
   25    HB3  SER   6           2HB      SER   6 -13.365 -17.019   1.990
   26    HG   SER   6           HG       SER   6 -12.128 -17.700   4.075
   27    H    GLY   7           H        GLY   7 -12.856 -14.524   2.077
   28    HA2  GLY   7           1HA      GLY   7 -13.604 -12.860   0.684
   29    HA3  GLY   7           2HA      GLY   7 -15.181 -13.632   0.771
   30    H    THR   8           H        THR   8 -13.220 -12.073   3.291
   31    HA   THR   8           HA       THR   8 -15.107  -9.870   3.464
   32    HB   THR   8           HB       THR   8 -14.635 -11.684   5.837
   33    HG1  THR   8           HG1      THR   8 -17.008 -11.207   4.326
   34   HG21  THR   8          3HG2      THR   8 -16.213 -10.254   7.002
   35   HG22  THR   8          1HG2      THR   8 -16.409  -9.255   5.563
   36   HG23  THR   8          2HG2      THR   8 -14.862  -9.290   6.409
   37    H    GLY   9           H        GLY   9 -14.032  -8.047   3.858
   38    HA2  GLY   9           1HA      GLY   9 -12.208  -6.677   4.225
   39    HA3  GLY   9           2HA      GLY   9 -12.226  -7.461   5.797
   40    H    GLU  10           H        GLU  10 -11.356  -8.619   2.543
   41    HA   GLU  10           HA       GLU  10  -9.184 -10.161   3.464
   42    HB2  GLU  10           1HB      GLU  10 -10.390 -10.537   1.318
   43    HB3  GLU  10           2HB      GLU  10  -9.635  -9.085   0.676
   44    HG2  GLU  10           1HG      GLU  10  -7.493 -10.057   0.711
   45    HG3  GLU  10           2HG      GLU  10  -8.033 -11.395   1.724
   46    H    LYS  11           H        LYS  11  -6.913  -9.828   2.504
   47    HA   LYS  11           HA       LYS  11  -6.124  -7.022   2.941
   48    HB2  LYS  11           1HB      LYS  11  -3.868  -8.127   3.577
   49    HB3  LYS  11           2HB      LYS  11  -5.186  -8.162   4.740
   50    HG2  LYS  11           1HG      LYS  11  -5.697 -10.442   4.171
   51    HG3  LYS  11           2HG      LYS  11  -4.503 -10.421   2.870
   52    HD2  LYS  11           1HD      LYS  11  -3.247 -11.411   4.494
   53    HD3  LYS  11           2HD      LYS  11  -2.902  -9.721   4.872
   54    HE2  LYS  11           1HE      LYS  11  -3.436 -10.613   6.945
   55    HE3  LYS  11           2HE      LYS  11  -4.960  -9.894   6.426
   56    HZ1  LYS  11           3HZ      LYS  11  -4.380 -12.601   7.030
   57    HZ2  LYS  11           1HZ      LYS  11  -4.966 -12.473   5.448
   58    HZ3  LYS  11           2HZ      LYS  11  -5.878 -11.871   6.740
   59    HA   PRO  12           HA       PRO  12  -4.879  -8.518  -1.361
   60    HB2  PRO  12           1HB      PRO  12  -6.339  -6.706  -2.759
   61    HB3  PRO  12           2HB      PRO  12  -6.971  -8.287  -2.283
   62    HG2  PRO  12           1HG      PRO  12  -7.386  -5.616  -0.997
   63    HG3  PRO  12           2HG      PRO  12  -8.565  -6.903  -1.308
   64    HD2  PRO  12           1HD      PRO  12  -7.445  -6.511   1.126
   65    HD3  PRO  12           2HD      PRO  12  -7.913  -8.119   0.538
   66    H    TYR  13           H        TYR  13  -4.486  -5.964   0.678
   67    HA   TYR  13           HA       TYR  13  -2.898  -4.411  -1.252
   68    HB2  TYR  13           1HB      TYR  13  -3.791  -3.514   1.490
   69    HB3  TYR  13           2HB      TYR  13  -3.121  -2.520   0.201
   70    HD1  TYR  13           HD2      TYR  13  -4.488  -1.895  -1.727
   71    HD2  TYR  13           HD1      TYR  13  -6.109  -4.197   1.463
   72    HE1  TYR  13           HE2      TYR  13  -6.759  -1.407  -2.536
   73    HE2  TYR  13           HE1      TYR  13  -8.384  -3.717   0.662
   74    HH   TYR  13           HH       TYR  13  -8.982  -2.246  -2.397
   75    H    GLU  14           H        GLU  14  -0.823  -4.957  -1.236
   76    HA   GLU  14           HA       GLU  14   0.489  -5.373   1.366
   77    HB2  GLU  14           1HB      GLU  14   0.178  -7.531   0.194
   78    HB3  GLU  14           2HB      GLU  14   1.077  -6.897  -1.177
   79    HG2  GLU  14           1HG      GLU  14   3.000  -6.537   0.430
   80    HG3  GLU  14           2HG      GLU  14   2.088  -7.513   1.579
   81    H    CYS  15           H        CYS  15   2.593  -4.606   1.565
   82    HA   CYS  15           HA       CYS  15   3.262  -2.451  -0.241
   83    HB2  CYS  15           1HB      CYS  15   3.457  -2.317   2.279
   84    HB3  CYS  15           2HB      CYS  15   4.838  -3.402   2.154
   85    H    ASP  16           H        ASP  16   4.774  -2.468  -1.785
   86    HA   ASP  16           HA       ASP  16   6.159  -4.961  -2.331
   87    HB2  ASP  16           1HB      ASP  16   5.671  -2.428  -3.857
   88    HB3  ASP  16           2HB      ASP  16   6.962  -3.514  -4.366
   89    H    VAL  17           H        VAL  17   6.879  -3.020  -0.098
   90    HA   VAL  17           HA       VAL  17   9.729  -2.752  -0.801
   91    HB   VAL  17           HB       VAL  17   8.142  -0.940   1.024
   92   HG11  VAL  17          1HG1      VAL  17  10.059  -0.107   1.799
   93   HG12  VAL  17          2HG1      VAL  17  10.844  -1.528   1.107
   94   HG13  VAL  17          3HG1      VAL  17  10.764  -0.026   0.186
   95   HG21  VAL  17          3HG2      VAL  17   7.982  -0.857  -1.623
   96   HG22  VAL  17          1HG2      VAL  17   8.024   0.610  -0.644
   97   HG23  VAL  17          2HG2      VAL  17   9.492   0.035  -1.436
   98    H    CYS  18           H        CYS  18   7.406  -3.210   1.842
   99    HA   CYS  18           HA       CYS  18   9.513  -4.626   3.339
  100    HB2  CYS  18           1HB      CYS  18   8.311  -4.016   5.395
  101    HB3  CYS  18           2HB      CYS  18   8.795  -2.588   4.487
  102    H    ARG  19           H        ARG  19   6.725  -5.029   1.592
  103    HA   ARG  19           HA       ARG  19   5.287  -6.762   1.281
  104    HB2  ARG  19           1HB      ARG  19   7.470  -8.129   2.838
  105    HB3  ARG  19           2HB      ARG  19   6.033  -8.998   2.317
  106    HG2  ARG  19           1HG      ARG  19   7.453  -9.457   0.590
  107    HG3  ARG  19           2HG      ARG  19   6.660  -8.005  -0.026
  108    HD2  ARG  19           1HD      ARG  19   8.905  -7.571  -0.416
  109    HD3  ARG  19           2HD      ARG  19   8.606  -6.743   1.112
  110    HE   ARG  19           HE       ARG  19  10.081  -8.167   2.116
  111   HH11  ARG  19          1HH1      ARG  19   9.064  -9.556  -0.910
  112   HH12  ARG  19          2HH1      ARG  19  10.179 -10.880  -0.827
  113   HH21  ARG  19          1HH2      ARG  19  11.553  -9.905   2.237
  114   HH22  ARG  19          2HH2      ARG  19  11.593 -11.078   0.964
  115    H    LYS  20           H        LYS  20   4.519  -4.982   3.197
  116    HA   LYS  20           HA       LYS  20   3.603  -6.543   5.496
  117    HB2  LYS  20           1HB      LYS  20   3.910  -3.641   4.905
  118    HB3  LYS  20           2HB      LYS  20   2.651  -4.112   6.039
  119    HG2  LYS  20           1HG      LYS  20   4.395  -5.348   7.335
  120    HG3  LYS  20           2HG      LYS  20   5.605  -4.631   6.268
  121    HD2  LYS  20           1HD      LYS  20   5.151  -2.458   7.034
  122    HD3  LYS  20           2HD      LYS  20   3.620  -2.944   7.765
  123    HE2  LYS  20           1HE      LYS  20   4.903  -4.338   9.376
  124    HE3  LYS  20           2HE      LYS  20   6.392  -3.684   8.694
  125    HZ1  LYS  20           3HZ      LYS  20   5.416  -2.593  10.780
  126    HZ2  LYS  20           1HZ      LYS  20   4.297  -1.884   9.728
  127    HZ3  LYS  20           2HZ      LYS  20   5.950  -1.587   9.529
  128    H    ALA  21           H        ALA  21   1.290  -5.840   6.237
  129    HA   ALA  21           HA       ALA  21  -0.497  -5.878   3.894
  130    HB1  ALA  21           3HB      ALA  21  -0.156  -7.906   5.839
  131    HB2  ALA  21           1HB      ALA  21  -1.750  -7.192   6.083
  132    HB3  ALA  21           2HB      ALA  21  -1.309  -7.848   4.506
  133    H    PHE  22           H        PHE  22  -2.232  -4.549   3.951
  134    HA   PHE  22           HA       PHE  22  -2.806  -3.136   6.466
  135    HB2  PHE  22           1HB      PHE  22  -2.681  -1.850   3.730
  136    HB3  PHE  22           2HB      PHE  22  -3.080  -1.040   5.241
  137    HD1  PHE  22           HD1      PHE  22  -0.363  -2.917   3.541
  138    HD2  PHE  22           HD2      PHE  22  -1.409  -0.070   6.528
  139    HE1  PHE  22           HE1      PHE  22   2.020  -2.417   3.894
  140    HE2  PHE  22           HE2      PHE  22   0.972   0.435   6.884
  141    HZ   PHE  22           HZ       PHE  22   2.690  -0.738   5.566
  142    H    SER  23           H        SER  23  -4.813  -3.609   7.041
  143    HA   SER  23           HA       SER  23  -6.751  -4.906   5.673
  144    HB2  SER  23           1HB      SER  23  -8.418  -3.735   7.161
  145    HB3  SER  23           2HB      SER  23  -7.049  -4.452   8.011
  146    HG   SER  23           HG       SER  23  -6.111  -2.392   8.122
  147    H    HIS  24           H        HIS  24  -6.438  -1.361   5.815
  148    HA   HIS  24           HA       HIS  24  -8.326  -1.139   3.585
  149    HB2  HIS  24           1HB      HIS  24  -8.353   0.262   5.833
  150    HB3  HIS  24           2HB      HIS  24  -7.189   1.256   4.961
  151    HD1  HIS  24           HD1      HIS  24  -8.092   2.833   3.219
  152    HD2  HIS  24           HD2      HIS  24 -10.953   0.157   4.603
  153    HE1  HIS  24           HE1      HIS  24 -10.277   3.629   2.260
  154    H    HIS  25           H        HIS  25  -7.812   0.522   1.908
  155    HA   HIS  25           HA       HIS  25  -5.215  -0.017   0.812
  156    HB2  HIS  25           1HB      HIS  25  -7.095   0.096  -0.695
  157    HB3  HIS  25           2HB      HIS  25  -7.494   1.722  -0.148
  158    HD1  HIS  25           HD1      HIS  25  -5.199  -0.151  -2.403
  159    HD2  HIS  25           HD2      HIS  25  -5.863   3.768  -1.195
  160    HE1  HIS  25           HE1      HIS  25  -3.894   1.278  -4.009
  161    H    ALA  26           H        ALA  26  -6.907   2.934   1.865
  162    HA   ALA  26           HA       ALA  26  -4.953   4.806   1.397
  163    HB1  ALA  26           3HB      ALA  26  -5.968   5.748   3.713
  164    HB2  ALA  26           1HB      ALA  26  -6.780   5.880   2.153
  165    HB3  ALA  26           2HB      ALA  26  -7.213   4.582   3.267
  166    H    SER  27           H        SER  27  -5.230   2.589   4.132
  167    HA   SER  27           HA       SER  27  -3.231   3.637   5.763
  168    HB2  SER  27           1HB      SER  27  -4.189   0.796   5.385
  169    HB3  SER  27           2HB      SER  27  -3.028   1.261   6.629
  170    HG   SER  27           HG       SER  27  -4.725   2.866   7.231
  171    H    LEU  28           H        LEU  28  -3.012   1.777   2.839
  172    HA   LEU  28           HA       LEU  28  -0.202   1.166   3.209
  173    HB2  LEU  28           1HB      LEU  28  -1.549  -0.479   2.102
  174    HB3  LEU  28           2HB      LEU  28  -2.108   0.705   0.923
  175    HG   LEU  28           HG       LEU  28   0.352   0.858   0.204
  176   HD11  LEU  28          1HD1      LEU  28   0.868  -0.629   2.363
  177   HD12  LEU  28          2HD1      LEU  28   1.874  -0.657   0.915
  178   HD13  LEU  28          3HD1      LEU  28   0.667  -1.916   1.174
  179   HD21  LEU  28          3HD2      LEU  28  -1.568  -1.358  -0.305
  180   HD22  LEU  28          1HD2      LEU  28   0.050  -1.464  -0.998
  181   HD23  LEU  28          2HD2      LEU  28  -0.987  -0.092  -1.389
  182    H    THR  29           H        THR  29  -2.144   3.070   0.906
  183    HA   THR  29           HA       THR  29  -0.104   4.189  -0.576
  184    HB   THR  29           HB       THR  29  -2.689   4.440  -0.810
  185    HG1  THR  29           HG1      THR  29  -1.414   5.291  -2.396
  186   HG21  THR  29          3HG2      THR  29  -3.755   6.128   0.261
  187   HG22  THR  29          1HG2      THR  29  -2.334   7.171   0.258
  188   HG23  THR  29          2HG2      THR  29  -2.482   5.885   1.456
  189    H    GLN  30           H        GLN  30  -1.083   4.907   2.673
  190    HA   GLN  30           HA       GLN  30   0.422   7.389   2.767
  191    HB2  GLN  30           1HB      GLN  30  -1.418   5.940   4.605
  192    HB3  GLN  30           2HB      GLN  30  -0.238   7.028   5.323
  193    HG2  GLN  30           1HG      GLN  30  -1.088   8.824   3.817
  194    HG3  GLN  30           2HG      GLN  30  -2.366   7.718   3.315
  195   HE21  GLN  30          1HE2      GLN  30  -4.060   7.312   4.670
  196   HE22  GLN  30          2HE2      GLN  30  -4.323   8.169   6.147
  197    H    HIS  31           H        HIS  31   0.537   4.202   4.350
  198    HA   HIS  31           HA       HIS  31   2.783   4.506   5.897
  199    HB2  HIS  31           1HB      HIS  31   1.781   2.459   6.222
  200    HB3  HIS  31           2HB      HIS  31   1.548   2.178   4.499
  201    HD1  HIS  31           HD1      HIS  31   4.227   2.008   7.154
  202    HD2  HIS  31           HD2      HIS  31   3.505   0.680   3.284
  203    HE1  HIS  31           HE1      HIS  31   6.092   0.404   6.635
  204    H    GLN  32           H        GLN  32   2.634   3.658   2.458
  205    HA   GLN  32           HA       GLN  32   5.155   3.015   1.804
  206    HB2  GLN  32           1HB      GLN  32   3.263   4.886   0.403
  207    HB3  GLN  32           2HB      GLN  32   4.823   4.471  -0.295
  208    HG2  GLN  32           1HG      GLN  32   3.981   2.014   0.166
  209    HG3  GLN  32           2HG      GLN  32   2.403   2.796   0.084
  210   HE21  GLN  32          1HE2      GLN  32   3.419   0.845  -1.720
  211   HE22  GLN  32          2HE2      GLN  32   3.518   1.581  -3.279
  212    H    ARG  33           H        ARG  33   4.118   6.106   2.999
  213    HA   ARG  33           HA       ARG  33   6.179   7.769   2.206
  214    HB2  ARG  33           1HB      ARG  33   4.467   7.680   4.669
  215    HB3  ARG  33           2HB      ARG  33   5.750   8.874   4.526
  216    HG2  ARG  33           1HG      ARG  33   4.742   9.793   2.543
  217    HG3  ARG  33           2HG      ARG  33   3.515   8.525   2.541
  218    HD2  ARG  33           1HD      ARG  33   3.829  10.860   4.382
  219    HD3  ARG  33           2HD      ARG  33   2.400  10.313   3.505
  220    HE   ARG  33           HE       ARG  33   1.944   8.828   5.211
  221   HH11  ARG  33          1HH1      ARG  33   5.091  10.247   5.663
  222   HH12  ARG  33          2HH1      ARG  33   5.272   9.649   7.279
  223   HH21  ARG  33          1HH2      ARG  33   2.171   8.035   7.338
  224   HH22  ARG  33          2HH2      ARG  33   3.611   8.390   8.230
  225    H    VAL  34           H        VAL  34   6.033   5.697   5.096
  226    HA   VAL  34           HA       VAL  34   8.353   6.286   6.365
  227    HB   VAL  34           HB       VAL  34   8.435   4.059   7.225
  228   HG11  VAL  34          1HG1      VAL  34   6.488   5.486   7.848
  229   HG12  VAL  34          2HG1      VAL  34   5.540   4.641   6.623
  230   HG13  VAL  34          3HG1      VAL  34   6.191   3.755   8.002
  231   HG21  VAL  34          3HG2      VAL  34   6.724   3.272   4.869
  232   HG22  VAL  34          1HG2      VAL  34   8.404   2.816   5.151
  233   HG23  VAL  34          2HG2      VAL  34   7.136   2.215   6.219
  234    H    HIS  35           H        HIS  35   8.023   4.704   3.283
  235    HA   HIS  35           HA       HIS  35  10.871   4.053   3.198
  236    HB2  HIS  35           1HB      HIS  35   8.764   3.519   1.098
  237    HB3  HIS  35           2HB      HIS  35  10.377   2.818   1.184
  238    HD1  HIS  35           HD1      HIS  35  10.556   1.737   3.949
  239    HD2  HIS  35           HD2      HIS  35   7.056   1.527   1.721
  240    HE1  HIS  35           HE1      HIS  35   9.233  -0.150   4.953
  241    H    SER  36           H        SER  36  12.127   5.738   2.710
  242    HA   SER  36           HA       SER  36  11.195   7.749   0.810
  243    HB2  SER  36           1HB      SER  36  13.216   9.008   1.513
  244    HB3  SER  36           2HB      SER  36  12.185   8.576   2.877
  245    HG   SER  36           HG       SER  36  14.689   7.548   2.136
  246    H    GLY  37           H        GLY  37  11.609   7.465  -1.274
  247    HA2  GLY  37           1HA      GLY  37  13.590   5.603  -2.194
  248    HA3  GLY  37           2HA      GLY  37  12.568   6.621  -3.199
  249    H    GLU  38           H        GLU  38  14.607   6.772  -4.455
  250    HA   GLU  38           HA       GLU  38  16.707   8.406  -3.311
  251    HB2  GLU  38           1HB      GLU  38  17.828   8.122  -5.457
  252    HB3  GLU  38           2HB      GLU  38  17.275   6.571  -4.841
  253    HG2  GLU  38           1HG      GLU  38  15.598   8.118  -6.770
  254    HG3  GLU  38           2HG      GLU  38  16.948   7.137  -7.337
  255    H    LYS  39           H        LYS  39  14.281   9.739  -3.283
  256    HA   LYS  39           HA       LYS  39  14.430  11.651  -5.503
  257    HB2  LYS  39           1HB      LYS  39  12.222  10.723  -5.093
  258    HB3  LYS  39           2HB      LYS  39  12.300  11.208  -3.404
  259    HG2  LYS  39           1HG      LYS  39  11.045  12.913  -4.211
  260    HG3  LYS  39           2HG      LYS  39  12.648  13.598  -4.492
  261    HD2  LYS  39           1HD      LYS  39  11.732  13.933  -6.556
  262    HD3  LYS  39           2HD      LYS  39  12.387  12.311  -6.795
  263    HE2  LYS  39           1HE      LYS  39  10.172  12.279  -7.637
  264    HE3  LYS  39           2HE      LYS  39  10.136  11.423  -6.096
  265    HZ1  LYS  39           3HZ      LYS  39   9.631  14.224  -5.805
  266    HZ2  LYS  39           1HZ      LYS  39   8.731  12.904  -5.250
  267    HZ3  LYS  39           2HZ      LYS  39   8.505  13.479  -6.824
  268    HA   PRO  40           HA       PRO  40  16.426  14.632  -2.939
  269    HB2  PRO  40           1HB      PRO  40  15.840  16.852  -4.387
  270    HB3  PRO  40           2HB      PRO  40  17.048  15.666  -4.894
  271    HG2  PRO  40           1HG      PRO  40  14.207  15.977  -5.787
  272    HG3  PRO  40           2HG      PRO  40  15.655  15.647  -6.756
  273    HD2  PRO  40           1HD      PRO  40  13.909  13.706  -6.038
  274    HD3  PRO  40           2HD      PRO  40  15.647  13.402  -6.233
  275    H    SER  41           H        SER  41  13.178  15.489  -4.133
  276    HA   SER  41           HA       SER  41  12.677  17.259  -1.926
  277    HB2  SER  41           1HB      SER  41  10.385  17.401  -2.889
  278    HB3  SER  41           2HB      SER  41  11.646  17.725  -4.078
  279    HG   SER  41           HG       SER  41  10.614  15.125  -3.758
  280    H    GLY  42           H        GLY  42  11.644  16.854  -0.052
  281    HA2  GLY  42           1HA      GLY  42   9.919  14.600   0.324
  282    HA3  GLY  42           2HA      GLY  42  11.494  14.350   1.063
  283    HA   PRO  43           HA       PRO  43   8.612  16.627   3.991
  284    HB2  PRO  43           1HB      PRO  43   8.679  14.770   5.970
  285    HB3  PRO  43           2HB      PRO  43   7.496  14.732   4.657
  286    HG2  PRO  43           1HG      PRO  43  10.039  13.182   4.961
  287    HG3  PRO  43           2HG      PRO  43   8.449  12.626   4.404
  288    HD2  PRO  43           1HD      PRO  43  10.469  13.209   2.697
  289    HD3  PRO  43           2HD      PRO  43   8.762  13.462   2.279
  290    H    SER  44           H        SER  44  10.483  18.047   4.058
  291    HA   SER  44           HA       SER  44  12.758  17.396   5.659
  292    HB2  SER  44           1HB      SER  44  12.822  19.048   3.797
  293    HB3  SER  44           2HB      SER  44  11.805  20.124   4.755
  294    HG   SER  44           HG       SER  44  14.220  19.126   5.803
  295    H    SER  45           H        SER  45  11.949  16.760   7.672
  296    HA   SER  45           HA       SER  45  11.672  18.829   9.583
  297    HB2  SER  45           1HB      SER  45   9.352  18.720   8.460
  298    HB3  SER  45           2HB      SER  45   9.164  17.183   9.304
  299    HG   SER  45           HG       SER  45   8.368  19.098  10.434
  300    H    GLY  46           H        GLY  46  12.938  17.949  11.084
  301    HA2  GLY  46           1HA      GLY  46  12.261  15.945  12.797
  302    HA3  GLY  46           2HA      GLY  46  13.074  15.101  11.487
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1   9.739 -22.790  10.570
    2    HA2  GLY   1           1HA      GLY   1  10.548 -25.423  11.382
    3    HA3  GLY   1           2HA      GLY   1   9.659 -24.574  12.638
    4    H    SER   2           H        SER   2   7.523 -24.786  12.635
    5    HA   SER   2           HA       SER   2   6.165 -26.428  10.836
    6    HB2  SER   2           1HB      SER   2   5.410 -25.844  13.157
    7    HB3  SER   2           2HB      SER   2   4.918 -24.265  12.546
    8    HG   SER   2           HG       SER   2   3.940 -26.784  11.673
    9    H    SER   3           H        SER   3   4.149 -25.680   9.608
   10    HA   SER   3           HA       SER   3   5.015 -23.773   7.630
   11    HB2  SER   3           1HB      SER   3   3.042 -24.447   6.387
   12    HB3  SER   3           2HB      SER   3   3.837 -25.885   7.027
   13    HG   SER   3           HG       SER   3   1.556 -24.581   8.103
   14    H    GLY   4           H        GLY   4   3.425 -22.116   6.802
   15    HA2  GLY   4           1HA      GLY   4   2.702 -20.392   8.989
   16    HA3  GLY   4           2HA      GLY   4   2.525 -20.038   7.277
   17    H    SER   5           H        SER   5   0.540 -19.162   8.761
   18    HA   SER   5           HA       SER   5  -1.592 -21.184   8.580
   19    HB2  SER   5           1HB      SER   5  -1.140 -18.853  10.394
   20    HB3  SER   5           2HB      SER   5  -2.800 -19.322  10.027
   21    HG   SER   5           HG       SER   5  -1.765 -21.558  10.580
   22    H    SER   6           H        SER   6  -3.278 -20.882   7.246
   23    HA   SER   6           HA       SER   6  -3.155 -19.113   5.112
   24    HB2  SER   6           1HB      SER   6  -5.530 -20.556   6.306
   25    HB3  SER   6           2HB      SER   6  -5.589 -19.680   4.776
   26    HG   SER   6           HG       SER   6  -4.471 -21.219   3.838
   27    H    GLY   7           H        GLY   7  -5.261 -18.903   7.986
   28    HA2  GLY   7           1HA      GLY   7  -6.159 -16.261   7.290
   29    HA3  GLY   7           2HA      GLY   7  -6.514 -17.127   8.777
   30    H    THR   8           H        THR   8  -3.768 -15.565   7.130
   31    HA   THR   8           HA       THR   8  -2.733 -14.758   9.756
   32    HB   THR   8           HB       THR   8  -1.106 -15.904   8.374
   33    HG1  THR   8           HG1      THR   8   0.496 -14.267   8.396
   34   HG21  THR   8          3HG2      THR   8  -1.913 -15.551   6.167
   35   HG22  THR   8          1HG2      THR   8  -0.330 -14.778   6.247
   36   HG23  THR   8          2HG2      THR   8  -1.795 -13.799   6.330
   37    H    GLY   9           H        GLY   9  -4.024 -13.517   6.766
   38    HA2  GLY   9           1HA      GLY   9  -5.068 -11.203   7.459
   39    HA3  GLY   9           2HA      GLY   9  -3.367 -10.765   7.515
   40    H    GLU  10           H        GLU  10  -5.103 -12.856   5.231
   41    HA   GLU  10           HA       GLU  10  -3.793 -11.731   2.986
   42    HB2  GLU  10           1HB      GLU  10  -6.297 -13.421   3.109
   43    HB3  GLU  10           2HB      GLU  10  -5.372 -13.081   1.654
   44    HG2  GLU  10           1HG      GLU  10  -3.471 -14.274   2.526
   45    HG3  GLU  10           2HG      GLU  10  -4.295 -14.524   4.064
   46    H    LYS  11           H        LYS  11  -4.156  -9.815   2.110
   47    HA   LYS  11           HA       LYS  11  -6.906  -8.861   1.829
   48    HB2  LYS  11           1HB      LYS  11  -4.661  -7.352   3.157
   49    HB3  LYS  11           2HB      LYS  11  -6.059  -6.535   2.470
   50    HG2  LYS  11           1HG      LYS  11  -7.535  -7.605   3.998
   51    HG3  LYS  11           2HG      LYS  11  -6.259  -8.685   4.564
   52    HD2  LYS  11           1HD      LYS  11  -5.027  -6.545   5.261
   53    HD3  LYS  11           2HD      LYS  11  -6.583  -5.738   5.050
   54    HE2  LYS  11           1HE      LYS  11  -6.621  -6.282   7.294
   55    HE3  LYS  11           2HE      LYS  11  -7.479  -7.642   6.573
   56    HZ1  LYS  11           3HZ      LYS  11  -5.902  -9.058   7.216
   57    HZ2  LYS  11           1HZ      LYS  11  -5.354  -7.829   8.242
   58    HZ3  LYS  11           2HZ      LYS  11  -4.640  -8.044   6.724
   59    HA   PRO  12           HA       PRO  12  -5.643  -7.646  -2.194
   60    HB2  PRO  12           1HB      PRO  12  -7.196  -5.460  -2.614
   61    HB3  PRO  12           2HB      PRO  12  -7.839  -7.106  -2.599
   62    HG2  PRO  12           1HG      PRO  12  -7.867  -5.042  -0.432
   63    HG3  PRO  12           2HG      PRO  12  -9.160  -6.140  -0.947
   64    HD2  PRO  12           1HD      PRO  12  -7.632  -6.614   1.237
   65    HD3  PRO  12           2HD      PRO  12  -8.291  -7.920   0.231
   66    H    TYR  13           H        TYR  13  -5.138  -5.609   0.496
   67    HA   TYR  13           HA       TYR  13  -3.480  -3.774  -1.098
   68    HB2  TYR  13           1HB      TYR  13  -4.410  -3.352   1.743
   69    HB3  TYR  13           2HB      TYR  13  -3.703  -2.162   0.656
   70    HD1  TYR  13           HD2      TYR  13  -5.027  -1.208  -1.174
   71    HD2  TYR  13           HD1      TYR  13  -6.739  -3.954   1.589
   72    HE1  TYR  13           HE2      TYR  13  -7.276  -0.545  -1.917
   73    HE2  TYR  13           HE1      TYR  13  -8.993  -3.299   0.853
   74    HH   TYR  13           HH       TYR  13  -9.799  -0.718  -0.526
   75    H    GLU  14           H        GLU  14  -1.482  -4.608  -1.202
   76    HA   GLU  14           HA       GLU  14  -0.140  -5.212   1.341
   77    HB2  GLU  14           1HB      GLU  14  -0.856  -7.263  -0.118
   78    HB3  GLU  14           2HB      GLU  14   0.515  -6.799  -1.115
   79    HG2  GLU  14           1HG      GLU  14   1.514  -8.299   0.271
   80    HG3  GLU  14           2HG      GLU  14   1.784  -6.813   1.180
   81    H    CYS  15           H        CYS  15   1.761  -4.218   1.581
   82    HA   CYS  15           HA       CYS  15   2.663  -2.302  -0.266
   83    HB2  CYS  15           1HB      CYS  15   3.078  -2.490   2.292
   84    HB3  CYS  15           2HB      CYS  15   4.453  -3.490   1.834
   85    H    ASP  16           H        ASP  16   5.053  -2.277  -0.988
   86    HA   ASP  16           HA       ASP  16   5.583  -4.828  -2.355
   87    HB2  ASP  16           1HB      ASP  16   6.562  -2.075  -3.135
   88    HB3  ASP  16           2HB      ASP  16   6.700  -3.555  -4.080
   89    H    VAL  17           H        VAL  17   7.122  -2.160  -0.616
   90    HA   VAL  17           HA       VAL  17   9.739  -3.282  -0.673
   91    HB   VAL  17           HB       VAL  17   8.565  -1.197   1.172
   92   HG11  VAL  17          1HG1      VAL  17  11.404  -1.016   0.801
   93   HG12  VAL  17          2HG1      VAL  17  10.480  -1.167   2.297
   94   HG13  VAL  17          3HG1      VAL  17  10.975  -2.613   1.415
   95   HG21  VAL  17          3HG2      VAL  17  10.482  -0.576  -1.016
   96   HG22  VAL  17          1HG2      VAL  17   8.800  -0.892  -1.440
   97   HG23  VAL  17          2HG2      VAL  17   9.197   0.414  -0.324
   98    H    CYS  18           H        CYS  18   7.575  -2.776   2.121
   99    HA   CYS  18           HA       CYS  18   8.966  -4.818   3.620
  100    HB2  CYS  18           1HB      CYS  18   7.636  -4.144   5.481
  101    HB3  CYS  18           2HB      CYS  18   8.078  -2.673   4.620
  102    H    ARG  19           H        ARG  19   6.097  -4.550   1.708
  103    HA   ARG  19           HA       ARG  19   4.572  -6.090   1.014
  104    HB2  ARG  19           1HB      ARG  19   6.351  -8.125   2.367
  105    HB3  ARG  19           2HB      ARG  19   5.120  -8.450   1.155
  106    HG2  ARG  19           1HG      ARG  19   7.536  -6.737   0.640
  107    HG3  ARG  19           2HG      ARG  19   7.480  -8.472   0.325
  108    HD2  ARG  19           1HD      ARG  19   5.583  -6.449  -0.859
  109    HD3  ARG  19           2HD      ARG  19   7.013  -7.078  -1.676
  110    HE   ARG  19           HE       ARG  19   4.499  -8.431  -1.280
  111   HH11  ARG  19          1HH1      ARG  19   7.896  -8.789  -1.948
  112   HH12  ARG  19          2HH1      ARG  19   7.717 -10.336  -2.708
  113   HH21  ARG  19          1HH2      ARG  19   4.249 -10.466  -2.279
  114   HH22  ARG  19          2HH2      ARG  19   5.642 -11.288  -2.896
  115    H    LYS  20           H        LYS  20   3.922  -4.710   3.261
  116    HA   LYS  20           HA       LYS  20   2.897  -6.654   5.195
  117    HB2  LYS  20           1HB      LYS  20   4.114  -4.557   5.927
  118    HB3  LYS  20           2HB      LYS  20   2.728  -3.643   5.346
  119    HG2  LYS  20           1HG      LYS  20   1.284  -4.778   6.931
  120    HG3  LYS  20           2HG      LYS  20   2.641  -5.762   7.486
  121    HD2  LYS  20           1HD      LYS  20   3.750  -3.864   8.394
  122    HD3  LYS  20           2HD      LYS  20   2.626  -2.752   7.610
  123    HE2  LYS  20           1HE      LYS  20   1.773  -4.778   9.665
  124    HE3  LYS  20           2HE      LYS  20   2.265  -3.138  10.081
  125    HZ1  LYS  20           3HZ      LYS  20   0.498  -2.454   8.373
  126    HZ2  LYS  20           1HZ      LYS  20  -0.020  -2.985   9.894
  127    HZ3  LYS  20           2HZ      LYS  20  -0.101  -4.025   8.563
  128    H    ALA  21           H        ALA  21   0.671  -6.554   5.883
  129    HA   ALA  21           HA       ALA  21  -1.117  -5.876   3.658
  130    HB1  ALA  21           3HB      ALA  21  -2.688  -7.293   5.319
  131    HB2  ALA  21           1HB      ALA  21  -1.673  -8.021   4.074
  132    HB3  ALA  21           2HB      ALA  21  -1.111  -7.957   5.745
  133    H    PHE  22           H        PHE  22  -2.989  -4.668   3.960
  134    HA   PHE  22           HA       PHE  22  -3.394  -3.416   6.574
  135    HB2  PHE  22           1HB      PHE  22  -3.304  -1.792   4.028
  136    HB3  PHE  22           2HB      PHE  22  -3.453  -1.192   5.677
  137    HD1  PHE  22           HD1      PHE  22  -1.147  -2.997   3.397
  138    HD2  PHE  22           HD2      PHE  22  -1.562  -0.611   6.897
  139    HE1  PHE  22           HE1      PHE  22   1.299  -2.773   3.530
  140    HE2  PHE  22           HE2      PHE  22   0.884  -0.383   7.036
  141    HZ   PHE  22           HZ       PHE  22   2.318  -1.464   5.350
  142    H    SER  23           H        SER  23  -5.488  -2.356   6.780
  143    HA   SER  23           HA       SER  23  -7.560  -3.926   5.597
  144    HB2  SER  23           1HB      SER  23  -7.615  -3.001   7.936
  145    HB3  SER  23           2HB      SER  23  -7.873  -1.403   7.237
  146    HG   SER  23           HG       SER  23  -9.859  -1.954   6.655
  147    H    HIS  24           H        HIS  24  -7.042  -0.394   5.596
  148    HA   HIS  24           HA       HIS  24  -8.472  -0.271   3.029
  149    HB2  HIS  24           1HB      HIS  24  -9.203   1.078   5.136
  150    HB3  HIS  24           2HB      HIS  24  -7.856   2.134   4.718
  151    HD1  HIS  24           HD1      HIS  24  -9.601   4.035   4.254
  152    HD2  HIS  24           HD2      HIS  24  -9.892   0.742   1.738
  153    HE1  HIS  24           HE1      HIS  24 -11.047   4.780   2.336
  154    H    HIS  25           H        HIS  25  -7.586   0.766   1.267
  155    HA   HIS  25           HA       HIS  25  -4.942   0.552   0.704
  156    HB2  HIS  25           1HB      HIS  25  -5.267   2.149  -1.105
  157    HB3  HIS  25           2HB      HIS  25  -6.683   1.112  -0.960
  158    HD1  HIS  25           HD1      HIS  25  -8.770   2.248   0.344
  159    HD2  HIS  25           HD2      HIS  25  -5.806   4.815  -1.029
  160    HE1  HIS  25           HE1      HIS  25  -9.812   4.537   0.340
  161    H    ALA  26           H        ALA  26  -6.505   3.555   1.825
  162    HA   ALA  26           HA       ALA  26  -4.545   5.349   1.938
  163    HB1  ALA  26           3HB      ALA  26  -6.853   4.808   3.582
  164    HB2  ALA  26           1HB      ALA  26  -5.556   5.542   4.525
  165    HB3  ALA  26           2HB      ALA  26  -6.165   6.353   3.081
  166    H    SER  27           H        SER  27  -5.008   3.208   4.755
  167    HA   SER  27           HA       SER  27  -2.817   3.706   6.212
  168    HB2  SER  27           1HB      SER  27  -4.638   1.797   6.395
  169    HB3  SER  27           2HB      SER  27  -3.358   0.810   5.690
  170    HG   SER  27           HG       SER  27  -2.865   0.662   7.762
  171    H    LEU  28           H        LEU  28  -2.845   1.587   3.363
  172    HA   LEU  28           HA       LEU  28  -0.050   1.028   3.479
  173    HB2  LEU  28           1HB      LEU  28  -1.312  -0.589   2.380
  174    HB3  LEU  28           2HB      LEU  28  -2.206   0.609   1.445
  175    HG   LEU  28           HG       LEU  28  -0.137   1.043   0.135
  176   HD11  LEU  28          1HD1      LEU  28   1.105  -1.478   0.945
  177   HD12  LEU  28          2HD1      LEU  28   1.159  -0.215   2.174
  178   HD13  LEU  28          3HD1      LEU  28   1.836   0.083   0.573
  179   HD21  LEU  28          3HD2      LEU  28  -0.275  -1.712  -0.484
  180   HD22  LEU  28          1HD2      LEU  28  -1.083  -0.367  -1.290
  181   HD23  LEU  28          2HD2      LEU  28  -1.882  -1.206   0.041
  182    H    THR  29           H        THR  29  -2.052   3.290   1.640
  183    HA   THR  29           HA       THR  29  -0.079   4.295  -0.065
  184    HB   THR  29           HB       THR  29  -2.593   5.532   1.038
  185    HG1  THR  29           HG1      THR  29  -2.915   5.369  -1.425
  186   HG21  THR  29          3HG2      THR  29  -0.361   6.888  -0.192
  187   HG22  THR  29          1HG2      THR  29  -1.847   7.559   0.477
  188   HG23  THR  29          2HG2      THR  29  -1.803   7.011  -1.198
  189    H    GLN  30           H        GLN  30  -1.251   5.677   3.010
  190    HA   GLN  30           HA       GLN  30   0.671   7.727   3.140
  191    HB2  GLN  30           1HB      GLN  30  -1.533   7.403   4.476
  192    HB3  GLN  30           2HB      GLN  30  -0.534   6.481   5.591
  193    HG2  GLN  30           1HG      GLN  30   0.843   8.381   6.037
  194    HG3  GLN  30           2HG      GLN  30   0.045   9.315   4.772
  195   HE21  GLN  30          1HE2      GLN  30   0.291   9.108   7.951
  196   HE22  GLN  30          2HE2      GLN  30  -1.290   9.602   8.441
  197    H    HIS  31           H        HIS  31   0.643   4.434   4.413
  198    HA   HIS  31           HA       HIS  31   2.940   4.565   5.994
  199    HB2  HIS  31           1HB      HIS  31   1.785   2.604   6.336
  200    HB3  HIS  31           2HB      HIS  31   1.452   2.375   4.622
  201    HD1  HIS  31           HD1      HIS  31   4.250   1.963   7.129
  202    HD2  HIS  31           HD2      HIS  31   3.190   0.709   3.313
  203    HE1  HIS  31           HE1      HIS  31   5.940   0.209   6.504
  204    H    GLN  32           H        GLN  32   2.599   3.623   2.580
  205    HA   GLN  32           HA       GLN  32   5.031   2.846   1.824
  206    HB2  GLN  32           1HB      GLN  32   3.142   4.756   0.502
  207    HB3  GLN  32           2HB      GLN  32   4.694   4.412  -0.249
  208    HG2  GLN  32           1HG      GLN  32   4.059   1.953  -0.039
  209    HG3  GLN  32           2HG      GLN  32   2.428   2.531   0.302
  210   HE21  GLN  32          1HE2      GLN  32   3.941   1.129  -2.015
  211   HE22  GLN  32          2HE2      GLN  32   3.347   1.954  -3.411
  212    H    ARG  33           H        ARG  33   4.209   6.133   2.761
  213    HA   ARG  33           HA       ARG  33   6.309   7.629   1.954
  214    HB2  ARG  33           1HB      ARG  33   4.807   7.585   4.547
  215    HB3  ARG  33           2HB      ARG  33   6.159   8.691   4.342
  216    HG2  ARG  33           1HG      ARG  33   4.936   9.400   2.174
  217    HG3  ARG  33           2HG      ARG  33   3.532   8.639   2.925
  218    HD2  ARG  33           1HD      ARG  33   3.406  10.900   3.545
  219    HD3  ARG  33           2HD      ARG  33   4.044  10.070   4.964
  220    HE   ARG  33           HE       ARG  33   6.030  11.199   4.702
  221   HH11  ARG  33          1HH1      ARG  33   4.056  11.619   1.865
  222   HH12  ARG  33          2HH1      ARG  33   5.071  12.846   1.181
  223   HH21  ARG  33          1HH2      ARG  33   7.374  12.813   3.812
  224   HH22  ARG  33          2HH2      ARG  33   6.958  13.524   2.289
  225    H    VAL  34           H        VAL  34   6.332   5.699   4.956
  226    HA   VAL  34           HA       VAL  34   8.811   6.110   5.917
  227    HB   VAL  34           HB       VAL  34   8.874   3.787   6.709
  228   HG11  VAL  34          1HG1      VAL  34   6.350   5.372   6.880
  229   HG12  VAL  34          2HG1      VAL  34   6.444   3.793   7.662
  230   HG13  VAL  34          3HG1      VAL  34   7.574   5.071   8.113
  231   HG21  VAL  34          3HG2      VAL  34   6.626   2.521   5.998
  232   HG22  VAL  34          1HG2      VAL  34   6.921   3.431   4.516
  233   HG23  VAL  34          2HG2      VAL  34   8.149   2.325   5.132
  234    H    HIS  35           H        HIS  35   8.026   4.102   3.118
  235    HA   HIS  35           HA       HIS  35  10.782   3.339   2.708
  236    HB2  HIS  35           1HB      HIS  35   8.441   2.958   0.834
  237    HB3  HIS  35           2HB      HIS  35   9.977   2.097   0.804
  238    HD1  HIS  35           HD1      HIS  35  10.116   1.416   3.850
  239    HD2  HIS  35           HD2      HIS  35   6.794   0.850   1.421
  240    HE1  HIS  35           HE1      HIS  35   8.756  -0.373   4.978
  241    H    SER  36           H        SER  36  12.238   4.368   1.499
  242    HA   SER  36           HA       SER  36  11.516   6.868   0.248
  243    HB2  SER  36           1HB      SER  36  13.659   6.399   1.586
  244    HB3  SER  36           2HB      SER  36  14.235   5.569   0.141
  245    HG   SER  36           HG       SER  36  13.489   8.292   0.396
  246    H    GLY  37           H        GLY  37  13.162   3.902  -0.872
  247    HA2  GLY  37           1HA      GLY  37  11.799   3.276  -3.091
  248    HA3  GLY  37           2HA      GLY  37  12.722   4.667  -3.639
  249    H    GLU  38           H        GLU  38  13.113   1.507  -2.061
  250    HA   GLU  38           HA       GLU  38  15.744   1.054  -2.084
  251    HB2  GLU  38           1HB      GLU  38  13.786  -0.597  -1.698
  252    HB3  GLU  38           2HB      GLU  38  13.978  -0.990  -3.401
  253    HG2  GLU  38           1HG      GLU  38  16.328  -1.075  -1.560
  254    HG3  GLU  38           2HG      GLU  38  15.185  -2.415  -1.617
  255    H    LYS  39           H        LYS  39  17.410   0.883  -3.470
  256    HA   LYS  39           HA       LYS  39  17.548   2.037  -5.892
  257    HB2  LYS  39           1HB      LYS  39  19.015  -0.451  -5.007
  258    HB3  LYS  39           2HB      LYS  39  19.452   0.492  -6.426
  259    HG2  LYS  39           1HG      LYS  39  19.253   1.839  -3.773
  260    HG3  LYS  39           2HG      LYS  39  20.678   0.873  -4.163
  261    HD2  LYS  39           1HD      LYS  39  19.647   3.019  -5.998
  262    HD3  LYS  39           2HD      LYS  39  20.780   3.367  -4.690
  263    HE2  LYS  39           1HE      LYS  39  21.336   1.210  -6.698
  264    HE3  LYS  39           2HE      LYS  39  21.717   2.896  -7.044
  265    HZ1  LYS  39           3HZ      LYS  39  23.020   1.039  -5.248
  266    HZ2  LYS  39           1HZ      LYS  39  22.797   2.593  -4.617
  267    HZ3  LYS  39           2HZ      LYS  39  23.649   2.382  -6.062
  268    HA   PRO  40           HA       PRO  40  14.680  -0.645  -8.152
  269    HB2  PRO  40           1HB      PRO  40  14.229   1.156 -10.132
  270    HB3  PRO  40           2HB      PRO  40  13.404   1.219  -8.570
  271    HG2  PRO  40           1HG      PRO  40  15.770   2.784  -9.527
  272    HG3  PRO  40           2HG      PRO  40  14.357   3.340  -8.611
  273    HD2  PRO  40           1HD      PRO  40  16.742   2.824  -7.439
  274    HD3  PRO  40           2HD      PRO  40  15.195   2.567  -6.608
  275    H    SER  41           H        SER  41  17.129   1.404  -9.746
  276    HA   SER  41           HA       SER  41  18.340   1.034 -11.672
  277    HB2  SER  41           1HB      SER  41  19.922  -0.809 -11.406
  278    HB3  SER  41           2HB      SER  41  19.684   0.009  -9.862
  279    HG   SER  41           HG       SER  41  19.471  -2.083  -9.351
  280    H    GLY  42           H        GLY  42  15.697   0.439 -12.197
  281    HA2  GLY  42           1HA      GLY  42  14.425  -0.596 -13.805
  282    HA3  GLY  42           2HA      GLY  42  15.926  -1.221 -14.473
  283    HA   PRO  43           HA       PRO  43  14.270  -4.407 -11.194
  284    HB2  PRO  43           1HB      PRO  43  11.630  -4.170 -10.608
  285    HB3  PRO  43           2HB      PRO  43  12.897  -3.368  -9.672
  286    HG2  PRO  43           1HG      PRO  43  11.138  -2.253 -11.822
  287    HG3  PRO  43           2HG      PRO  43  11.613  -1.526 -10.276
  288    HD2  PRO  43           1HD      PRO  43  12.791  -0.861 -12.622
  289    HD3  PRO  43           2HD      PRO  43  13.668  -0.858 -11.078
  290    H    SER  44           H        SER  44  13.686  -6.385 -11.922
  291    HA   SER  44           HA       SER  44  13.175  -7.024 -14.471
  292    HB2  SER  44           1HB      SER  44  12.134  -8.412 -11.998
  293    HB3  SER  44           2HB      SER  44  12.000  -9.108 -13.613
  294    HG   SER  44           HG       SER  44  14.098  -9.474 -13.648
  295    H    SER  45           H        SER  45  11.740  -6.169 -15.824
  296    HA   SER  45           HA       SER  45   9.115  -5.359 -14.925
  297    HB2  SER  45           1HB      SER  45   8.831  -4.457 -17.161
  298    HB3  SER  45           2HB      SER  45  10.427  -4.010 -16.560
  299    HG   SER  45           HG       SER  45   9.728  -5.615 -18.676
  300    H    GLY  46           H        GLY  46   7.138  -6.056 -15.978
  301    HA2  GLY  46           1HA      GLY  46   6.990  -8.305 -17.671
  302    HA3  GLY  46           2HA      GLY  46   6.826  -8.837 -16.004
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1   2.603 -28.586  18.474
    2    HA2  GLY   1           1HA      GLY   1   2.736 -25.799  18.712
    3    HA3  GLY   1           2HA      GLY   1   2.021 -26.666  17.361
    4    H    SER   2           H        SER   2   1.036 -24.223  18.290
    5    HA   SER   2           HA       SER   2  -1.699 -24.953  18.793
    6    HB2  SER   2           1HB      SER   2  -1.986 -23.724  20.864
    7    HB3  SER   2           2HB      SER   2  -0.722 -24.933  21.090
    8    HG   SER   2           HG       SER   2   0.702 -23.398  21.359
    9    H    SER   3           H        SER   3  -2.826 -23.697  17.481
   10    HA   SER   3           HA       SER   3  -2.233 -20.847  17.326
   11    HB2  SER   3           1HB      SER   3  -2.048 -20.775  14.947
   12    HB3  SER   3           2HB      SER   3  -0.948 -22.041  15.491
   13    HG   SER   3           HG       SER   3  -2.866 -23.471  15.080
   14    H    GLY   4           H        GLY   4  -3.963 -19.602  16.346
   15    HA2  GLY   4           1HA      GLY   4  -6.495 -21.008  15.948
   16    HA3  GLY   4           2HA      GLY   4  -6.422 -19.849  17.268
   17    H    SER   5           H        SER   5  -8.228 -18.921  15.948
   18    HA   SER   5           HA       SER   5  -7.137 -16.831  14.237
   19    HB2  SER   5           1HB      SER   5  -7.787 -18.680  12.702
   20    HB3  SER   5           2HB      SER   5  -9.435 -18.579  13.323
   21    HG   SER   5           HG       SER   5  -9.684 -16.626  12.386
   22    H    SER   6           H        SER   6  -8.099 -14.921  14.578
   23    HA   SER   6           HA       SER   6 -10.377 -14.861  16.410
   24    HB2  SER   6           1HB      SER   6  -8.355 -12.793  15.556
   25    HB3  SER   6           2HB      SER   6  -9.806 -12.359  16.458
   26    HG   SER   6           HG       SER   6  -7.925 -14.304  17.310
   27    H    GLY   7           H        GLY   7  -9.363 -13.026  13.515
   28    HA2  GLY   7           1HA      GLY   7 -11.754 -13.475  12.090
   29    HA3  GLY   7           2HA      GLY   7 -11.881 -11.946  12.947
   30    H    THR   8           H        THR   8 -10.020 -13.730  10.546
   31    HA   THR   8           HA       THR   8  -8.265 -11.694   9.777
   32    HB   THR   8           HB       THR   8  -8.181 -12.901   7.558
   33    HG1  THR   8           HG1      THR   8  -9.818 -14.168   7.151
   34   HG21  THR   8          3HG2      THR   8  -7.299 -13.713  10.123
   35   HG22  THR   8          1HG2      THR   8  -6.581 -14.085   8.556
   36   HG23  THR   8          2HG2      THR   8  -7.789 -15.165   9.252
   37    H    GLY   9           H        GLY   9  -8.299 -10.548   7.647
   38    HA2  GLY   9           1HA      GLY   9 -10.965  -9.888   6.655
   39    HA3  GLY   9           2HA      GLY   9 -10.047  -8.579   7.385
   40    H    GLU  10           H        GLU  10 -10.964  -8.662   4.690
   41    HA   GLU  10           HA       GLU  10  -9.270  -9.506   2.736
   42    HB2  GLU  10           1HB      GLU  10 -10.864  -6.974   2.998
   43    HB3  GLU  10           2HB      GLU  10  -9.877  -7.266   1.572
   44    HG2  GLU  10           1HG      GLU  10 -11.148  -9.532   1.490
   45    HG3  GLU  10           2HG      GLU  10 -12.318  -8.697   2.510
   46    H    LYS  11           H        LYS  11  -7.137  -9.393   2.595
   47    HA   LYS  11           HA       LYS  11  -5.816  -6.853   3.288
   48    HB2  LYS  11           1HB      LYS  11  -3.927  -8.061   4.175
   49    HB3  LYS  11           2HB      LYS  11  -5.385  -8.621   4.983
   50    HG2  LYS  11           1HG      LYS  11  -5.302 -10.689   4.003
   51    HG3  LYS  11           2HG      LYS  11  -4.413 -10.106   2.594
   52    HD2  LYS  11           1HD      LYS  11  -2.586  -9.620   4.491
   53    HD3  LYS  11           2HD      LYS  11  -3.423 -10.979   5.245
   54    HE2  LYS  11           1HE      LYS  11  -2.665 -11.211   2.380
   55    HE3  LYS  11           2HE      LYS  11  -1.386 -11.329   3.587
   56    HZ1  LYS  11           3HZ      LYS  11  -2.019 -13.494   3.459
   57    HZ2  LYS  11           1HZ      LYS  11  -3.627 -13.138   3.071
   58    HZ3  LYS  11           2HZ      LYS  11  -3.089 -12.987   4.667
   59    HA   PRO  12           HA       PRO  12  -4.813  -8.576  -1.044
   60    HB2  PRO  12           1HB      PRO  12  -6.272  -6.819  -2.511
   61    HB3  PRO  12           2HB      PRO  12  -6.912  -8.370  -1.955
   62    HG2  PRO  12           1HG      PRO  12  -7.291  -5.637  -0.793
   63    HG3  PRO  12           2HG      PRO  12  -8.485  -6.927  -1.031
   64    HD2  PRO  12           1HD      PRO  12  -7.337  -6.431   1.370
   65    HD3  PRO  12           2HD      PRO  12  -7.824  -8.061   0.864
   66    H    TYR  13           H        TYR  13  -4.370  -5.939   0.871
   67    HA   TYR  13           HA       TYR  13  -2.830  -4.458  -1.148
   68    HB2  TYR  13           1HB      TYR  13  -3.921  -3.626   1.542
   69    HB3  TYR  13           2HB      TYR  13  -2.808  -2.635   0.604
   70    HD1  TYR  13           HD1      TYR  13  -6.196  -4.105   0.654
   71    HD2  TYR  13           HD2      TYR  13  -3.566  -1.362  -1.260
   72    HE1  TYR  13           HE1      TYR  13  -8.098  -3.152  -0.581
   73    HE2  TYR  13           HE2      TYR  13  -5.461  -0.400  -2.499
   74    HH   TYR  13           HH       TYR  13  -8.162  -1.744  -3.059
   75    H    GLU  14           H        GLU  14  -0.702  -4.686  -1.158
   76    HA   GLU  14           HA       GLU  14   0.690  -5.238   1.366
   77    HB2  GLU  14           1HB      GLU  14   0.764  -6.850  -1.149
   78    HB3  GLU  14           2HB      GLU  14   2.227  -6.720  -0.184
   79    HG2  GLU  14           1HG      GLU  14   1.362  -8.581   0.758
   80    HG3  GLU  14           2HG      GLU  14   0.550  -7.378   1.760
   81    H    CYS  15           H        CYS  15   2.864  -4.543   1.445
   82    HA   CYS  15           HA       CYS  15   3.401  -2.289  -0.306
   83    HB2  CYS  15           1HB      CYS  15   3.682  -2.236   2.222
   84    HB3  CYS  15           2HB      CYS  15   5.100  -3.254   1.995
   85    H    ASP  16           H        ASP  16   4.880  -2.235  -1.885
   86    HA   ASP  16           HA       ASP  16   6.231  -4.694  -2.594
   87    HB2  ASP  16           1HB      ASP  16   5.916  -2.016  -3.935
   88    HB3  ASP  16           2HB      ASP  16   7.023  -3.234  -4.562
   89    H    VAL  17           H        VAL  17   7.045  -3.108  -0.199
   90    HA   VAL  17           HA       VAL  17   9.891  -2.845  -0.903
   91    HB   VAL  17           HB       VAL  17   8.376  -1.036   0.986
   92   HG11  VAL  17          1HG1      VAL  17  11.060  -1.761   1.040
   93   HG12  VAL  17          2HG1      VAL  17  11.037  -0.187   0.242
   94   HG13  VAL  17          3HG1      VAL  17  10.321  -0.376   1.843
   95   HG21  VAL  17          3HG2      VAL  17   7.826  -0.052  -0.972
   96   HG22  VAL  17          1HG2      VAL  17   9.460   0.601  -0.857
   97   HG23  VAL  17          2HG2      VAL  17   9.147  -0.820  -1.853
   98    H    CYS  18           H        CYS  18   7.592  -3.162   1.797
   99    HA   CYS  18           HA       CYS  18   9.597  -4.803   3.200
  100    HB2  CYS  18           1HB      CYS  18   8.331  -4.212   5.278
  101    HB3  CYS  18           2HB      CYS  18   9.089  -2.835   4.486
  102    H    ARG  19           H        ARG  19   6.813  -5.000   1.437
  103    HA   ARG  19           HA       ARG  19   5.324  -6.674   1.043
  104    HB2  ARG  19           1HB      ARG  19   7.023  -8.282   2.959
  105    HB3  ARG  19           2HB      ARG  19   5.836  -8.926   1.832
  106    HG2  ARG  19           1HG      ARG  19   8.202  -7.338   0.897
  107    HG3  ARG  19           2HG      ARG  19   8.291  -9.078   1.179
  108    HD2  ARG  19           1HD      ARG  19   6.222  -7.813  -0.602
  109    HD3  ARG  19           2HD      ARG  19   7.796  -8.343  -1.194
  110    HE   ARG  19           HE       ARG  19   6.479 -10.419   0.228
  111   HH11  ARG  19          1HH1      ARG  19   6.516  -8.735  -2.819
  112   HH12  ARG  19          2HH1      ARG  19   5.874 -10.073  -3.714
  113   HH21  ARG  19          1HH2      ARG  19   5.634 -12.187  -0.940
  114   HH22  ARG  19          2HH2      ARG  19   5.372 -12.035  -2.644
  115    H    LYS  20           H        LYS  20   4.848  -4.755   3.120
  116    HA   LYS  20           HA       LYS  20   3.750  -6.016   5.422
  117    HB2  LYS  20           1HB      LYS  20   3.749  -3.276   4.270
  118    HB3  LYS  20           2HB      LYS  20   2.479  -3.659   5.424
  119    HG2  LYS  20           1HG      LYS  20   5.361  -4.195   6.045
  120    HG3  LYS  20           2HG      LYS  20   4.638  -2.605   6.302
  121    HD2  LYS  20           1HD      LYS  20   3.367  -5.086   7.411
  122    HD3  LYS  20           2HD      LYS  20   4.678  -4.272   8.268
  123    HE2  LYS  20           1HE      LYS  20   3.406  -2.255   8.434
  124    HE3  LYS  20           2HE      LYS  20   2.158  -2.890   7.364
  125    HZ1  LYS  20           3HZ      LYS  20   2.689  -4.472   9.734
  126    HZ2  LYS  20           1HZ      LYS  20   1.214  -4.056   9.016
  127    HZ3  LYS  20           2HZ      LYS  20   2.006  -2.952  10.023
  128    H    ALA  21           H        ALA  21   1.315  -5.346   5.938
  129    HA   ALA  21           HA       ALA  21  -0.442  -5.764   3.662
  130    HB1  ALA  21           3HB      ALA  21  -0.137  -8.025   4.079
  131    HB2  ALA  21           1HB      ALA  21  -0.039  -7.792   5.825
  132    HB3  ALA  21           2HB      ALA  21  -1.593  -7.650   5.001
  133    H    PHE  22           H        PHE  22  -2.238  -4.597   3.891
  134    HA   PHE  22           HA       PHE  22  -3.132  -3.897   6.604
  135    HB2  PHE  22           1HB      PHE  22  -3.150  -1.963   4.284
  136    HB3  PHE  22           2HB      PHE  22  -3.527  -1.618   5.968
  137    HD1  PHE  22           HD1      PHE  22  -0.783  -2.617   3.690
  138    HD2  PHE  22           HD2      PHE  22  -1.856  -0.959   7.461
  139    HE1  PHE  22           HE1      PHE  22   1.566  -1.998   4.083
  140    HE2  PHE  22           HE2      PHE  22   0.491  -0.336   7.859
  141    HZ   PHE  22           HZ       PHE  22   2.205  -0.855   6.168
  142    H    SER  23           H        SER  23  -5.396  -2.771   6.404
  143    HA   SER  23           HA       SER  23  -7.068  -4.645   4.926
  144    HB2  SER  23           1HB      SER  23  -8.924  -3.594   6.265
  145    HB3  SER  23           2HB      SER  23  -7.666  -4.358   7.237
  146    HG   SER  23           HG       SER  23  -7.594  -2.485   8.189
  147    H    HIS  24           H        HIS  24  -7.110  -1.122   5.502
  148    HA   HIS  24           HA       HIS  24  -8.642  -0.713   3.076
  149    HB2  HIS  24           1HB      HIS  24  -8.805   0.561   5.382
  150    HB3  HIS  24           2HB      HIS  24  -7.525   1.548   4.683
  151    HD1  HIS  24           HD1      HIS  24  -8.279   3.427   3.252
  152    HD2  HIS  24           HD2      HIS  24 -11.204   0.503   3.649
  153    HE1  HIS  24           HE1      HIS  24 -10.311   4.347   2.091
  154    H    HIS  25           H        HIS  25  -7.970   0.567   1.315
  155    HA   HIS  25           HA       HIS  25  -5.353   0.120   0.423
  156    HB2  HIS  25           1HB      HIS  25  -5.941   1.318  -1.509
  157    HB3  HIS  25           2HB      HIS  25  -7.468   0.647  -0.944
  158    HD1  HIS  25           HD1      HIS  25  -8.950   2.417   0.535
  159    HD2  HIS  25           HD2      HIS  25  -6.004   3.994  -1.935
  160    HE1  HIS  25           HE1      HIS  25  -9.540   4.845   0.250
  161    H    ALA  26           H        ALA  26  -6.840   2.929   1.954
  162    HA   ALA  26           HA       ALA  26  -4.792   4.782   1.593
  163    HB1  ALA  26           3HB      ALA  26  -6.332   4.728   4.149
  164    HB2  ALA  26           1HB      ALA  26  -5.871   6.101   3.142
  165    HB3  ALA  26           2HB      ALA  26  -7.174   5.028   2.628
  166    H    SER  27           H        SER  27  -5.367   2.706   4.440
  167    HA   SER  27           HA       SER  27  -3.284   3.319   6.034
  168    HB2  SER  27           1HB      SER  27  -4.421   0.608   5.364
  169    HB3  SER  27           2HB      SER  27  -3.174   0.814   6.594
  170    HG   SER  27           HG       SER  27  -4.563   1.861   7.858
  171    H    LEU  28           H        LEU  28  -3.088   1.708   2.956
  172    HA   LEU  28           HA       LEU  28  -0.323   0.938   3.295
  173    HB2  LEU  28           1HB      LEU  28  -1.775  -0.464   1.969
  174    HB3  LEU  28           2HB      LEU  28  -2.151   0.886   0.900
  175    HG   LEU  28           HG       LEU  28   0.284   0.897   0.244
  176   HD11  LEU  28          1HD1      LEU  28   1.071  -0.369   2.227
  177   HD12  LEU  28          2HD1      LEU  28   1.615  -1.049   0.694
  178   HD13  LEU  28          3HD1      LEU  28   0.288  -1.808   1.573
  179   HD21  LEU  28          3HD2      LEU  28  -1.230   0.007  -1.316
  180   HD22  LEU  28          1HD2      LEU  28  -1.524  -1.431  -0.337
  181   HD23  LEU  28          2HD2      LEU  28   0.027  -1.220  -1.149
  182    H    THR  29           H        THR  29  -1.989   3.025   0.927
  183    HA   THR  29           HA       THR  29   0.168   4.244  -0.219
  184    HB   THR  29           HB       THR  29  -2.373   4.587  -0.662
  185    HG1  THR  29           HG1      THR  29  -1.165   5.620  -2.105
  186   HG21  THR  29          3HG2      THR  29  -2.962   5.578   1.468
  187   HG22  THR  29          1HG2      THR  29  -3.202   6.763   0.184
  188   HG23  THR  29          2HG2      THR  29  -1.784   6.868   1.228
  189    H    GLN  30           H        GLN  30  -1.336   5.036   2.872
  190    HA   GLN  30           HA       GLN  30   0.278   7.357   3.325
  191    HB2  GLN  30           1HB      GLN  30  -1.688   5.776   4.918
  192    HB3  GLN  30           2HB      GLN  30  -0.596   6.857   5.774
  193    HG2  GLN  30           1HG      GLN  30  -1.403   8.745   4.526
  194    HG3  GLN  30           2HG      GLN  30  -2.400   7.697   3.518
  195   HE21  GLN  30          1HE2      GLN  30  -3.981   9.363   4.350
  196   HE22  GLN  30          2HE2      GLN  30  -4.823   8.970   5.806
  197    H    HIS  31           H        HIS  31   0.541   3.954   4.025
  198    HA   HIS  31           HA       HIS  31   2.626   4.196   5.963
  199    HB2  HIS  31           1HB      HIS  31   1.603   2.163   6.217
  200    HB3  HIS  31           2HB      HIS  31   1.311   1.974   4.490
  201    HD1  HIS  31           HD1      HIS  31   3.613   1.007   7.178
  202    HD2  HIS  31           HD2      HIS  31   3.613   1.029   3.024
  203    HE1  HIS  31           HE1      HIS  31   5.508  -0.499   6.498
  204    H    GLN  32           H        GLN  32   2.590   3.185   2.546
  205    HA   GLN  32           HA       GLN  32   5.125   2.609   1.978
  206    HB2  GLN  32           1HB      GLN  32   3.157   4.290   0.482
  207    HB3  GLN  32           2HB      GLN  32   4.790   4.126  -0.149
  208    HG2  GLN  32           1HG      GLN  32   3.328   1.659   0.614
  209    HG3  GLN  32           2HG      GLN  32   2.851   2.494  -0.862
  210   HE21  GLN  32          1HE2      GLN  32   3.930  -0.090  -0.787
  211   HE22  GLN  32          2HE2      GLN  32   5.461  -0.064  -1.588
  212    H    ARG  33           H        ARG  33   3.979   5.800   2.854
  213    HA   ARG  33           HA       ARG  33   5.987   7.471   2.122
  214    HB2  ARG  33           1HB      ARG  33   4.309   7.332   4.595
  215    HB3  ARG  33           2HB      ARG  33   5.595   8.527   4.498
  216    HG2  ARG  33           1HG      ARG  33   3.476   9.485   3.821
  217    HG3  ARG  33           2HG      ARG  33   4.600   9.437   2.461
  218    HD2  ARG  33           1HD      ARG  33   2.690   7.180   2.886
  219    HD3  ARG  33           2HD      ARG  33   2.119   8.678   2.151
  220    HE   ARG  33           HE       ARG  33   3.905   6.726   0.978
  221   HH11  ARG  33          1HH1      ARG  33   2.621   9.959   0.845
  222   HH12  ARG  33          2HH1      ARG  33   3.002  10.182  -0.830
  223   HH21  ARG  33          1HH2      ARG  33   4.412   7.007  -1.228
  224   HH22  ARG  33          2HH2      ARG  33   4.020   8.502  -2.009
  225    H    VAL  34           H        VAL  34   6.001   5.401   5.016
  226    HA   VAL  34           HA       VAL  34   8.263   6.022   6.295
  227    HB   VAL  34           HB       VAL  34   8.630   3.665   6.831
  228   HG11  VAL  34          1HG1      VAL  34   5.807   4.674   6.748
  229   HG12  VAL  34          2HG1      VAL  34   6.205   3.118   7.480
  230   HG13  VAL  34          3HG1      VAL  34   6.920   4.600   8.114
  231   HG21  VAL  34          3HG2      VAL  34   6.502   2.984   4.814
  232   HG22  VAL  34          1HG2      VAL  34   8.228   2.882   4.462
  233   HG23  VAL  34          2HG2      VAL  34   7.526   1.880   5.733
  234    H    HIS  35           H        HIS  35   8.112   4.522   3.128
  235    HA   HIS  35           HA       HIS  35  11.021   4.295   3.011
  236    HB2  HIS  35           1HB      HIS  35   9.090   3.581   0.810
  237    HB3  HIS  35           2HB      HIS  35  10.727   2.982   1.061
  238    HD1  HIS  35           HD1      HIS  35  10.872   1.676   3.592
  239    HD2  HIS  35           HD2      HIS  35   7.276   1.723   1.512
  240    HE1  HIS  35           HE1      HIS  35   9.528  -0.231   4.530
  241    H    SER  36           H        SER  36  12.272   5.309   1.400
  242    HA   SER  36           HA       SER  36  11.327   7.946   0.704
  243    HB2  SER  36           1HB      SER  36  13.963   6.518   0.449
  244    HB3  SER  36           2HB      SER  36  13.691   8.065  -0.353
  245    HG   SER  36           HG       SER  36  13.764   9.051   1.514
  246    H    GLY  37           H        GLY  37  11.876   8.784  -1.558
  247    HA2  GLY  37           1HA      GLY  37  10.223   7.792  -3.454
  248    HA3  GLY  37           2HA      GLY  37  11.707   8.642  -3.860
  249    H    GLU  38           H        GLU  38  13.684   7.329  -4.035
  250    HA   GLU  38           HA       GLU  38  13.441   4.486  -4.323
  251    HB2  GLU  38           1HB      GLU  38  13.886   4.351  -6.702
  252    HB3  GLU  38           2HB      GLU  38  12.404   5.257  -6.428
  253    HG2  GLU  38           1HG      GLU  38  13.369   6.602  -7.971
  254    HG3  GLU  38           2HG      GLU  38  14.068   7.307  -6.514
  255    H    LYS  39           H        LYS  39  15.538   3.606  -5.395
  256    HA   LYS  39           HA       LYS  39  17.769   3.287  -5.006
  257    HB2  LYS  39           1HB      LYS  39  17.481   5.176  -6.848
  258    HB3  LYS  39           2HB      LYS  39  18.257   6.166  -5.619
  259    HG2  LYS  39           1HG      LYS  39  19.436   3.555  -6.500
  260    HG3  LYS  39           2HG      LYS  39  19.737   5.056  -7.379
  261    HD2  LYS  39           1HD      LYS  39  20.646   6.072  -5.358
  262    HD3  LYS  39           2HD      LYS  39  20.304   4.597  -4.449
  263    HE2  LYS  39           1HE      LYS  39  21.973   3.397  -5.528
  264    HE3  LYS  39           2HE      LYS  39  22.011   4.497  -6.905
  265    HZ1  LYS  39           3HZ      LYS  39  23.455   5.850  -5.885
  266    HZ2  LYS  39           1HZ      LYS  39  23.791   4.514  -4.903
  267    HZ3  LYS  39           2HZ      LYS  39  22.711   5.702  -4.373
  268    HA   PRO  40           HA       PRO  40  17.558   5.611  -0.898
  269    HB2  PRO  40           1HB      PRO  40  17.121   3.441   0.673
  270    HB3  PRO  40           2HB      PRO  40  15.811   4.388  -0.043
  271    HG2  PRO  40           1HG      PRO  40  17.001   1.800  -0.965
  272    HG3  PRO  40           2HG      PRO  40  15.296   2.282  -0.884
  273    HD2  PRO  40           1HD      PRO  40  16.714   2.321  -3.191
  274    HD3  PRO  40           2HD      PRO  40  15.412   3.478  -2.851
  275    H    SER  41           H        SER  41  19.215   5.648   0.625
  276    HA   SER  41           HA       SER  41  21.495   3.897   0.004
  277    HB2  SER  41           1HB      SER  41  21.520   6.573   1.419
  278    HB3  SER  41           2HB      SER  41  22.927   5.645   0.899
  279    HG   SER  41           HG       SER  41  22.514   6.140  -1.169
  280    H    GLY  42           H        GLY  42  22.676   2.918   1.663
  281    HA2  GLY  42           1HA      GLY  42  21.806   3.211   4.414
  282    HA3  GLY  42           2HA      GLY  42  21.428   1.659   3.683
  283    HA   PRO  43           HA       PRO  43  26.033   2.166   5.073
  284    HB2  PRO  43           1HB      PRO  43  25.904   1.660   7.737
  285    HB3  PRO  43           2HB      PRO  43  25.839   3.293   7.065
  286    HG2  PRO  43           1HG      PRO  43  23.599   1.536   7.992
  287    HG3  PRO  43           2HG      PRO  43  23.849   3.270   8.268
  288    HD2  PRO  43           1HD      PRO  43  22.152   2.324   6.381
  289    HD3  PRO  43           2HD      PRO  43  23.047   3.845   6.184
  290    H    SER  44           H        SER  44  26.278   0.234   3.939
  291    HA   SER  44           HA       SER  44  26.542  -2.117   5.548
  292    HB2  SER  44           1HB      SER  44  24.048  -1.981   4.846
  293    HB3  SER  44           2HB      SER  44  24.633  -2.421   3.242
  294    HG   SER  44           HG       SER  44  25.539  -3.952   5.380
  295    H    SER  45           H        SER  45  27.285  -4.009   4.175
  296    HA   SER  45           HA       SER  45  28.488  -3.244   1.635
  297    HB2  SER  45           1HB      SER  45  30.725  -3.691   2.249
  298    HB3  SER  45           2HB      SER  45  30.095  -2.705   3.569
  299    HG   SER  45           HG       SER  45  31.018  -5.260   3.606
  300    H    GLY  46           H        GLY  46  28.202  -4.841   0.231
  301    HA2  GLY  46           1HA      GLY  46  27.675  -7.540   1.283
  302    HA3  GLY  46           2HA      GLY  46  27.125  -6.931  -0.271
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1  11.368 -21.441  19.801
    2    HA2  GLY   1           1HA      GLY   1  12.702 -21.008  17.465
    3    HA3  GLY   1           2HA      GLY   1  11.688 -22.417  17.737
    4    H    SER   2           H        SER   2  10.996 -22.551  15.609
    5    HA   SER   2           HA       SER   2   9.681 -20.266  14.394
    6    HB2  SER   2           1HB      SER   2   9.419 -21.756  12.435
    7    HB3  SER   2           2HB      SER   2  11.093 -21.675  12.983
    8    HG   SER   2           HG       SER   2   9.597 -23.677  14.142
    9    H    SER   3           H        SER   3   7.621 -19.831  14.766
   10    HA   SER   3           HA       SER   3   5.837 -22.004  15.617
   11    HB2  SER   3           1HB      SER   3   5.901 -19.058  16.124
   12    HB3  SER   3           2HB      SER   3   4.346 -19.889  16.167
   13    HG   SER   3           HG       SER   3   4.876 -20.567  18.071
   14    H    GLY   4           H        GLY   4   5.897 -19.141  13.499
   15    HA2  GLY   4           1HA      GLY   4   4.170 -20.579  11.620
   16    HA3  GLY   4           2HA      GLY   4   3.606 -19.027  12.224
   17    H    SER   5           H        SER   5   4.055 -19.591   9.503
   18    HA   SER   5           HA       SER   5   6.457 -17.987   8.925
   19    HB2  SER   5           1HB      SER   5   6.432 -18.990   6.687
   20    HB3  SER   5           2HB      SER   5   6.479 -20.243   7.927
   21    HG   SER   5           HG       SER   5   4.248 -20.539   7.627
   22    H    SER   6           H        SER   6   6.323 -16.244   7.521
   23    HA   SER   6           HA       SER   6   3.881 -14.808   7.550
   24    HB2  SER   6           1HB      SER   6   5.083 -13.144   6.183
   25    HB3  SER   6           2HB      SER   6   6.054 -13.671   7.558
   26    HG   SER   6           HG       SER   6   7.507 -14.223   6.161
   27    H    GLY   7           H        GLY   7   3.150 -13.730   5.368
   28    HA2  GLY   7           1HA      GLY   7   2.703 -14.056   3.032
   29    HA3  GLY   7           2HA      GLY   7   3.013 -15.772   3.253
   30    H    THR   8           H        THR   8   0.771 -13.201   4.251
   31    HA   THR   8           HA       THR   8  -1.398 -15.193   4.130
   32    HB   THR   8           HB       THR   8  -2.561 -13.886   5.916
   33    HG1  THR   8           HG1      THR   8  -0.071 -12.531   5.906
   34   HG21  THR   8          3HG2      THR   8  -1.454 -15.929   6.532
   35   HG22  THR   8          1HG2      THR   8  -1.133 -14.729   7.783
   36   HG23  THR   8          2HG2      THR   8   0.110 -15.118   6.594
   37    H    GLY   9           H        GLY   9  -2.361 -14.704   2.235
   38    HA2  GLY   9           1HA      GLY   9  -2.640 -11.987   1.319
   39    HA3  GLY   9           2HA      GLY   9  -3.269 -13.426   0.530
   40    H    GLU  10           H        GLU  10  -3.833 -12.001   3.746
   41    HA   GLU  10           HA       GLU  10  -6.651 -12.519   3.544
   42    HB2  GLU  10           1HB      GLU  10  -6.779 -11.480   5.768
   43    HB3  GLU  10           2HB      GLU  10  -5.527 -12.712   5.695
   44    HG2  GLU  10           1HG      GLU  10  -3.806 -11.106   5.661
   45    HG3  GLU  10           2HG      GLU  10  -4.935  -9.793   5.334
   46    H    LYS  11           H        LYS  11  -4.543  -9.829   2.965
   47    HA   LYS  11           HA       LYS  11  -6.889  -8.114   2.469
   48    HB2  LYS  11           1HB      LYS  11  -4.218  -7.547   3.647
   49    HB3  LYS  11           2HB      LYS  11  -4.927  -6.302   2.627
   50    HG2  LYS  11           1HG      LYS  11  -5.718  -5.665   4.668
   51    HG3  LYS  11           2HG      LYS  11  -7.035  -6.713   4.134
   52    HD2  LYS  11           1HD      LYS  11  -6.403  -8.440   5.553
   53    HD3  LYS  11           2HD      LYS  11  -4.752  -7.838   5.712
   54    HE2  LYS  11           1HE      LYS  11  -7.181  -6.427   6.804
   55    HE3  LYS  11           2HE      LYS  11  -6.173  -7.527   7.744
   56    HZ1  LYS  11           3HZ      LYS  11  -5.252  -5.014   6.454
   57    HZ2  LYS  11           1HZ      LYS  11  -4.285  -6.070   7.355
   58    HZ3  LYS  11           2HZ      LYS  11  -5.543  -5.227   8.107
   59    HA   PRO  12           HA       PRO  12  -5.752  -8.121  -1.790
   60    HB2  PRO  12           1HB      PRO  12  -7.069  -5.877  -2.565
   61    HB3  PRO  12           2HB      PRO  12  -7.893  -7.398  -2.202
   62    HG2  PRO  12           1HG      PRO  12  -7.546  -4.973  -0.481
   63    HG3  PRO  12           2HG      PRO  12  -8.987  -5.979  -0.719
   64    HD2  PRO  12           1HD      PRO  12  -7.386  -6.217   1.452
   65    HD3  PRO  12           2HD      PRO  12  -8.253  -7.598   0.749
   66    H    TYR  13           H        TYR  13  -5.136  -5.383   0.289
   67    HA   TYR  13           HA       TYR  13  -3.232  -4.275  -1.649
   68    HB2  TYR  13           1HB      TYR  13  -4.230  -3.078   0.943
   69    HB3  TYR  13           2HB      TYR  13  -3.223  -2.273  -0.255
   70    HD1  TYR  13           HD1      TYR  13  -6.602  -3.501   0.498
   71    HD2  TYR  13           HD2      TYR  13  -4.171  -1.411  -2.299
   72    HE1  TYR  13           HE1      TYR  13  -8.624  -2.700  -0.651
   73    HE2  TYR  13           HE2      TYR  13  -6.185  -0.603  -3.455
   74    HH   TYR  13           HH       TYR  13  -8.882  -1.761  -3.477
   75    H    GLU  14           H        GLU  14  -1.069  -4.077  -1.213
   76    HA   GLU  14           HA       GLU  14  -0.001  -4.763   1.380
   77    HB2  GLU  14           1HB      GLU  14  -0.347  -6.983   0.395
   78    HB3  GLU  14           2HB      GLU  14   0.588  -6.509  -1.016
   79    HG2  GLU  14           1HG      GLU  14   2.533  -6.133   0.523
   80    HG3  GLU  14           2HG      GLU  14   1.571  -6.879   1.798
   81    H    CYS  15           H        CYS  15   2.176  -4.179   1.635
   82    HA   CYS  15           HA       CYS  15   3.047  -2.088  -0.127
   83    HB2  CYS  15           1HB      CYS  15   3.335  -2.033   2.360
   84    HB3  CYS  15           2HB      CYS  15   4.531  -3.316   2.204
   85    H    ASP  16           H        ASP  16   4.441  -2.211  -1.763
   86    HA   ASP  16           HA       ASP  16   5.575  -4.784  -2.456
   87    HB2  ASP  16           1HB      ASP  16   6.080  -2.260  -3.998
   88    HB3  ASP  16           2HB      ASP  16   5.936  -3.913  -4.589
   89    H    VAL  17           H        VAL  17   6.586  -3.281  -0.113
   90    HA   VAL  17           HA       VAL  17   9.418  -3.218  -0.909
   91    HB   VAL  17           HB       VAL  17   8.091  -1.277   0.989
   92   HG11  VAL  17          1HG1      VAL  17  10.190  -1.533   1.905
   93   HG12  VAL  17          2HG1      VAL  17  10.947  -1.865   0.345
   94   HG13  VAL  17          3HG1      VAL  17  10.465  -0.219   0.762
   95   HG21  VAL  17          3HG2      VAL  17   9.497  -0.613  -1.580
   96   HG22  VAL  17          1HG2      VAL  17   7.771  -0.972  -1.526
   97   HG23  VAL  17          2HG2      VAL  17   8.416   0.399  -0.622
   98    H    CYS  18           H        CYS  18   7.168  -3.369   1.843
   99    HA   CYS  18           HA       CYS  18   9.106  -5.102   3.227
  100    HB2  CYS  18           1HB      CYS  18   7.980  -4.425   5.322
  101    HB3  CYS  18           2HB      CYS  18   8.666  -3.052   4.461
  102    H    ARG  19           H        ARG  19   6.211  -5.103   1.575
  103    HA   ARG  19           HA       ARG  19   4.596  -6.670   1.239
  104    HB2  ARG  19           1HB      ARG  19   6.344  -8.477   2.918
  105    HB3  ARG  19           2HB      ARG  19   5.070  -8.980   1.815
  106    HG2  ARG  19           1HG      ARG  19   7.554  -7.513   0.960
  107    HG3  ARG  19           2HG      ARG  19   7.373  -9.268   0.929
  108    HD2  ARG  19           1HD      ARG  19   5.353  -8.930  -0.527
  109    HD3  ARG  19           2HD      ARG  19   5.797  -7.227  -0.626
  110    HE   ARG  19           HE       ARG  19   8.053  -8.405  -1.424
  111   HH11  ARG  19          1HH1      ARG  19   4.737  -8.964  -2.325
  112   HH12  ARG  19          2HH1      ARG  19   5.125  -9.486  -3.931
  113   HH21  ARG  19          1HH2      ARG  19   8.577  -9.090  -3.536
  114   HH22  ARG  19          2HH2      ARG  19   7.309  -9.557  -4.619
  115    H    LYS  20           H        LYS  20   4.021  -4.872   3.169
  116    HA   LYS  20           HA       LYS  20   2.997  -6.371   5.468
  117    HB2  LYS  20           1HB      LYS  20   4.304  -4.193   5.719
  118    HB3  LYS  20           2HB      LYS  20   2.884  -3.384   5.069
  119    HG2  LYS  20           1HG      LYS  20   1.542  -4.231   6.919
  120    HG3  LYS  20           2HG      LYS  20   2.955  -5.069   7.566
  121    HD2  LYS  20           1HD      LYS  20   4.067  -2.750   7.578
  122    HD3  LYS  20           2HD      LYS  20   2.429  -2.118   7.392
  123    HE2  LYS  20           1HE      LYS  20   1.747  -2.950   9.464
  124    HE3  LYS  20           2HE      LYS  20   3.091  -4.088   9.553
  125    HZ1  LYS  20           3HZ      LYS  20   4.418  -2.555  10.456
  126    HZ2  LYS  20           1HZ      LYS  20   3.001  -1.695  10.792
  127    HZ3  LYS  20           2HZ      LYS  20   3.904  -1.329   9.410
  128    H    ALA  21           H        ALA  21   0.812  -6.306   6.070
  129    HA   ALA  21           HA       ALA  21  -1.010  -5.862   3.824
  130    HB1  ALA  21           3HB      ALA  21  -2.475  -6.988   5.889
  131    HB2  ALA  21           1HB      ALA  21  -1.781  -7.835   4.506
  132    HB3  ALA  21           2HB      ALA  21  -0.886  -7.741   6.023
  133    H    PHE  22           H        PHE  22  -2.808  -4.546   3.943
  134    HA   PHE  22           HA       PHE  22  -3.127  -2.918   6.366
  135    HB2  PHE  22           1HB      PHE  22  -3.028  -1.844   3.539
  136    HB3  PHE  22           2HB      PHE  22  -3.421  -0.900   4.972
  137    HD1  PHE  22           HD1      PHE  22  -0.762  -2.563   3.098
  138    HD2  PHE  22           HD2      PHE  22  -1.708  -0.259   6.549
  139    HE1  PHE  22           HE1      PHE  22   1.628  -2.080   3.426
  140    HE2  PHE  22           HE2      PHE  22   0.680   0.230   6.882
  141    HZ   PHE  22           HZ       PHE  22   2.352  -0.681   5.319
  142    H    SER  23           H        SER  23  -5.187  -2.586   6.968
  143    HA   SER  23           HA       SER  23  -7.276  -4.097   5.965
  144    HB2  SER  23           1HB      SER  23  -7.258  -1.573   7.617
  145    HB3  SER  23           2HB      SER  23  -8.756  -2.408   7.204
  146    HG   SER  23           HG       SER  23  -7.831  -4.293   8.196
  147    H    HIS  24           H        HIS  24  -6.345  -0.783   5.182
  148    HA   HIS  24           HA       HIS  24  -8.080  -0.929   2.819
  149    HB2  HIS  24           1HB      HIS  24  -8.332   1.675   3.306
  150    HB3  HIS  24           2HB      HIS  24  -9.440   0.493   3.994
  151    HD1  HIS  24           HD1      HIS  24  -7.374   3.260   4.937
  152    HD2  HIS  24           HD2      HIS  24  -8.535  -0.298   6.741
  153    HE1  HIS  24           HE1      HIS  24  -6.966   3.589   7.397
  154    H    HIS  25           H        HIS  25  -7.546   1.076   1.356
  155    HA   HIS  25           HA       HIS  25  -4.807   0.822   0.631
  156    HB2  HIS  25           1HB      HIS  25  -5.399   2.634  -1.045
  157    HB3  HIS  25           2HB      HIS  25  -6.357   1.160  -1.139
  158    HD1  HIS  25           HD1      HIS  25  -6.650   4.777  -0.770
  159    HD2  HIS  25           HD2      HIS  25  -9.008   1.453   0.038
  160    HE1  HIS  25           HE1      HIS  25  -8.983   5.666  -0.464
  161    H    ALA  26           H        ALA  26  -6.712   3.611   1.776
  162    HA   ALA  26           HA       ALA  26  -4.825   5.552   1.920
  163    HB1  ALA  26           3HB      ALA  26  -6.582   6.566   2.821
  164    HB2  ALA  26           1HB      ALA  26  -7.319   5.018   3.236
  165    HB3  ALA  26           2HB      ALA  26  -6.192   5.787   4.354
  166    H    SER  27           H        SER  27  -5.180   2.819   4.108
  167    HA   SER  27           HA       SER  27  -3.313   3.696   6.049
  168    HB2  SER  27           1HB      SER  27  -4.671   1.129   5.395
  169    HB3  SER  27           2HB      SER  27  -3.219   1.044   6.392
  170    HG   SER  27           HG       SER  27  -5.033   2.996   7.115
  171    H    LEU  28           H        LEU  28  -3.021   1.852   3.073
  172    HA   LEU  28           HA       LEU  28  -0.239   1.225   3.521
  173    HB2  LEU  28           1HB      LEU  28  -1.443  -0.390   2.302
  174    HB3  LEU  28           2HB      LEU  28  -2.132   0.823   1.225
  175    HG   LEU  28           HG       LEU  28   0.207   1.175   0.331
  176   HD11  LEU  28          1HD1      LEU  28   1.375   0.134   2.241
  177   HD12  LEU  28          2HD1      LEU  28   1.835  -0.565   0.689
  178   HD13  LEU  28          3HD1      LEU  28   0.727  -1.432   1.752
  179   HD21  LEU  28          3HD2      LEU  28  -0.652  -1.648  -0.130
  180   HD22  LEU  28          1HD2      LEU  28  -0.090  -0.440  -1.286
  181   HD23  LEU  28          2HD2      LEU  28  -1.712  -0.320  -0.604
  182    H    THR  29           H        THR  29  -2.039   3.250   1.206
  183    HA   THR  29           HA       THR  29   0.014   4.363  -0.210
  184    HB   THR  29           HB       THR  29  -2.558   4.805  -0.331
  185    HG1  THR  29           HG1      THR  29  -1.083   7.120  -0.893
  186   HG21  THR  29          3HG2      THR  29  -2.744   5.899   1.851
  187   HG22  THR  29          1HG2      THR  29  -3.207   6.996   0.552
  188   HG23  THR  29          2HG2      THR  29  -1.628   7.157   1.321
  189    H    GLN  30           H        GLN  30  -1.054   5.218   3.035
  190    HA   GLN  30           HA       GLN  30   0.686   7.488   3.250
  191    HB2  GLN  30           1HB      GLN  30  -1.502   7.069   4.528
  192    HB3  GLN  30           2HB      GLN  30  -0.551   6.011   5.562
  193    HG2  GLN  30           1HG      GLN  30   1.005   8.090   5.778
  194    HG3  GLN  30           2HG      GLN  30  -0.430   8.972   5.258
  195   HE21  GLN  30          1HE2      GLN  30   1.227   8.248   7.882
  196   HE22  GLN  30          2HE2      GLN  30  -0.035   8.124   9.055
  197    H    HIS  31           H        HIS  31   0.672   4.236   4.704
  198    HA   HIS  31           HA       HIS  31   3.032   4.387   6.129
  199    HB2  HIS  31           1HB      HIS  31   1.891   2.434   6.558
  200    HB3  HIS  31           2HB      HIS  31   1.513   2.155   4.861
  201    HD1  HIS  31           HD1      HIS  31   3.857   1.209   7.504
  202    HD2  HIS  31           HD2      HIS  31   3.744   1.071   3.354
  203    HE1  HIS  31           HE1      HIS  31   5.667  -0.403   6.836
  204    H    GLN  32           H        GLN  32   2.600   3.327   2.759
  205    HA   GLN  32           HA       GLN  32   5.020   2.545   1.965
  206    HB2  GLN  32           1HB      GLN  32   3.131   4.446   0.604
  207    HB3  GLN  32           2HB      GLN  32   4.625   3.941  -0.175
  208    HG2  GLN  32           1HG      GLN  32   2.624   1.966   0.870
  209    HG3  GLN  32           2HG      GLN  32   2.516   2.654  -0.750
  210   HE21  GLN  32          1HE2      GLN  32   2.680   0.232  -1.122
  211   HE22  GLN  32          2HE2      GLN  32   4.268  -0.395  -1.380
  212    H    ARG  33           H        ARG  33   4.151   5.951   2.463
  213    HA   ARG  33           HA       ARG  33   6.351   7.284   1.637
  214    HB2  ARG  33           1HB      ARG  33   4.622   7.662   4.057
  215    HB3  ARG  33           2HB      ARG  33   6.005   8.717   3.795
  216    HG2  ARG  33           1HG      ARG  33   3.946   9.704   2.947
  217    HG3  ARG  33           2HG      ARG  33   5.100   9.402   1.647
  218    HD2  ARG  33           1HD      ARG  33   3.901   7.326   1.095
  219    HD3  ARG  33           2HD      ARG  33   2.733   7.678   2.368
  220    HE   ARG  33           HE       ARG  33   1.768   9.278   1.014
  221   HH11  ARG  33          1HH1      ARG  33   4.747   8.154  -0.393
  222   HH12  ARG  33          2HH1      ARG  33   4.463   8.915  -1.923
  223   HH21  ARG  33          1HH2      ARG  33   1.383  10.284  -0.996
  224   HH22  ARG  33          2HH2      ARG  33   2.550  10.127  -2.265
  225    H    VAL  34           H        VAL  34   6.056   5.632   4.773
  226    HA   VAL  34           HA       VAL  34   8.302   6.180   6.089
  227    HB   VAL  34           HB       VAL  34   8.448   3.867   6.876
  228   HG11  VAL  34          1HG1      VAL  34   6.791   4.951   8.039
  229   HG12  VAL  34          2HG1      VAL  34   5.795   5.201   6.604
  230   HG13  VAL  34          3HG1      VAL  34   5.883   3.605   7.351
  231   HG21  VAL  34          3HG2      VAL  34   6.481   2.413   5.751
  232   HG22  VAL  34          1HG2      VAL  34   7.007   3.353   4.354
  233   HG23  VAL  34          2HG2      VAL  34   8.164   2.348   5.227
  234    H    HIS  35           H        HIS  35   8.173   4.241   3.148
  235    HA   HIS  35           HA       HIS  35  11.054   3.821   3.196
  236    HB2  HIS  35           1HB      HIS  35   9.205   3.019   0.961
  237    HB3  HIS  35           2HB      HIS  35  10.744   2.298   1.424
  238    HD1  HIS  35           HD1      HIS  35  10.560   1.303   4.086
  239    HD2  HIS  35           HD2      HIS  35   7.148   1.460   1.720
  240    HE1  HIS  35           HE1      HIS  35   8.949  -0.328   5.120
  241    H    SER  36           H        SER  36  12.488   4.993   2.087
  242    HA   SER  36           HA       SER  36  11.464   6.897   0.083
  243    HB2  SER  36           1HB      SER  36  12.226   7.950   2.244
  244    HB3  SER  36           2HB      SER  36  13.849   7.361   1.885
  245    HG   SER  36           HG       SER  36  12.659   9.566   0.994
  246    H    GLY  37           H        GLY  37  14.366   5.134   1.156
  247    HA2  GLY  37           1HA      GLY  37  15.265   3.652  -0.695
  248    HA3  GLY  37           2HA      GLY  37  15.280   5.126  -1.652
  249    H    GLU  38           H        GLU  38  16.355   6.998  -0.110
  250    HA   GLU  38           HA       GLU  38  19.106   6.321  -0.076
  251    HB2  GLU  38           1HB      GLU  38  18.106   8.614  -0.482
  252    HB3  GLU  38           2HB      GLU  38  17.849   8.719   1.254
  253    HG2  GLU  38           1HG      GLU  38  20.575   8.030   0.344
  254    HG3  GLU  38           2HG      GLU  38  20.018   9.676   0.049
  255    H    LYS  39           H        LYS  39  20.469   6.937   1.933
  256    HA   LYS  39           HA       LYS  39  21.213   6.026   3.909
  257    HB2  LYS  39           1HB      LYS  39  20.053   6.916   5.827
  258    HB3  LYS  39           2HB      LYS  39  20.037   8.123   4.548
  259    HG2  LYS  39           1HG      LYS  39  17.717   6.288   4.726
  260    HG3  LYS  39           2HG      LYS  39  17.883   7.530   5.969
  261    HD2  LYS  39           1HD      LYS  39  18.231   8.357   3.139
  262    HD3  LYS  39           2HD      LYS  39  16.597   7.971   3.683
  263    HE2  LYS  39           1HE      LYS  39  18.394   9.854   5.186
  264    HE3  LYS  39           2HE      LYS  39  17.343  10.398   3.880
  265    HZ1  LYS  39           3HZ      LYS  39  16.212   8.818   6.087
  266    HZ2  LYS  39           1HZ      LYS  39  15.460   9.961   5.092
  267    HZ3  LYS  39           2HZ      LYS  39  16.512  10.467   6.316
  268    HA   PRO  40           HA       PRO  40  18.135   2.419   3.680
  269    HB2  PRO  40           1HB      PRO  40  19.707   0.700   2.285
  270    HB3  PRO  40           2HB      PRO  40  18.584   1.822   1.507
  271    HG2  PRO  40           1HG      PRO  40  21.539   2.076   1.910
  272    HG3  PRO  40           2HG      PRO  40  20.569   2.455   0.475
  273    HD2  PRO  40           1HD      PRO  40  21.427   4.359   2.198
  274    HD3  PRO  40           2HD      PRO  40  19.892   4.492   1.316
  275    H    SER  41           H        SER  41  18.663   2.425   5.957
  276    HA   SER  41           HA       SER  41  20.991   0.777   6.674
  277    HB2  SER  41           1HB      SER  41  20.548   1.662   9.007
  278    HB3  SER  41           2HB      SER  41  21.048   2.873   7.825
  279    HG   SER  41           HG       SER  41  19.113   3.274   9.267
  280    H    GLY  42           H        GLY  42  20.490  -1.311   6.831
  281    HA2  GLY  42           1HA      GLY  42  17.823  -2.195   7.471
  282    HA3  GLY  42           2HA      GLY  42  19.218  -3.219   7.159
  283    HA   PRO  43           HA       PRO  43  18.163  -2.686  11.817
  284    HB2  PRO  43           1HB      PRO  43  16.515  -4.811  12.198
  285    HB3  PRO  43           2HB      PRO  43  15.922  -3.194  11.801
  286    HG2  PRO  43           1HG      PRO  43  16.335  -5.553  10.005
  287    HG3  PRO  43           2HG      PRO  43  14.980  -4.410  10.058
  288    HD2  PRO  43           1HD      PRO  43  16.960  -4.238   8.219
  289    HD3  PRO  43           2HD      PRO  43  16.120  -2.809   8.854
  290    H    SER  44           H        SER  44  19.559  -4.764   9.665
  291    HA   SER  44           HA       SER  44  20.136  -7.143  10.723
  292    HB2  SER  44           1HB      SER  44  22.178  -5.185   9.647
  293    HB3  SER  44           2HB      SER  44  22.473  -6.909   9.874
  294    HG   SER  44           HG       SER  44  21.632  -5.947   7.723
  295    H    SER  45           H        SER  45  20.416  -7.737  12.765
  296    HA   SER  45           HA       SER  45  21.323  -6.072  14.833
  297    HB2  SER  45           1HB      SER  45  20.001  -8.348  14.883
  298    HB3  SER  45           2HB      SER  45  21.614  -9.047  15.030
  299    HG   SER  45           HG       SER  45  20.409  -7.135  16.746
  300    H    GLY  46           H        GLY  46  23.285  -5.769  15.794
  301    HA2  GLY  46           1HA      GLY  46  25.593  -7.032  14.446
  302    HA3  GLY  46           2HA      GLY  46  25.600  -5.373  15.025