*HEADER    TRANSCRIPTION                           28-MAR-07   2EM5              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 768-          
*TITLE    2 800) OF HUMAN ZINC FINGER PROTEIN 95 HOMOLOG                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 95 HOMOLOG;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2, UNP RESIDUES 768-800;                             
*COMPND   5 SYNONYM: ZFP-95;                                                     
*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: ZFP95, KIAA1015;                                               
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P061225-15;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    ZF-C2H2, NMR, STRUCTURAL GENOMICS, NPPSFA, NATIONAL PROJECT           
*KEYWDS   2 ON PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES, RIKEN                 
*KEYWDS   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI,                     
*KEYWDS   4 TRANSCRIPTION                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    T.TOMIZAWA, N.TOCHIO, H.ABE, K.SAITO, H.LI, M.SATO,                   
*AUTHOR   2 S.KOSHIBA, N.KOBAYASHI, T.KIGAWA, S.YOKOYAMA, RIKEN                  
*AUTHOR   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)                     
*REVDAT   1   12-MAY-09 2EM5    0                                                

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

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

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

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

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

15 CYSS SG   18  CYSS SG   3.96  5.00E+00
15 CYSS SG   31  HIS  NE2  3.72  5.00E+00
15 CYSS SG   35  HIS  NE2  3.72  5.00E+00
18 CYSS SG   31  HIS  NE2  3.72  5.00E+00
18 CYSS SG   35  HIS  NE2  3.72  5.00E+00
31 HIS  NE2  35  HIS  NE2  3.60  5.00E+00
 16 HIS  HA     18 CYSS HN      4.66 #SUP  0.93  #QF  0.93
 17 GLU  HG3    18 CYSS HN      4.97 #SUP  1.00
 15 CYSS HB3    18 CYSS HN      3.43 #SUP  0.94  #QF  0.94
 18 CYSS HN     18 CYSS HB3     3.47 #SUP  0.99  #QF  0.99
 17 GLU  QB     18 CYSS HN      3.19 #SUP  0.98  #QF  0.98
 17 GLU  HN     18 CYSS HN      3.12 #SUP  1.00
 18 CYSS HN     19 GLY  HA1     4.32 #SUP  1.00
 17 GLU  HG2    18 CYSS HN      4.84 #SUP  0.97  #QF  0.97
 14 GLN  HN     15 CYSS HN      4.67 #SUP  1.00
 13 HIS  HA     14 GLN  HN      3.03 #SUP  0.80  #QF  0.80
 13 HIS  QB     14 GLN  HN      3.92 #SUP  0.90  #QF  0.90
 14 GLN  HN     14 GLN  QG      4.20 #SUP  0.98  #QF  0.98
 14 GLN  HN     14 GLN  QB      3.27 #SUP  0.90  #QF  0.90
 38 GLU  HN     39 LYS  HN      4.90 #SUP  0.96  #QF  0.96
 38 GLU  HA     39 LYS  HN      3.13 #SUP  0.90  #QF  0.90
 39 LYS  HN     39 LYS  QG      4.43 #SUP  0.98  #QF  0.98
 38 GLU  HG2    39 LYS  HN      5.50 #SUP  0.83  #QF  0.56
 38 GLU  HG3    39 LYS  HN      5.50 #SUP  0.83  #QF  0.56
 19 GLY  HN     20 ARG  HA      4.89 #SUP  0.99  #QF  0.99
 16 HIS  QB     19 GLY  HN      5.50 #SUP  0.97  #QF  0.97
 15 CYSS HB2    19 GLY  HN      4.30 #SUP  1.00  #QF  0.89
 18 CYSS HB3    19 GLY  HN      4.65 #SUP  1.00  #QF  0.89
 17 GLU  HN     19 GLY  HN      3.92 #SUP  1.00
 19 GLY  HN     20 ARG  HB2     4.91 #SUP  0.90  #QF  0.90
 19 GLY  HN     19 GLY  HA1     2.92 #SUP  1.00
 15 CYSS HB3    19 GLY  HN      3.56 #SUP  0.98  #QF  0.98
 17 GLU  QB     19 GLY  HN      4.31 #SUP  0.98  #QF  0.98
 16 HIS  HA     19 GLY  HN      4.35 #SUP  0.91  #QF  0.91
 14 GLN  QG     19 GLY  HN      4.94 #SUP  0.98  #QF  0.98
 17 GLU  HG2    19 GLY  HN      5.50 #SUP  0.99  #QF  0.99
 32 GLN  QG     32 GLN  HE22    3.83 #SUP  0.98  #QF  0.98
 15 CYSS HA     32 GLN  HE21    4.94 #SUP  0.87  #QF  0.87
 32 GLN  HB3    32 GLN  HE21    4.99 #SUP  0.98  #QF  0.98
 28 LEU  HG     32 GLN  HE21    4.94 #SUP  0.99  #QF  0.99
 28 LEU  QD1    32 GLN  HE21    4.83 #SUP  0.84  #QF  0.60
 28 LEU  QD2    32 GLN  HE21    4.83 #SUP  0.84  #QF  0.60
 15 CYSS HA     32 GLN  HE22    4.94 #SUP  0.79  #QF  0.79
 32 GLN  HB3    32 GLN  HE22    4.99 #SUP  0.86  #QF  0.86
 28 LEU  HG     32 GLN  HE22    4.94 #SUP  0.98  #QF  0.98
 28 LEU  QD1    32 GLN  HE22    4.83 #SUP  0.83  #QF  0.53
 32 GLN  QG     32 GLN  HE21    3.83 #SUP  1.00
 13 HIS  QB     28 LEU  HN      4.34 #SUP  0.98  #QF  0.98
 22 PHE  HN     28 LEU  HN      5.50 #SUP  0.63  #QF  0.63
 28 LEU  HN     30 GLN  HN      5.15 #SUP  1.00  #QF  0.97
 28 LEU  HN     31 HIS  HN      5.50 #SUP  1.00  #QF  0.97
 27 HIS  HN     28 LEU  HN      3.21 #SUP  0.85  #QF  0.85
 26 SER  HA     28 LEU  HN      4.93 #SUP  0.99  #QF  0.99
 27 HIS  HB2    28 LEU  HN      3.46 #SUP  0.99  #QF  0.87
 27 HIS  HB3    28 LEU  HN      3.41 #SUP  1.00  #QF  0.61
 22 PHE  HB2    28 LEU  HN      4.02 #SUP  0.52  #QF  0.52
 28 LEU  HN     28 LEU  HB3     3.13 #SUP  1.00
 28 LEU  HN     28 LEU  HG      4.82 #SUP  1.00
 28 LEU  HN     28 LEU  HB2     3.24 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  QD2     4.90 #SUP  0.96  #QF  0.91
 15 CYSS HN     20 ARG  HN      4.29 #SUP  1.00
 15 CYSS HB3    20 ARG  HN      3.38 #SUP  0.97  #QF  0.97
 15 CYSS HB2    20 ARG  HN      3.66 #SUP  0.99  #QF  0.99
 20 ARG  HN     20 ARG  HB2     3.19 #SUP  0.99  #QF  0.99
 20 ARG  HN     20 ARG  HG3     3.27 #SUP  0.86  #QF  0.86
 12 SER  HN     13 HIS  HN      4.65 #SUP  0.98  #QF  0.98
 13 HIS  HN     13 HIS  HD2     3.92 #SUP  0.83  #QF  0.83
 13 HIS  HN     25 LYS  HA      5.50 #SUP  0.70  #QF  0.70
 13 HIS  HN     13 HIS  QB      3.25 #SUP  0.88  #QF  0.88
 13 HIS  HN     22 PHE  HB2     4.81 #SUP  0.75  #QF  0.75
 12 SER  QB     13 HIS  HN      3.71 #SUP  0.95  #QF  0.95
 11 LYS  QB     13 HIS  HN      4.68 #SUP  0.86  #QF  0.86
 34 ILE  HA     36 THR  HN      4.82 #SUP  0.90  #QF  0.90
 36 THR  HN     36 THR  HB      4.09 #SUP  1.00  #QF  0.99
 33 ARG  HA     36 THR  HN      4.67 #SUP  0.88  #QF  0.88
 35 HIS  HB2    36 THR  HN      4.27 #SUP  0.96  #QF  0.96
 36 THR  HN     36 THR  QG2     3.89 #SUP  0.97  #QF  0.97
 36 THR  HN     37 GLY  HN      4.79 #SUP  0.79  #QF  0.79
 35 HIS  HB3    36 THR  HN      4.48 #SUP  0.97  #QF  0.97
 14 GLN  QB     14 GLN  HE22    4.84 #SUP  0.99  #QF  0.99
 14 GLN  QB     14 GLN  HE21    4.84 #SUP  0.98  #QF  0.98
 27 HIS  HN     30 GLN  HN      5.19 #SUP  0.92  #QF  0.92
 27 HIS  HN     28 LEU  HB3     5.45 #SUP  0.90  #QF  0.61
 27 HIS  HN     30 GLN  QB      5.50 #SUP  0.90  #QF  0.61
 26 SER  QB     27 HIS  HN      4.44 #SUP  0.93  #QF  0.27
 27 HIS  HN     27 HIS  HB2     3.30 #SUP  0.99  #QF  0.99
 27 HIS  HN     27 HIS  HB3     3.69 #SUP  1.00
 24 LEU  HB3    27 HIS  HN      3.61 #SUP  0.98  #QF  0.98
 24 LEU  HB2    27 HIS  HN      3.42 #SUP  0.97  #QF  0.97
 24 LEU  QD1    27 HIS  HN      4.96 #SUP  1.00
 15 CYSS HB3    17 GLU  HN      4.38 #SUP  0.97  #QF  0.97
 16 HIS  QB     17 GLU  HN      3.75 #SUP  0.98  #QF  0.98
 17 GLU  HN     17 GLU  HG2     4.16 #SUP  1.00
 17 GLU  HN     17 GLU  HG3     3.90 #SUP  1.00
 17 GLU  HN     17 GLU  QB      2.94 #SUP  0.98  #QF  0.98
 15 CYSS HB2    17 GLU  HN      4.70 #SUP  0.96  #QF  0.96
 36 THR  HB     37 GLY  HN      4.96 #SUP  1.00
 38 GLU  HN     38 GLU  HG2     5.35 #SUP  0.93  #QF  0.69
 38 GLU  HN     38 GLU  HG3     5.35 #SUP  0.93  #QF  0.69
 29 ASN  HA     29 ASN  HD22    4.76 #SUP  0.99  #QF  0.99
 29 ASN  HA     29 ASN  HD21    4.76 #SUP  0.99  #QF  0.99
 29 ASN  HN     31 HIS  HN      4.93 #SUP  0.90  #QF  0.90
 27 HIS  HA     31 HIS  HN      5.05 #SUP  0.99  #QF  0.59
 31 HIS  HN     32 GLN  HA      5.33 #SUP  0.95  #QF  0.95
 31 HIS  HN     31 HIS  HB3     2.97 #SUP  0.98  #QF  0.98
 31 HIS  HN     31 HIS  HB2     3.25 #SUP  1.00
 30 GLN  QB     31 HIS  HN      3.47 #SUP  0.91  #QF  0.91
 30 GLN  HG3    31 HIS  HN      5.50 #SUP  0.88  #QF  0.70
 21 GLY  HN     22 PHE  HN      4.45 #SUP  0.90  #QF  0.90
 20 ARG  HA     21 GLY  HN      2.72 #SUP  0.93  #QF  0.93
 20 ARG  HG2    21 GLY  HN      4.02 #SUP  1.00
 20 ARG  HB3    21 GLY  HN      3.42 #SUP  0.94  #QF  0.94
 23 THR  HB     24 LEU  HN      3.60 #SUP  0.95  #QF  0.95
 22 PHE  HB3    24 LEU  HN      3.62 #SUP  0.93  #QF  0.45
 24 LEU  HN     27 HIS  HB2     3.81 #SUP  0.93  #QF  0.45
 24 LEU  HN     27 HIS  HB3     4.57 #SUP  0.93  #QF  0.93
 24 LEU  HN     24 LEU  HG      3.55 #SUP  0.99  #QF  0.99
 23 THR  QG2    24 LEU  HN      3.99 #SUP  0.99  #QF  0.61
 24 LEU  HN     24 LEU  HB2     3.42 #SUP  0.97  #QF  0.96
 24 LEU  HN     24 LEU  QD2     4.13 #SUP  0.97  #QF  0.96
 24 LEU  HN     24 LEU  QD1     4.13 #SUP  1.00
 24 LEU  HN     27 HIS  HN      4.62 #SUP  0.98  #QF  0.98
 30 GLN  HN     32 GLN  HN      4.74 #SUP  0.96  #QF  0.96
 27 HIS  HA     30 GLN  HN      4.09 #SUP  1.00  #QF  0.21
 28 LEU  HA     30 GLN  HN      5.30 #SUP  0.96  #QF  0.93
 30 GLN  HN     33 ARG  QD      5.50 #SUP  0.96  #QF  0.93
 29 ASN  QB     30 GLN  HN      3.16 #SUP  0.97  #QF  0.97
 30 GLN  HN     30 GLN  HG3     4.86 #SUP  0.90  #QF  0.90
 30 GLN  HN     30 GLN  QB      2.91 #SUP  0.93  #QF  0.93
 28 LEU  HN     29 ASN  HN      3.24 #SUP  1.00
 27 HIS  HN     29 ASN  HN      4.67 #SUP  1.00
 29 ASN  HN     29 ASN  QB      2.88 #SUP  0.97  #QF  0.97
 28 LEU  HB3    29 ASN  HN      3.28 #SUP  0.99  #QF  0.99
 35 HIS  HN     36 THR  HN      3.60 #SUP  0.99  #QF  0.98
 35 HIS  HN     35 HIS  HD2     4.06 #SUP  0.95  #QF  0.95
 33 ARG  HA     35 HIS  HN      4.42 #SUP  0.95  #QF  0.95
 32 GLN  HA     35 HIS  HN      4.09 #SUP  0.99  #QF  0.99
 35 HIS  HN     35 HIS  HB3     3.84 #SUP  0.99  #QF  0.99
 35 HIS  HN     35 HIS  HB2     3.38 #SUP  0.95  #QF  0.95
 34 ILE  HB     35 HIS  HN      4.29 #SUP  1.00
 17 GLU  QB     35 HIS  HN      5.36 #SUP  0.82  #QF  0.29
 35 HIS  HN     36 THR  QG2     5.50 #SUP  0.82  #QF  0.29
 34 ILE  HG13   35 HIS  HN      4.49 #SUP  1.00  #QF  0.99
 34 ILE  QG2    35 HIS  HN      4.08 #SUP  1.00
 35 HIS  HN     36 THR  HA      5.50 #SUP  0.88  #QF  0.80
 35 HIS  HN     36 THR  HB      5.50 #SUP  0.88  #QF  0.80
 29 ASN  HN     30 GLN  HN      3.35 #SUP  0.99  #QF  0.99
 26 SER  HA     29 ASN  HN      3.90 #SUP  0.98  #QF  0.98
 26 SER  QB     29 ASN  HN      5.50 #SUP  0.99  #QF  0.99
 27 HIS  HB2    29 ASN  HN      5.19 #SUP  0.95  #QF  0.95
 28 LEU  HG     29 ASN  HN      4.58 #SUP  1.00
 28 LEU  HB2    29 ASN  HN      4.13 #SUP  1.00
 28 LEU  QD1    29 ASN  HN      4.59 #SUP  0.93  #QF  0.93
 34 ILE  HG12   35 HIS  HN      4.49 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  QD      3.28 #SUP  0.95  #QF  0.95
 13 HIS  HD2    22 PHE  HN      5.45 #SUP  0.91  #QF  0.22
 22 PHE  HN     22 PHE  QE      5.50 #SUP  0.91  #QF  0.22
 11 LYS  HA     22 PHE  HN      5.45 #SUP  0.91  #QF  0.91
 13 HIS  QB     22 PHE  HN      3.84 #SUP  0.90  #QF  0.90
 22 PHE  HN     22 PHE  HB2     3.44 #SUP  0.96  #QF  0.96
 14 GLN  QG     22 PHE  HN      5.50 #SUP  1.00  #QF  0.98
 22 PHE  HN     28 LEU  HB3     5.50 #SUP  1.00  #QF  0.98
 14 GLN  QB     22 PHE  HN      5.04 #SUP  0.89  #QF  0.89
 11 LYS  QB     22 PHE  HN      4.30 #SUP  0.82  #QF  0.82
 22 PHE  HN     28 LEU  HB2     5.02 #SUP  0.99  #QF  0.56
 22 PHE  HN     28 LEU  QD1     5.50 #SUP  0.78  #QF  0.40
 22 PHE  HN     28 LEU  QD2     5.50 #SUP  0.78  #QF  0.40
 33 ARG  HN     33 ARG  QD      4.13 #SUP  0.99  #QF  0.99
 32 GLN  HN     33 ARG  HN      3.40 #SUP  1.00
 30 GLN  HA     33 ARG  HN      4.15 #SUP  0.90  #QF  0.90
 32 GLN  QG     33 ARG  HN      4.59 #SUP  0.99  #QF  0.99
 32 GLN  HB2    33 ARG  HN      4.05 #SUP  0.88  #QF  0.88
 11 LYS  QB     12 SER  HN      4.73 #SUP  0.98  #QF  0.98
 15 CYSS HN     22 PHE  HN      5.09 #SUP  1.00
 15 CYSS HN     19 GLY  HN      4.60 #SUP  0.99  #QF  0.99
 15 CYSS HN     18 CYSS HN      5.50 #SUP  1.00
 15 CYSS HN     22 PHE  QD      4.54 #SUP  0.99  #QF  0.99
 15 CYSS HN     31 HIS  HD2     5.38 #SUP  1.00
 15 CYSS HN     22 PHE  QE      4.35 #SUP  0.98  #QF  0.98
 14 GLN  HA     15 CYSS HN      2.99 #SUP  0.87  #QF  0.87
 15 CYSS HN     19 GLY  HA2     5.46 #SUP  1.00
 15 CYSS HN     15 CYSS HB3     3.09 #SUP  0.99  #QF  0.99
 15 CYSS HN     15 CYSS HB2     3.22 #SUP  1.00
 14 GLN  QG     15 CYSS HN      3.79 #SUP  0.99  #QF  0.99
 14 GLN  QB     15 CYSS HN      3.68 #SUP  0.98  #QF  0.98
 15 CYSS HN     20 ARG  HB3     4.70 #SUP  0.98  #QF  0.98
 12 SER  HN     12 SER  QB      4.03 #SUP  0.99  #QF  0.99
 34 ILE  HN     35 HIS  HN      3.22 #SUP  0.97  #QF  0.97
 33 ARG  HN     34 ILE  HN      3.41 #SUP  1.00
 32 GLN  HA     34 ILE  HN      4.18 #SUP  1.00
 33 ARG  QD     34 ILE  HN      5.31 #SUP  0.96  #QF  0.92
 34 ILE  HN     35 HIS  HB2     5.50 #SUP  0.96  #QF  0.92
 34 ILE  HN     34 ILE  HB      3.62 #SUP  1.00
 34 ILE  HN     34 ILE  HG12    3.92 #SUP  1.00
 34 ILE  HN     34 ILE  HG13    3.92 #SUP  1.00
 32 GLN  HN     34 ILE  HN      4.73 #SUP  0.95  #QF  0.95
 24 LEU  HB2    25 LYS  HN      5.24 #SUP  0.74  #QF  0.42
 13 HIS  HD2    25 LYS  HN      5.23 #SUP  0.94  #QF  0.40
 32 GLN  HN     35 HIS  HD2     4.76 #SUP  0.83  #QF  0.83
 31 HIS  HN     32 GLN  HN      3.25 #SUP  1.00
 31 HIS  HD2    32 GLN  HN      4.00 #SUP  1.00
 29 ASN  HA     32 GLN  HN      3.95 #SUP  0.98  #QF  0.98
 30 GLN  HA     32 GLN  HN      5.02 #SUP  1.00
 31 HIS  HB3    32 GLN  HN      3.45 #SUP  0.98  #QF  0.98
 32 GLN  HN     32 GLN  QG      3.05 #SUP  0.98  #QF  0.98
 32 GLN  HN     32 GLN  HB2     3.18 #SUP  0.98  #QF  0.98
 30 GLN  QB     32 GLN  HN      5.44 #SUP  0.96  #QF  0.96
 28 LEU  HG     32 GLN  HN      5.50 #SUP  0.98  #QF  0.98
 18 CYSS HN     19 GLY  HN      2.84 #SUP  1.00
 27 HIS  HA     27 HIS  HD2     3.48 #SUP  0.92  #QF  0.92
 27 HIS  HD2    30 GLN  QB      4.82 #SUP  0.78  #QF  0.78
 24 LEU  HB2    27 HIS  HD2     4.62 #SUP  0.88  #QF  0.88
 18 CYSS HA     35 HIS  HE1     4.66 #SUP  0.97  #QF  0.97
 18 CYSS HB3    35 HIS  HE1     3.27 #SUP  0.96  #QF  0.96
 17 GLU  QB     35 HIS  HE1     4.28 #SUP  0.77  #QF  0.77
 34 ILE  QG2    35 HIS  HE1     5.50 #SUP  0.60  #QF  0.60
 20 ARG  HG2    31 HIS  HE1     5.08 #SUP  0.95  #QF  0.95
 20 ARG  HG3    31 HIS  HE1     4.77 #SUP  0.96  #QF  0.44
 31 HIS  HE1    34 ILE  QD1     3.35 #SUP  0.99  #QF  0.99
 22 PHE  HZ     31 HIS  HE1     4.78 #SUP  0.99  #QF  0.99
 20 ARG  HD2    31 HIS  HE1     4.23 #SUP  0.97  #QF  0.97
 31 HIS  HE1    34 ILE  HG12    4.82 #SUP  0.94  #QF  0.94
 24 LEU  HG     27 HIS  HE1     4.75 #SUP  0.96  #QF  0.96
 24 LEU  HB3    27 HIS  HE1     5.06 #SUP  0.85  #QF  0.85
 24 LEU  HB2    27 HIS  HE1     4.95 #SUP  0.91  #QF  0.79
 13 HIS  QB     13 HIS  HE1     4.98 #SUP  0.86  #QF  0.35
 22 PHE  QD     27 HIS  HB3     3.42 #SUP  0.98  #QF  0.89
 15 CYSS HB2    22 PHE  QD      4.33 #SUP  0.95  #QF  0.95
 22 PHE  QD     28 LEU  HB3     4.25 #SUP  0.99  #QF  0.99
 22 PHE  QD     28 LEU  HG      4.59 #SUP  0.94  #QF  0.94
 22 PHE  QD     28 LEU  HB2     3.78 #SUP  1.00  #QF  0.45
 22 PHE  QD     27 HIS  HA      4.72 #SUP  0.94  #QF  0.94
 20 ARG  HD3    22 PHE  QE      4.87 #SUP  1.00  #QF  0.97
 22 PHE  QE     31 HIS  HB3     4.93 #SUP  1.00  #QF  0.97
 20 ARG  HB3    22 PHE  QE      3.89 #SUP  0.99  #QF  0.98
 22 PHE  QE     27 HIS  HB3     4.72 #SUP  0.98  #QF  0.71
 15 CYSS HB2    22 PHE  QE      3.77 #SUP  0.99  #QF  0.93
 20 ARG  HB2    22 PHE  QE      4.19 #SUP  0.88  #QF  0.88
 22 PHE  QD     22 PHE  HZ      4.02 #SUP  0.96  #QF  0.96
 20 ARG  HD3    22 PHE  HZ      4.12 #SUP  1.00  #QF  0.97
 20 ARG  HD2    22 PHE  HZ      4.12 #SUP  0.97  #QF  0.69
 20 ARG  HB3    22 PHE  HZ      4.09 #SUP  0.95  #QF  0.95
 35 HIS  HB2    35 HIS  HD2     3.74 #SUP  0.98  #QF  0.98
 32 GLN  QG     35 HIS  HD2     4.06 #SUP  1.00
 32 GLN  HB3    35 HIS  HD2     4.72 #SUP  0.86  #QF  0.86
 17 GLU  HG2    35 HIS  HD2     4.82 #SUP  0.96  #QF  0.96
 17 GLU  HG3    35 HIS  HD2     4.89 #SUP  0.98  #QF  0.98
 17 GLU  QB     35 HIS  HD2     3.96 #SUP  0.98  #QF  0.98
 31 HIS  HD2    32 GLN  HB2     4.80 #SUP  0.54  #QF  0.54
 31 HIS  HN     31 HIS  HD2     4.65 #SUP  0.85  #QF  0.85
 15 CYSS HB3    31 HIS  HD2     4.25 #SUP  0.99  #QF  0.99
 31 HIS  HB3    31 HIS  HD2     3.87 #SUP  0.99  #QF  0.99
 13 HIS  QB     13 HIS  HD2     3.88 #SUP  0.98  #QF  0.98
 13 HIS  HD2    28 LEU  HB2     5.36 #SUP  0.75  #QF  0.75
 16 HIS  HA     16 HIS  HD2     4.63 #SUP  0.86  #QF  0.86
 16 HIS  QB     16 HIS  HD2     3.63 #SUP  0.95  #QF  0.95
 24 LEU  QD2    27 HIS  HN      4.96 #SUP  0.97  #QF  0.97
 28 LEU  QD2    29 ASN  HN      4.59 #SUP  1.00
 28 LEU  QD2    32 GLN  HE22    4.83 #SUP  0.72  #QF  0.72
 28 LEU  HB3    28 LEU  QD2     3.61 #SUP  1.00
 28 LEU  HB2    28 LEU  QD2     3.46 #SUP  1.00
 18 CYSS HN     19 GLY  HA2     4.87 #SUP  1.00
 14 GLN  QG     19 GLY  HA1     4.30 #SUP  0.99  #QF  0.99
 14 GLN  QB     19 GLY  HA1     5.19 #SUP  0.99  #QF  0.99
 23 THR  HA     23 THR  QG2     3.29 #SUP  0.93  #QF  0.93
 23 THR  HB     24 LEU  HG      4.34 #SUP  0.93  #QF  0.93
 23 THR  HB     24 LEU  HB2     5.18 #SUP  0.99  #QF  0.45
 10 THR  HA     10 THR  QG2     3.38 #SUP  1.00
 36 THR  HA     36 THR  QG2     3.22 #SUP  0.93  #QF  0.35
 33 ARG  QD     36 THR  QG2     5.50 #SUP  0.94  #QF  0.32
 33 ARG  HA     36 THR  QG2     4.06 #SUP  0.60  #QF  0.60
 24 LEU  HB3    27 HIS  HB2     4.67 #SUP  0.99  #QF  0.99
 24 LEU  HB2    27 HIS  HB2     4.46 #SUP  1.00  #QF  0.37
 24 LEU  HB2    27 HIS  HB3     4.72 #SUP  1.00
 22 PHE  HB3    28 LEU  HB2     4.25 #SUP  1.00
 22 PHE  HB3    28 LEU  HB3     4.85 #SUP  1.00
 22 PHE  HB3    28 LEU  QD1     5.50 #SUP  0.93  #QF  0.38
 22 PHE  HB3    28 LEU  QD2     5.50 #SUP  0.93  #QF  0.38
 13 HIS  QB     22 PHE  HB2     3.91 #SUP  0.99  #QF  0.99
 22 PHE  HB2    28 LEU  HB3     4.50 #SUP  1.00
 22 PHE  HB2    28 LEU  HG      5.22 #SUP  0.98  #QF  0.98
 22 PHE  HB2    28 LEU  HB2     4.10 #SUP  0.99  #QF  0.99
 22 PHE  HB2    28 LEU  QD1     5.08 #SUP  0.85  #QF  0.55
 22 PHE  HB2    28 LEU  QD2     5.08 #SUP  0.85  #QF  0.55
 22 PHE  HB2    24 LEU  HN      4.63 #SUP  1.00
 20 ARG  HD3    31 HIS  HE1     4.23 #SUP  1.00
 20 ARG  HB3    20 ARG  HD3     3.68 #SUP  1.00  #QF  0.77
 20 ARG  HD2    22 PHE  QE      4.87 #SUP  1.00
 20 ARG  HB3    20 ARG  HD2     3.68 #SUP  1.00  #QF  0.53
 33 ARG  HB2    33 ARG  QD      3.75 #SUP  1.00  #QF  0.64
 33 ARG  HA     33 ARG  QD      4.54 #SUP  1.00
 30 GLN  HA     33 ARG  QD      3.69 #SUP  0.99  #QF  0.99
 13 HIS  HE1    25 LYS  QE      4.54 #SUP  0.85  #QF  0.85
 12 SER  QB     13 HIS  HD2     4.62 #SUP  0.66  #QF  0.66
 34 ILE  QG2    35 HIS  HD2     5.41 #SUP  0.97  #QF  0.97
 31 HIS  HE1    34 ILE  QG2     4.08 #SUP  0.95  #QF  0.95
 34 ILE  HN     34 ILE  QG2     3.27 #SUP  1.00
 33 ARG  HN     34 ILE  QG2     4.60 #SUP  0.95  #QF  0.95
 31 HIS  HA     34 ILE  QG2     4.19 #SUP  0.99  #QF  0.99
 34 ILE  HA     34 ILE  QG2     3.11 #SUP  1.00
 32 GLN  HA     34 ILE  QG2     4.74 #SUP  0.98  #QF  0.98
 33 ARG  QD     34 ILE  QG2     5.21 #SUP  0.79  #QF  0.79
 31 HIS  HB2    34 ILE  QG2     4.67 #SUP  0.85  #QF  0.85
 27 HIS  HB2    28 LEU  HB3     5.50 #SUP  1.00
 13 HIS  QB     28 LEU  HB3     4.18 #SUP  1.00
 28 LEU  HB3    29 ASN  QB      4.52 #SUP  0.91  #QF  0.91
 28 LEU  HB3    28 LEU  QD1     3.61 #SUP  0.94  #QF  0.94
 13 HIS  QB     28 LEU  HB2     4.06 #SUP  1.00
 34 ILE  HA     34 ILE  HG12    3.99 #SUP  1.00
 34 ILE  HA     34 ILE  HB      2.99 #SUP  1.00
 34 ILE  HA     34 ILE  HG13    3.99 #SUP  1.00
 10 THR  HA     11 LYS  QB      4.82 #SUP  0.44  #QF  0.44
 28 LEU  HN     29 ASN  QB      4.78 #SUP  0.99  #QF  0.99
 26 SER  QB     29 ASN  QB      4.39 #SUP  0.89  #QF  0.89
 28 LEU  HG     29 ASN  QB      5.50 #SUP  0.94  #QF  0.52
 34 ILE  HN     34 ILE  QD1     4.07 #SUP  1.00
 34 ILE  QD1    35 HIS  HN      4.69 #SUP  1.00
 31 HIS  HA     34 ILE  QD1     4.51 #SUP  0.98  #QF  0.98
 34 ILE  HA     34 ILE  QD1     4.34 #SUP  1.00
 34 ILE  HB     34 ILE  QD1     3.10 #SUP  0.98  #QF  0.98
 31 HIS  HB2    34 ILE  QD1     4.61 #SUP  0.43  #QF  0.43
 26 SER  HA     29 ASN  QB      3.36 #SUP  0.98  #QF  0.98
 17 GLU  HA     17 GLU  HG2     4.03 #SUP  0.99  #QF  0.99
 17 GLU  HG2    35 HIS  HB2     5.50 #SUP  1.00  #QF  0.97
 17 GLU  HA     17 GLU  HG3     4.03 #SUP  1.00
 17 GLU  HG3    35 HIS  HB2     4.74 #SUP  0.79  #QF  0.79
 32 GLN  HA     35 HIS  HD2     3.29 #SUP  0.98  #QF  0.98
 32 GLN  HA     32 GLN  QG      3.28 #SUP  1.00
 32 GLN  HA     35 HIS  HB2     4.42 #SUP  0.87  #QF  0.87
 31 HIS  HD2    32 GLN  HA      3.83 #SUP  0.99  #QF  0.99
 17 GLU  QB     32 GLN  HA      4.90 #SUP  0.89  #QF  0.89
 25 LYS  HA     28 LEU  HN      4.01 #SUP  0.94  #QF  0.94
 25 LYS  HA     28 LEU  HB3     3.54 #SUP  0.92  #QF  0.92
 25 LYS  HA     29 ASN  HN      4.59 #SUP  0.98  #QF  0.98
 13 HIS  HD2    25 LYS  HA      4.51 #SUP  0.95  #QF  0.73
 25 LYS  HA     26 SER  HA      5.03 #SUP  0.68  #QF  0.68
 13 HIS  QB     25 LYS  HA      4.14 #SUP  0.92  #QF  0.85
 25 LYS  HA     25 LYS  QE      4.74 #SUP  0.92  #QF  0.85
 31 HIS  HD2    32 GLN  QG      3.69 #SUP  0.91  #QF  0.91
 29 ASN  HA     32 GLN  QG      4.23 #SUP  0.92  #QF  0.92
 28 LEU  HG     32 GLN  QG      3.93 #SUP  0.98  #QF  0.98
 17 GLU  QB     32 GLN  QG      4.62 #SUP  0.76  #QF  0.76
 31 HIS  HA     31 HIS  HD2     4.80 #SUP  1.00
 30 GLN  QB     31 HIS  HA      4.54 #SUP  0.97  #QF  0.97
 11 LYS  QB     12 SER  HA      4.91 #SUP  0.97  #QF  0.97
 30 GLN  HA     30 GLN  HG2     3.85 #SUP  0.92  #QF  0.92
 30 GLN  HA     30 GLN  QB      3.00 #SUP  1.00
 30 GLN  HA     33 ARG  HG3     4.49 #SUP  0.97  #QF  0.97
 29 ASN  QB     30 GLN  HA      4.31 #SUP  0.95  #QF  0.95
 17 GLU  HA     17 GLU  QB      2.94 #SUP  1.00
 16 HIS  QB     17 GLU  HA      4.49 #SUP  0.82  #QF  0.31
 33 ARG  HA     33 ARG  HG3     3.69 #SUP  0.94  #QF  0.90
 28 LEU  HA     31 HIS  HD2     4.48 #SUP  0.98  #QF  0.98
 28 LEU  HA     32 GLN  HN      4.59 #SUP  1.00
 28 LEU  HA     31 HIS  HN      3.95 #SUP  0.98  #QF  0.98
 22 PHE  QE     28 LEU  HA      4.35 #SUP  0.92  #QF  0.92
 28 LEU  HA     31 HIS  HA      5.25 #SUP  1.00
 28 LEU  HA     31 HIS  HB2     3.65 #SUP  0.91  #QF  0.91
 28 LEU  HA     28 LEU  HG      3.85 #SUP  1.00
 14 GLN  QG     19 GLY  HA2     4.65 #SUP  0.98  #QF  0.98
 14 GLN  QG     15 CYSS HB3     5.28 #SUP  0.90  #QF  0.51
 20 ARG  HA     20 ARG  HD3     4.71 #SUP  1.00
 20 ARG  HA     20 ARG  HD2     4.71 #SUP  1.00
 20 ARG  HA     20 ARG  HG2     3.79 #SUP  1.00
 20 ARG  HA     20 ARG  HG3     3.73 #SUP  0.99  #QF  0.94
 30 GLN  HA     30 GLN  HG3     3.85 #SUP  1.00
 30 GLN  HN     30 GLN  HG2     4.86 #SUP  1.00
 30 GLN  HG2    31 HIS  HN      5.50 #SUP  1.00
 18 CYSS HB2    35 HIS  HE1     3.92 #SUP  0.99  #QF  0.99
 18 CYSS HN     18 CYSS HB2     4.14 #SUP  1.00
 17 GLU  QB     18 CYSS HB3     4.46 #SUP  0.95  #QF  0.95
 29 ASN  HA     31 HIS  HN      5.27 #SUP  1.00  #QF  0.97
 11 LYS  HA     11 LYS  HG2     4.18 #SUP  0.79  #QF  0.46
 22 PHE  HB2    27 HIS  HB2     4.46 #SUP  0.86  #QF  0.86
 14 GLN  QB     14 GLN  QG      2.62 #SUP  0.99  #QF  0.99
 22 PHE  QD     27 HIS  HB2     4.05 #SUP  0.63  #QF  0.63
 27 HIS  HB3    28 LEU  HB2     5.16 #SUP  0.41  #QF  0.41
 20 ARG  HB2    22 PHE  HZ      4.71 #SUP  1.00
 20 ARG  HB2    21 GLY  HN      4.42 #SUP  1.00
 15 CYSS HB3    20 ARG  HB2     4.66 #SUP  0.99  #QF  0.99
 15 CYSS HB2    20 ARG  HB2     4.27 #SUP  1.00  #QF  0.99
 20 ARG  HN     20 ARG  HB3     3.77 #SUP  1.00
 15 CYSS HB3    20 ARG  HB3     4.70 #SUP  0.99  #QF  0.99
 13 HIS  QB     28 LEU  HG      5.30 #SUP  0.94  #QF  0.42
 13 HIS  QB     22 PHE  HB3     4.62 #SUP  0.99  #QF  0.99
 13 HIS  QB     22 PHE  QD      4.82 #SUP  0.98  #QF  0.98
 33 ARG  HB3    34 ILE  HN      4.60 #SUP  0.99  #QF  0.99
 33 ARG  HN     33 ARG  HB3     3.77 #SUP  1.00
 33 ARG  HB3    33 ARG  QD      3.75 #SUP  1.00
 33 ARG  HN     33 ARG  HB2     3.77 #SUP  1.00
 16 HIS  QB     17 GLU  QB      5.05 #SUP  0.97  #QF  0.97
 16 HIS  HA     16 HIS  QB      3.00 #SUP  0.99  #QF  0.99
 16 HIS  QB     17 GLU  HG2     4.82 #SUP  0.96  #QF  0.96
 33 ARG  HB2    34 ILE  HN      4.60 #SUP  0.99  #QF  0.99
 15 CYSS HB3    22 PHE  QE      4.09 #SUP  1.00
 15 CYSS HB3    17 GLU  QB      5.25 #SUP  1.00  #QF  0.83
 15 CYSS HB3    20 ARG  HG3     5.50 #SUP  1.00  #QF  0.83
 15 CYSS HB2    18 CYSS HN      4.55 #SUP  1.00
 15 CYSS HB2    20 ARG  HB3     4.48 #SUP  0.99  #QF  0.99
 15 CYSS HB2    31 HIS  HD2     3.51 #SUP  0.81  #QF  0.81
 11 LYS  HA     11 LYS  QD      4.46 #SUP  0.98  #QF  0.98
 35 HIS  HB3    35 HIS  HD2     3.93 #SUP  0.99  #QF  0.99
 17 GLU  QB     35 HIS  HB3     4.62 #SUP  0.80  #QF  0.70
 17 GLU  QB     35 HIS  HB2     5.04 #SUP  0.78  #QF  0.50
 35 HIS  HB2    36 THR  QG2     5.50 #SUP  0.78  #QF  0.50
 29 ASN  QB     30 GLN  QB      4.43 #SUP  0.88  #QF  0.88
 27 HIS  HA     30 GLN  QB      3.78 #SUP  0.99  #QF  0.99
 30 GLN  QB     33 ARG  QD      4.53 #SUP  0.94  #QF  0.94
 22 PHE  HZ     31 HIS  HB3     4.54 #SUP  0.97  #QF  0.97
 31 HIS  HB2    32 GLN  HN      4.26 #SUP  0.99  #QF  0.99
 22 PHE  QE     31 HIS  HB2     4.26 #SUP  0.97  #QF  0.97
 22 PHE  HZ     31 HIS  HB2     4.23 #SUP  0.98  #QF  0.98
 29 ASN  HA     32 GLN  HB2     4.27 #SUP  0.94  #QF  0.94
 32 GLN  HN     32 GLN  HB3     3.67 #SUP  1.00
 32 GLN  HB3    33 ARG  HN      5.22 #SUP  1.00  #QF  0.76
 29 ASN  HA     32 GLN  HB3     4.89 #SUP  0.99  #QF  0.99
 20 ARG  HN     20 ARG  HG2     4.01 #SUP  1.00
 20 ARG  HG3    22 PHE  QE      4.74 #SUP  1.00
 20 ARG  HG3    21 GLY  HN      4.87 #SUP  0.99  #QF  0.99
 33 ARG  HA     33 ARG  HG2     3.69 #SUP  0.95  #QF  0.95
 30 GLN  HA     33 ARG  HG2     4.49 #SUP  0.99  #QF  0.99
 39 LYS  HA     40 PRO  HD3     3.37 #SUP  0.95  #QF  0.95
 39 LYS  HA     40 PRO  HD2     3.37 #SUP  0.97  #QF  0.97
 28 LEU  HN     28 LEU  QD1     4.90 #SUP  1.00
 28 LEU  HB2    28 LEU  QD1     3.46 #SUP  1.00
 34 ILE  QG2    34 ILE  HG12    3.77 #SUP  0.99  #QF  0.99
 34 ILE  QG2    34 ILE  HG13    3.77 #SUP  0.98  #QF  0.98
 31 HIS  HE1    34 ILE  HG13    4.82 #SUP  0.68  #QF  0.68
 11 LYS  HA     11 LYS  HG3     4.18 #SUP  0.98  #QF  0.98
 25 LYS  HA     25 LYS  HG3     4.07 #SUP  1.00
 25 LYS  HA     25 LYS  HG2     4.07 #SUP  1.00
 11 LYS  HA     11 LYS  QG      3.66 
 11 LYS  QB     11 LYS  QE      4.39 
 11 LYS  QB     21 GLY  QA      4.21 
 11 LYS  QG     11 LYS  QE      3.25 
 11 LYS  QG     12 SER  HA      4.68 
 11 LYS  QG     12 SER  QB      4.57 
 11 LYS  QG     13 HIS  HN      4.84 
 11 LYS  QG     21 GLY  QA      4.65 
 11 LYS  QG     22 PHE  HN      4.51 
 13 HIS  HA     28 LEU  QQD     4.67 
 13 HIS  QB     25 LYS  QD      4.85 
 13 HIS  QB     28 LEU  QQD     3.24 
 13 HIS  HD2    28 LEU  QQD     5.01 
 13 HIS  HE1    25 LYS  QB      3.93 
 13 HIS  HE1    25 LYS  QD      4.76 
 14 GLN  HN     28 LEU  QQD     4.33 
 14 GLN  HA     21 GLY  QA      4.38 
 14 GLN  QB     14 GLN  QE2     4.10 
 14 GLN  QB     21 GLY  QA      4.72 
 14 GLN  QG     21 GLY  QA      4.52 
 14 GLN  QE2    19 GLY  HA1     4.33 
 14 GLN  QE2    19 GLY  HA2     4.40 
 15 CYSS HN     21 GLY  QA      4.68 
 15 CYSS HN     28 LEU  QQD     3.76 
 15 CYSS HA     28 LEU  QQD     3.56 
 15 CYSS HA     32 GLN  QE2     4.25 
 15 CYSS HB2    28 LEU  QQD     3.29 
 15 CYSS HB3    28 LEU  QQD     3.63 
 20 ARG  HN     20 ARG  QD      4.75 
 20 ARG  HA     21 GLY  QA      4.53 
 20 ARG  HB3    21 GLY  QA      5.31 
 20 ARG  QD     21 GLY  HN      5.13 
 20 ARG  QD     22 PHE  QE      4.18 
 20 ARG  QD     31 HIS  HE1     3.66 
 21 GLY  QA     22 PHE  HN      2.93 
 21 GLY  QA     22 PHE  QD      4.76 
 22 PHE  HN     28 LEU  QQD     4.79 
 22 PHE  HB2    28 LEU  QQD     4.38 
 22 PHE  QD     28 LEU  QQD     3.35 
 22 PHE  QE     28 LEU  QQD     3.61 
 22 PHE  HZ     28 LEU  QQD     4.80 
 23 THR  HB     24 LEU  QQD     4.58 
 24 LEU  HN     24 LEU  QQD     3.55 
 24 LEU  HA     24 LEU  QQD     3.61 
 24 LEU  QQD    25 LYS  HN      5.44 
 24 LEU  QQD    26 SER  QB      4.79 
 24 LEU  QQD    27 HIS  HN      4.15 
 24 LEU  QQD    27 HIS  HB2     4.99 
 24 LEU  QQD    27 HIS  HD2     4.33 
 24 LEU  QQD    27 HIS  HE1     3.76 
 25 LYS  HA     25 LYS  QG      3.56 
 25 LYS  HA     25 LYS  QD      3.84 
 25 LYS  HA     28 LEU  QQD     4.11 
 25 LYS  QB     25 LYS  QE      4.04 
 25 LYS  QG     25 LYS  QE      3.49 
 25 LYS  QG     29 ASN  QB      4.58 
 25 LYS  QD     28 LEU  QQD     4.38 
 25 LYS  QD     29 ASN  QB      5.34 
 25 LYS  QE     28 LEU  QQD     4.08 
 26 SER  HA     29 ASN  QD2     4.24 
 28 LEU  HN     28 LEU  QQD     4.06 
 28 LEU  HA     28 LEU  QQD     3.07 
 28 LEU  HB3    28 LEU  QQD     3.09 
 28 LEU  QQD    29 ASN  HN      3.76 
 28 LEU  QQD    31 HIS  HN      4.45 
 28 LEU  QQD    31 HIS  HB2     4.52 
 28 LEU  QQD    31 HIS  HB3     4.24 
 28 LEU  QQD    31 HIS  HD2     3.36 
 28 LEU  QQD    32 GLN  HN      4.19 
 28 LEU  QQD    32 GLN  HA      4.71 
 28 LEU  QQD    32 GLN  HB2     4.54 
 28 LEU  QQD    32 GLN  QG      3.41 
 28 LEU  QQD    32 GLN  QE2     3.47 
 29 ASN  HN     29 ASN  QD2     4.80 
 29 ASN  HA     29 ASN  QD2     4.17 
 30 GLN  HN     30 GLN  QG      4.00 
 30 GLN  HA     30 GLN  QG      3.28 
 30 GLN  HA     33 ARG  QG      3.64 
 31 HIS  HE1    34 ILE  QG1     4.21 
 32 GLN  HN     33 ARG  QG      4.65 
 32 GLN  HB2    32 GLN  QE2     4.86 
 32 GLN  HB3    32 GLN  QE2     4.36 
 32 GLN  QG     32 GLN  QE2     3.17 
 33 ARG  HN     33 ARG  QG      2.92 
 33 ARG  HA     33 ARG  QG      3.23 
 33 ARG  QB     33 ARG  QD      3.10 
 34 ILE  HN     34 ILE  QG1     3.32 
 34 ILE  HA     34 ILE  QG1     3.40 
 34 ILE  QG2    34 ILE  QG1     3.23 
 34 ILE  QG1    35 HIS  HN      3.78 
 38 GLU  HN     38 GLU  QB      3.49 
 38 GLU  HN     38 GLU  QG      4.56 
 38 GLU  QB     39 LYS  HN      4.16 
 38 GLU  QG     39 LYS  HN      4.70 
 39 LYS  HN     39 LYS  QB      3.47 
 39 LYS  HA     40 PRO  QD      2.95 
 39 LYS  QB     40 PRO  QD      3.83 
     14   GLN  PHI  -130.00     -70.00
     14   GLN  PSI    93.00     153.00
     15   CYSS  PHI  -109.00     -49.00
     15   CYSS  PSI   115.00     175.00
     22   PHE  PHI  -145.00     -85.00
     22   PHE  PSI   111.00     171.00
     25   LYS  PHI   -89.00     -29.00
     25   LYS  PSI   -69.00      -9.00
     26   SER  PHI   -94.00     -34.00
     26   SER  PSI   -68.00      -8.00
     27   HIS  PHI   -97.00     -37.00
     27   HIS  PSI   -72.00     -12.00
     28   LEU  PHI   -92.00     -32.00
     28   LEU  PSI   -74.00     -14.00
     29   ASN  PHI   -91.00     -31.00
     29   ASN  PSI   -67.00      -7.00
     30   GLN  PHI   -97.00     -37.00
     30   GLN  PSI   -65.00      -5.00
     31   HIS  PHI   -94.00     -34.00
     31   HIS  PSI   -73.00     -13.00
     32   GLN  PHI   -92.00     -32.00
     32   GLN  PSI   -71.00     -11.00
     33   ARG  PHI   -97.00     -37.00
     33   ARG  PSI   -70.00     -10.00
     34   ILE  PHI  -106.00     -46.00
     34   ILE  PSI   -54.00       6.00
     35   HIS  PHI  -129.00     -69.00
     35   HIS  PSI   -35.00      25.00

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


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1   1.081 -23.317 -19.680
    2    HA2  GLY   1           1HA      GLY   1   1.739 -23.992 -16.897
    3    HA3  GLY   1           2HA      GLY   1   2.718 -23.007 -17.973
    4    H    SER   2           H        SER   2   1.715 -20.894 -18.638
    5    HA   SER   2           HA       SER   2   0.969 -18.829 -18.044
    6    HB2  SER   2           1HB      SER   2  -1.234 -19.920 -18.213
    7    HB3  SER   2           2HB      SER   2  -1.120 -20.409 -16.522
    8    HG   SER   2           HG       SER   2  -1.893 -18.529 -16.042
    9    H    SER   3           H        SER   3   3.089 -19.795 -16.543
   10    HA   SER   3           HA       SER   3   2.611 -19.437 -13.739
   11    HB2  SER   3           1HB      SER   3   4.493 -20.800 -14.946
   12    HB3  SER   3           2HB      SER   3   5.341 -19.254 -14.971
   13    HG   SER   3           HG       SER   3   5.895 -20.315 -13.092
   14    H    GLY   4           H        GLY   4   1.571 -17.344 -13.815
   15    HA2  GLY   4           1HA      GLY   4   3.361 -15.228 -13.207
   16    HA3  GLY   4           2HA      GLY   4   2.679 -15.000 -14.810
   17    H    SER   5           H        SER   5   0.670 -14.177 -15.012
   18    HA   SER   5           HA       SER   5  -1.074 -12.846 -14.310
   19    HB2  SER   5           1HB      SER   5  -2.820 -14.150 -13.188
   20    HB3  SER   5           2HB      SER   5  -2.042 -15.113 -14.444
   21    HG   SER   5           HG       SER   5  -2.049 -15.444 -11.704
   22    H    SER   6           H        SER   6   1.178 -12.183 -12.851
   23    HA   SER   6           HA       SER   6   0.677 -12.222 -10.039
   24    HB2  SER   6           1HB      SER   6   2.938 -11.952 -11.295
   25    HB3  SER   6           2HB      SER   6   2.504 -10.245 -11.377
   26    HG   SER   6           HG       SER   6   2.629 -11.773  -8.988
   27    H    GLY   7           H        GLY   7  -1.515 -11.402 -10.034
   28    HA2  GLY   7           1HA      GLY   7  -1.584  -8.580  -9.526
   29    HA3  GLY   7           2HA      GLY   7  -2.446  -9.013 -10.994
   30    H    SER   8           H        SER   8  -2.263  -9.658  -7.521
   31    HA   SER   8           HA       SER   8  -5.027 -10.641  -7.587
   32    HB2  SER   8           1HB      SER   8  -3.070 -10.737  -5.281
   33    HB3  SER   8           2HB      SER   8  -4.611 -11.586  -5.403
   34    HG   SER   8           HG       SER   8  -3.661 -13.090  -6.514
   35    H    SER   9           H        SER   9  -6.265 -10.047  -5.480
   36    HA   SER   9           HA       SER   9  -5.782  -7.259  -4.719
   37    HB2  SER   9           1HB      SER   9  -8.241  -6.796  -5.006
   38    HB3  SER   9           2HB      SER   9  -7.364  -7.047  -6.516
   39    HG   SER   9           HG       SER   9  -9.460  -8.400  -5.556
   40    H    THR  10           H        THR  10  -5.703  -7.188  -2.585
   41    HA   THR  10           HA       THR  10  -7.172  -9.189  -1.024
   42    HB   THR  10           HB       THR  10  -5.748  -8.435   0.879
   43    HG1  THR  10           HG1      THR  10  -5.335  -6.311  -0.209
   44   HG21  THR  10          3HG2      THR  10  -4.313  -9.343  -1.617
   45   HG22  THR  10          1HG2      THR  10  -5.059 -10.369  -0.393
   46   HG23  THR  10          2HG2      THR  10  -3.634  -9.409   0.009
   47    H    LYS  11           H        LYS  11  -6.863  -5.739  -1.535
   48    HA   LYS  11           HA       LYS  11  -9.351  -5.329  -0.069
   49    HB2  LYS  11           1HB      LYS  11  -7.144  -4.882   1.331
   50    HB3  LYS  11           2HB      LYS  11  -7.166  -3.362   0.447
   51    HG2  LYS  11           1HG      LYS  11  -9.033  -2.606   1.511
   52    HG3  LYS  11           2HG      LYS  11  -9.670  -4.230   1.784
   53    HD2  LYS  11           1HD      LYS  11  -7.151  -3.464   3.166
   54    HD3  LYS  11           2HD      LYS  11  -8.663  -2.772   3.755
   55    HE2  LYS  11           1HE      LYS  11  -8.602  -4.680   5.007
   56    HE3  LYS  11           2HE      LYS  11  -9.465  -5.282   3.593
   57    HZ1  LYS  11           3HZ      LYS  11  -6.536  -5.528   4.014
   58    HZ2  LYS  11           1HZ      LYS  11  -7.427  -6.187   2.735
   59    HZ3  LYS  11           2HZ      LYS  11  -7.659  -6.758   4.310
   60    H    SER  12           H        SER  12 -10.462  -3.406  -0.647
   61    HA   SER  12           HA       SER  12 -10.402  -2.736  -3.332
   62    HB2  SER  12           1HB      SER  12 -11.633  -1.517  -0.905
   63    HB3  SER  12           2HB      SER  12 -11.606  -0.555  -2.383
   64    HG   SER  12           HG       SER  12 -12.741  -3.131  -2.027
   65    H    HIS  13           H        HIS  13  -9.348  -0.629  -0.650
   66    HA   HIS  13           HA       HIS  13  -7.779   0.951  -2.536
   67    HB2  HIS  13           1HB      HIS  13  -8.055   1.475   0.418
   68    HB3  HIS  13           2HB      HIS  13  -7.655   2.618  -0.860
   69    HD1  HIS  13           HD1      HIS  13  -9.771   2.836  -2.701
   70    HD2  HIS  13           HD2      HIS  13 -10.624   1.691   1.201
   71    HE1  HIS  13           HE1      HIS  13 -12.220   3.309  -2.382
   72    H    GLN  14           H        GLN  14  -5.865   0.046  -2.996
   73    HA   GLN  14           HA       GLN  14  -4.224  -0.920  -0.748
   74    HB2  GLN  14           1HB      GLN  14  -4.980  -2.513  -2.680
   75    HB3  GLN  14           2HB      GLN  14  -3.707  -1.713  -3.591
   76    HG2  GLN  14           1HG      GLN  14  -2.181  -2.310  -1.630
   77    HG3  GLN  14           2HG      GLN  14  -3.469  -3.407  -1.134
   78   HE21  GLN  14          1HE2      GLN  14  -0.769  -2.980  -3.101
   79   HE22  GLN  14          2HE2      GLN  14  -0.911  -4.424  -4.040
   80    H    CYS  15           H        CYS  15  -2.077  -0.298  -0.619
   81    HA   CYS  15           HA       CYS  15  -1.444   2.170  -2.025
   82    HB2  CYS  15           1HB      CYS  15  -1.135   2.003   0.434
   83    HB3  CYS  15           2HB      CYS  15   0.082   0.758   0.173
   84    H    HIS  16           H        HIS  16   0.468   2.506  -3.203
   85    HA   HIS  16           HA       HIS  16   1.584   0.047  -4.360
   86    HB2  HIS  16           1HB      HIS  16   0.431   1.891  -5.779
   87    HB3  HIS  16           2HB      HIS  16   1.927   2.789  -5.542
   88    HD1  HIS  16           HD1      HIS  16   1.434  -0.895  -6.354
   89    HD2  HIS  16           HD2      HIS  16   3.226   2.519  -7.902
   90    HE1  HIS  16           HE1      HIS  16   2.670  -1.657  -8.407
   91    H    GLU  17           H        GLU  17   2.347   2.752  -2.413
   92    HA   GLU  17           HA       GLU  17   5.126   2.932  -2.942
   93    HB2  GLU  17           1HB      GLU  17   3.763   3.634  -0.343
   94    HB3  GLU  17           2HB      GLU  17   5.258   4.301  -0.986
   95    HG2  GLU  17           1HG      GLU  17   2.486   4.713  -2.081
   96    HG3  GLU  17           2HG      GLU  17   3.477   5.897  -1.231
   97    H    CYS  18           H        CYS  18   3.218   1.111  -0.589
   98    HA   CYS  18           HA       CYS  18   5.639  -0.444   0.049
   99    HB2  CYS  18           1HB      CYS  18   4.683  -0.809   2.309
  100    HB3  CYS  18           2HB      CYS  18   5.032   0.886   1.984
  101    H    GLY  19           H        GLY  19   2.122  -0.478  -0.311
  102    HA2  GLY  19           1HA      GLY  19   1.142  -2.276  -1.627
  103    HA3  GLY  19           2HA      GLY  19   2.316  -3.364  -0.902
  104    H    ARG  20           H        ARG  20   0.541  -0.935   0.900
  105    HA   ARG  20           HA       ARG  20  -0.525  -3.010   2.621
  106    HB2  ARG  20           1HB      ARG  20  -0.240  -0.052   2.758
  107    HB3  ARG  20           2HB      ARG  20  -1.538  -0.781   3.693
  108    HG2  ARG  20           1HG      ARG  20   0.328  -2.370   4.554
  109    HG3  ARG  20           2HG      ARG  20   1.413  -1.099   3.987
  110    HD2  ARG  20           1HD      ARG  20   1.080  -0.374   6.121
  111    HD3  ARG  20           2HD      ARG  20  -0.275   0.432   5.333
  112    HE   ARG  20           HE       ARG  20  -0.964  -2.163   6.315
  113   HH11  ARG  20          1HH1      ARG  20  -0.537   1.173   7.214
  114   HH12  ARG  20          2HH1      ARG  20  -1.620   1.083   8.564
  115   HH21  ARG  20          1HH2      ARG  20  -2.391  -2.294   8.089
  116   HH22  ARG  20          2HH2      ARG  20  -2.673  -0.889   9.061
  117    H    GLY  21           H        GLY  21  -2.856  -2.688   3.404
  118    HA2  GLY  21           1HA      GLY  21  -4.606  -1.941   1.152
  119    HA3  GLY  21           2HA      GLY  21  -4.788  -3.503   1.936
  120    H    PHE  22           H        PHE  22  -6.519  -1.007   1.672
  121    HA   PHE  22           HA       PHE  22  -7.341  -0.967   4.482
  122    HB2  PHE  22           1HB      PHE  22  -7.037   1.519   2.783
  123    HB3  PHE  22           2HB      PHE  22  -7.692   1.464   4.416
  124    HD1  PHE  22           HD2      PHE  22  -4.662   1.231   2.379
  125    HD2  PHE  22           HD1      PHE  22  -6.254   1.201   6.326
  126    HE1  PHE  22           HE2      PHE  22  -2.397   1.537   3.291
  127    HE2  PHE  22           HE1      PHE  22  -3.992   1.509   7.244
  128    HZ   PHE  22           HZ       PHE  22  -2.060   1.676   5.726
  129    H    THR  23           H        THR  23  -9.521  -0.884   4.804
  130    HA   THR  23           HA       THR  23 -11.195  -1.528   2.574
  131    HB   THR  23           HB       THR  23 -12.076  -0.875   5.390
  132    HG1  THR  23           HG1      THR  23 -10.433  -2.628   5.092
  133   HG21  THR  23          3HG2      THR  23 -13.601  -1.279   3.165
  134   HG22  THR  23          1HG2      THR  23 -14.125  -1.610   4.815
  135   HG23  THR  23          2HG2      THR  23 -13.483  -2.913   3.815
  136    H    LEU  24           H        LEU  24 -10.972   1.241   4.792
  137    HA   LEU  24           HA       LEU  24 -12.860   2.727   3.125
  138    HB2  LEU  24           1HB      LEU  24 -11.717   3.143   5.862
  139    HB3  LEU  24           2HB      LEU  24 -12.500   4.465   4.999
  140    HG   LEU  24           HG       LEU  24 -13.870   1.848   5.585
  141   HD11  LEU  24          1HD1      LEU  24 -13.026   3.441   7.561
  142   HD12  LEU  24          2HD1      LEU  24 -14.552   2.560   7.618
  143   HD13  LEU  24          3HD1      LEU  24 -14.533   4.261   7.154
  144   HD21  LEU  24          3HD2      LEU  24 -14.530   4.187   4.067
  145   HD22  LEU  24          1HD2      LEU  24 -15.644   4.021   5.425
  146   HD23  LEU  24          2HD2      LEU  24 -15.450   2.696   4.278
  147    H    LYS  25           H        LYS  25 -12.111   3.954   1.543
  148    HA   LYS  25           HA       LYS  25  -9.608   4.413   0.720
  149    HB2  LYS  25           1HB      LYS  25 -11.472   5.222  -0.564
  150    HB3  LYS  25           2HB      LYS  25 -11.896   6.383   0.688
  151    HG2  LYS  25           1HG      LYS  25 -10.833   7.768  -0.762
  152    HG3  LYS  25           2HG      LYS  25  -9.450   7.257   0.208
  153    HD2  LYS  25           1HD      LYS  25 -10.249   5.756  -2.263
  154    HD3  LYS  25           2HD      LYS  25  -9.240   7.201  -2.361
  155    HE2  LYS  25           1HE      LYS  25  -7.841   5.972  -0.518
  156    HE3  LYS  25           2HE      LYS  25  -8.639   4.536  -1.158
  157    HZ1  LYS  25           3HZ      LYS  25  -6.412   5.191  -2.159
  158    HZ2  LYS  25           1HZ      LYS  25  -7.245   6.444  -2.932
  159    HZ3  LYS  25           2HZ      LYS  25  -7.665   4.835  -3.238
  160    H    SER  26           H        SER  26 -11.296   6.581   2.990
  161    HA   SER  26           HA       SER  26  -9.391   8.461   3.463
  162    HB2  SER  26           1HB      SER  26 -11.501   8.638   4.575
  163    HB3  SER  26           2HB      SER  26 -11.247   7.119   5.435
  164    HG   SER  26           HG       SER  26 -10.073   9.634   5.873
  165    H    HIS  27           H        HIS  27  -9.636   5.361   5.206
  166    HA   HIS  27           HA       HIS  27  -7.551   5.485   6.917
  167    HB2  HIS  27           1HB      HIS  27  -8.407   3.175   5.175
  168    HB3  HIS  27           2HB      HIS  27  -7.193   3.010   6.440
  169    HD1  HIS  27           HD1      HIS  27  -9.805   1.419   6.598
  170    HD2  HIS  27           HD2      HIS  27  -9.242   5.133   8.373
  171    HE1  HIS  27           HE1      HIS  27 -11.491   1.536   8.460
  172    H    LEU  28           H        LEU  28  -7.127   4.088   3.660
  173    HA   LEU  28           HA       LEU  28  -4.368   4.001   3.654
  174    HB2  LEU  28           1HB      LEU  28  -5.659   2.911   1.949
  175    HB3  LEU  28           2HB      LEU  28  -6.279   4.456   1.370
  176    HG   LEU  28           HG       LEU  28  -3.999   5.054   0.627
  177   HD11  LEU  28          1HD1      LEU  28  -3.030   3.307   2.340
  178   HD12  LEU  28          2HD1      LEU  28  -2.175   3.696   0.848
  179   HD13  LEU  28          3HD1      LEU  28  -3.142   2.225   0.952
  180   HD21  LEU  28          3HD2      LEU  28  -4.073   2.700  -0.903
  181   HD22  LEU  28          1HD2      LEU  28  -4.759   4.274  -1.306
  182   HD23  LEU  28          2HD2      LEU  28  -5.745   3.069  -0.478
  183    H    ASN  29           H        ASN  29  -6.393   6.569   2.224
  184    HA   ASN  29           HA       ASN  29  -4.594   8.330   1.305
  185    HB2  ASN  29           1HB      ASN  29  -7.157   8.584   1.604
  186    HB3  ASN  29           2HB      ASN  29  -6.749   9.359   3.131
  187   HD21  ASN  29          1HD2      ASN  29  -8.051  10.512   0.840
  188   HD22  ASN  29          2HD2      ASN  29  -7.058  11.823   0.309
  189    H    GLN  30           H        GLN  30  -5.538   8.142   4.735
  190    HA   GLN  30           HA       GLN  30  -3.696  10.090   5.624
  191    HB2  GLN  30           1HB      GLN  30  -5.600   9.528   6.987
  192    HB3  GLN  30           2HB      GLN  30  -5.090   7.848   7.090
  193    HG2  GLN  30           1HG      GLN  30  -3.172   8.464   8.410
  194    HG3  GLN  30           2HG      GLN  30  -3.557  10.174   8.225
  195   HE21  GLN  30          1HE2      GLN  30  -4.984  11.100   9.578
  196   HE22  GLN  30          2HE2      GLN  30  -5.820  10.267  10.839
  197    H    HIS  31           H        HIS  31  -3.474   6.625   5.149
  198    HA   HIS  31           HA       HIS  31  -1.044   6.229   6.551
  199    HB2  HIS  31           1HB      HIS  31  -2.072   4.213   6.200
  200    HB3  HIS  31           2HB      HIS  31  -2.674   4.674   4.611
  201    HD1  HIS  31           HD1      HIS  31   0.380   3.306   6.320
  202    HD2  HIS  31           HD2      HIS  31  -1.046   3.982   2.476
  203    HE1  HIS  31           HE1      HIS  31   1.986   2.122   4.790
  204    H    GLN  32           H        GLN  32  -1.710   6.523   3.059
  205    HA   GLN  32           HA       GLN  32   0.788   6.356   2.014
  206    HB2  GLN  32           1HB      GLN  32  -1.576   8.031   1.282
  207    HB3  GLN  32           2HB      GLN  32  -0.063   8.271   0.419
  208    HG2  GLN  32           1HG      GLN  32  -0.110   5.735   0.040
  209    HG3  GLN  32           2HG      GLN  32  -1.805   5.841   0.515
  210   HE21  GLN  32          1HE2      GLN  32  -2.845   5.506  -1.344
  211   HE22  GLN  32          2HE2      GLN  32  -2.638   6.443  -2.781
  212    H    ARG  33           H        ARG  33  -0.505   8.972   3.921
  213    HA   ARG  33           HA       ARG  33   1.143  11.076   3.362
  214    HB2  ARG  33           1HB      ARG  33   0.164  10.112   6.051
  215    HB3  ARG  33           2HB      ARG  33   0.953  11.664   5.806
  216    HG2  ARG  33           1HG      ARG  33  -0.818  12.415   4.384
  217    HG3  ARG  33           2HG      ARG  33  -1.564  10.815   4.394
  218    HD2  ARG  33           1HD      ARG  33  -2.799  12.151   5.913
  219    HD3  ARG  33           2HD      ARG  33  -1.807  11.064   6.885
  220    HE   ARG  33           HE       ARG  33  -0.754  12.891   7.753
  221   HH11  ARG  33          1HH1      ARG  33  -2.299  13.808   4.771
  222   HH12  ARG  33          2HH1      ARG  33  -1.927  15.491   4.945
  223   HH21  ARG  33          1HH2      ARG  33  -0.257  15.104   7.992
  224   HH22  ARG  33          2HH2      ARG  33  -0.765  16.227   6.777
  225    H    ILE  34           H        ILE  34   1.903   8.223   5.297
  226    HA   ILE  34           HA       ILE  34   4.316   8.968   6.405
  227    HB   ILE  34           HB       ILE  34   4.875   6.657   6.590
  228   HG12  ILE  34          1HG1      ILE  34   2.782   6.114   4.473
  229   HG13  ILE  34          2HG1      ILE  34   4.522   6.064   4.213
  230   HG21  ILE  34          1HG2      ILE  34   2.152   7.568   7.061
  231   HG22  ILE  34          2HG2      ILE  34   2.279   5.815   6.932
  232   HG23  ILE  34          3HG2      ILE  34   3.250   6.684   8.120
  233   HD11  ILE  34          3HD1      ILE  34   4.251   4.360   6.303
  234   HD12  ILE  34          1HD1      ILE  34   2.739   4.095   5.435
  235   HD13  ILE  34          2HD1      ILE  34   4.282   3.880   4.607
  236    H    HIS  35           H        HIS  35   3.629   7.902   3.124
  237    HA   HIS  35           HA       HIS  35   6.416   7.825   2.376
  238    HB2  HIS  35           1HB      HIS  35   3.999   7.761   0.563
  239    HB3  HIS  35           2HB      HIS  35   5.633   7.233   0.175
  240    HD1  HIS  35           HD1      HIS  35   6.441   5.230   2.038
  241    HD2  HIS  35           HD2      HIS  35   2.417   5.650   1.093
  242    HE1  HIS  35           HE1      HIS  35   5.374   3.035   2.646
  243    H    THR  36           H        THR  36   3.722  10.051   2.110
  244    HA   THR  36           HA       THR  36   5.572  12.058   1.003
  245    HB   THR  36           HB       THR  36   4.039  11.391  -0.772
  246    HG1  THR  36           HG1      THR  36   3.742  13.428  -1.342
  247   HG21  THR  36          3HG2      THR  36   1.738  12.410   0.865
  248   HG22  THR  36          1HG2      THR  36   2.217  10.714   0.919
  249   HG23  THR  36          2HG2      THR  36   1.705  11.438  -0.606
  250    H    GLY  37           H        GLY  37   5.849  13.692   2.364
  251    HA2  GLY  37           1HA      GLY  37   3.758  14.224   4.367
  252    HA3  GLY  37           2HA      GLY  37   5.451  14.670   4.520
  253    H    GLU  38           H        GLU  38   5.459  16.824   4.693
  254    HA   GLU  38           HA       GLU  38   3.989  18.360   2.651
  255    HB2  GLU  38           1HB      GLU  38   4.481  18.943   5.561
  256    HB3  GLU  38           2HB      GLU  38   4.102  20.230   4.423
  257    HG2  GLU  38           1HG      GLU  38   2.096  18.613   3.827
  258    HG3  GLU  38           2HG      GLU  38   2.385  18.056   5.474
  259    H    LYS  39           H        LYS  39   6.317  17.595   1.769
  260    HA   LYS  39           HA       LYS  39   8.502  18.140   1.265
  261    HB2  LYS  39           1HB      LYS  39   6.765  20.513   0.780
  262    HB3  LYS  39           2HB      LYS  39   8.502  20.714   0.591
  263    HG2  LYS  39           1HG      LYS  39   8.490  18.800  -0.995
  264    HG3  LYS  39           2HG      LYS  39   6.728  18.778  -0.881
  265    HD2  LYS  39           1HD      LYS  39   8.299  21.214  -1.700
  266    HD3  LYS  39           2HD      LYS  39   7.683  20.029  -2.853
  267    HE2  LYS  39           1HE      LYS  39   5.838  21.259  -0.850
  268    HE3  LYS  39           2HE      LYS  39   6.288  22.161  -2.297
  269    HZ1  LYS  39           3HZ      LYS  39   4.399  21.062  -2.966
  270    HZ2  LYS  39           1HZ      LYS  39   4.745  19.666  -2.074
  271    HZ3  LYS  39           2HZ      LYS  39   5.600  19.994  -3.496
  272    HA   PRO  40           HA       PRO  40   9.278  20.198   5.453
  273    HB2  PRO  40           1HB      PRO  40  10.339  18.028   6.692
  274    HB3  PRO  40           2HB      PRO  40   8.611  18.402   6.721
  275    HG2  PRO  40           1HG      PRO  40  10.101  16.463   4.994
  276    HG3  PRO  40           2HG      PRO  40   8.547  16.258   5.824
  277    HD2  PRO  40           1HD      PRO  40   8.724  16.831   3.183
  278    HD3  PRO  40           2HD      PRO  40   7.384  17.404   4.197
  279    H    SER  41           H        SER  41  11.319  20.809   6.230
  280    HA   SER  41           HA       SER  41  13.477  20.420   4.323
  281    HB2  SER  41           1HB      SER  41  13.376  22.167   6.794
  282    HB3  SER  41           2HB      SER  41  14.610  22.213   5.536
  283    HG   SER  41           HG       SER  41  11.889  22.584   4.906
  284    H    GLY  42           H        GLY  42  14.890  18.828   4.561
  285    HA2  GLY  42           1HA      GLY  42  16.593  18.335   6.591
  286    HA3  GLY  42           2HA      GLY  42  15.158  17.454   7.096
  287    HA   PRO  43           HA       PRO  43  17.892  14.995   4.075
  288    HB2  PRO  43           1HB      PRO  43  18.986  13.266   5.860
  289    HB3  PRO  43           2HB      PRO  43  19.744  14.802   5.422
  290    HG2  PRO  43           1HG      PRO  43  18.089  14.122   7.822
  291    HG3  PRO  43           2HG      PRO  43  19.584  15.071   7.726
  292    HD2  PRO  43           1HD      PRO  43  17.139  16.220   7.913
  293    HD3  PRO  43           2HD      PRO  43  18.482  16.971   7.028
  294    H    SER  44           H        SER  44  16.338  13.827   3.103
  295    HA   SER  44           HA       SER  44  14.411  12.286   4.554
  296    HB2  SER  44           1HB      SER  44  13.583  11.619   2.352
  297    HB3  SER  44           2HB      SER  44  13.883  13.356   2.387
  298    HG   SER  44           HG       SER  44  14.969  12.891   0.631
  299    H    SER  45           H        SER  45  15.051  10.511   5.597
  300    HA   SER  45           HA       SER  45  17.273   8.965   5.187
  301    HB2  SER  45           1HB      SER  45  15.692   8.798   7.128
  302    HB3  SER  45           2HB      SER  45  14.599   7.876   6.095
  303    HG   SER  45           HG       SER  45  17.282   7.082   6.403
  304    H    GLY  46           H        GLY  46  17.269   6.589   4.497
  305    HA2  GLY  46           1HA      GLY  46  17.045   6.351   1.779
  306    HA3  GLY  46           2HA      GLY  46  16.987   4.979   2.876
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1  11.944 -12.781   1.950
    2    HA2  GLY   1           1HA      GLY   1  11.332 -11.193  -0.074
    3    HA3  GLY   1           2HA      GLY   1  11.604 -12.692  -0.949
    4    H    SER   2           H        SER   2   9.711 -13.522  -1.519
    5    HA   SER   2           HA       SER   2   7.769 -14.196   0.496
    6    HB2  SER   2           1HB      SER   2   6.981 -12.290  -1.721
    7    HB3  SER   2           2HB      SER   2   5.886 -13.013  -0.543
    8    HG   SER   2           HG       SER   2   6.535 -11.629   0.914
    9    H    SER   3           H        SER   3   5.910 -15.416  -0.468
   10    HA   SER   3           HA       SER   3   6.924 -17.107  -2.627
   11    HB2  SER   3           1HB      SER   3   5.079 -18.652  -1.926
   12    HB3  SER   3           2HB      SER   3   6.241 -18.304  -0.645
   13    HG   SER   3           HG       SER   3   4.125 -18.131   0.139
   14    H    GLY   4           H        GLY   4   5.677 -17.643  -4.451
   15    HA2  GLY   4           1HA      GLY   4   3.866 -15.507  -5.269
   16    HA3  GLY   4           2HA      GLY   4   4.567 -16.735  -6.312
   17    H    SER   5           H        SER   5   1.834 -15.775  -4.544
   18    HA   SER   5           HA       SER   5   0.566 -18.394  -5.015
   19    HB2  SER   5           1HB      SER   5   0.793 -17.641  -2.598
   20    HB3  SER   5           2HB      SER   5  -0.346 -16.352  -2.984
   21    HG   SER   5           HG       SER   5  -1.068 -18.941  -3.705
   22    H    SER   6           H        SER   6  -1.756 -18.313  -5.507
   23    HA   SER   6           HA       SER   6  -2.293 -16.185  -7.415
   24    HB2  SER   6           1HB      SER   6  -4.139 -17.596  -8.173
   25    HB3  SER   6           2HB      SER   6  -2.656 -18.545  -8.066
   26    HG   SER   6           HG       SER   6  -3.435 -19.610  -6.367
   27    H    GLY   7           H        GLY   7  -2.798 -14.412  -6.135
   28    HA2  GLY   7           1HA      GLY   7  -4.369 -12.993  -5.200
   29    HA3  GLY   7           2HA      GLY   7  -5.516 -14.325  -5.198
   30    H    SER   8           H        SER   8  -2.875 -12.810  -3.448
   31    HA   SER   8           HA       SER   8  -3.228 -14.533  -1.147
   32    HB2  SER   8           1HB      SER   8  -0.983 -13.672  -1.819
   33    HB3  SER   8           2HB      SER   8  -1.525 -12.044  -1.413
   34    HG   SER   8           HG       SER   8  -1.314 -14.259   0.350
   35    H    SER   9           H        SER   9  -3.384 -11.001  -1.639
   36    HA   SER   9           HA       SER   9  -5.724 -10.896   0.108
   37    HB2  SER   9           1HB      SER   9  -3.906 -10.501   1.652
   38    HB3  SER   9           2HB      SER   9  -3.188  -9.309   0.568
   39    HG   SER   9           HG       SER   9  -4.944  -8.880   2.472
   40    H    THR  10           H        THR  10  -7.158  -9.310  -0.408
   41    HA   THR  10           HA       THR  10  -6.361  -7.258  -2.339
   42    HB   THR  10           HB       THR  10  -8.497  -7.677  -3.621
   43    HG1  THR  10           HG1      THR  10  -9.495  -9.039  -2.048
   44   HG21  THR  10          3HG2      THR  10  -7.559  -9.645  -4.866
   45   HG22  THR  10          1HG2      THR  10  -6.325  -9.771  -3.613
   46   HG23  THR  10          2HG2      THR  10  -6.419  -8.323  -4.615
   47    H    LYS  11           H        LYS  11  -6.882  -5.390  -1.427
   48    HA   LYS  11           HA       LYS  11  -9.374  -5.232   0.138
   49    HB2  LYS  11           1HB      LYS  11  -6.974  -4.795   1.173
   50    HB3  LYS  11           2HB      LYS  11  -7.205  -3.206   0.454
   51    HG2  LYS  11           1HG      LYS  11  -8.040  -2.856   2.551
   52    HG3  LYS  11           2HG      LYS  11  -9.510  -3.317   1.690
   53    HD2  LYS  11           1HD      LYS  11  -9.653  -4.640   3.571
   54    HD3  LYS  11           2HD      LYS  11  -8.843  -5.731   2.444
   55    HE2  LYS  11           1HE      LYS  11  -6.765  -5.430   3.468
   56    HE3  LYS  11           2HE      LYS  11  -7.275  -3.950   4.279
   57    HZ1  LYS  11           3HZ      LYS  11  -7.758  -6.738   5.022
   58    HZ2  LYS  11           1HZ      LYS  11  -8.959  -5.606   5.396
   59    HZ3  LYS  11           2HZ      LYS  11  -7.392  -5.408   6.000
   60    H    SER  12           H        SER  12 -10.695  -3.403  -0.104
   61    HA   SER  12           HA       SER  12 -11.328  -2.508  -2.550
   62    HB2  SER  12           1HB      SER  12 -11.560  -1.236   0.139
   63    HB3  SER  12           2HB      SER  12 -11.946  -0.255  -1.275
   64    HG   SER  12           HG       SER  12 -13.129  -2.709  -0.492
   65    H    HIS  13           H        HIS  13  -9.030  -0.833  -0.407
   66    HA   HIS  13           HA       HIS  13  -7.882   0.447  -2.800
   67    HB2  HIS  13           1HB      HIS  13  -7.798   1.716  -0.074
   68    HB3  HIS  13           2HB      HIS  13  -7.557   2.470  -1.647
   69    HD1  HIS  13           HD1      HIS  13  -9.607   3.345  -2.854
   70    HD2  HIS  13           HD2      HIS  13 -10.526   1.221   0.596
   71    HE1  HIS  13           HE1      HIS  13 -12.057   3.745  -2.451
   72    H    GLN  14           H        GLN  14  -5.816  -0.015  -3.157
   73    HA   GLN  14           HA       GLN  14  -4.204  -1.028  -0.909
   74    HB2  GLN  14           1HB      GLN  14  -4.842  -2.614  -2.852
   75    HB3  GLN  14           2HB      GLN  14  -3.660  -1.705  -3.785
   76    HG2  GLN  14           1HG      GLN  14  -2.350  -3.400  -3.031
   77    HG3  GLN  14           2HG      GLN  14  -2.114  -2.234  -1.730
   78   HE21  GLN  14          1HE2      GLN  14  -1.471  -4.361  -0.715
   79   HE22  GLN  14          2HE2      GLN  14  -2.712  -5.226   0.119
   80    H    CYS  15           H        CYS  15  -2.161  -0.239  -0.616
   81    HA   CYS  15           HA       CYS  15  -1.582   2.309  -1.797
   82    HB2  CYS  15           1HB      CYS  15  -1.086   1.676   0.593
   83    HB3  CYS  15           2HB      CYS  15   0.212   0.655  -0.015
   84    H    HIS  16           H        HIS  16   0.604   2.803  -2.692
   85    HA   HIS  16           HA       HIS  16   1.496   0.620  -4.460
   86    HB2  HIS  16           1HB      HIS  16   0.361   2.571  -5.577
   87    HB3  HIS  16           2HB      HIS  16   1.693   3.582  -5.026
   88    HD1  HIS  16           HD1      HIS  16   1.414   0.294  -6.940
   89    HD2  HIS  16           HD2      HIS  16   3.525   3.872  -6.977
   90    HE1  HIS  16           HE1      HIS  16   2.954   0.145  -8.923
   91    H    GLU  17           H        GLU  17   2.401   2.892  -2.065
   92    HA   GLU  17           HA       GLU  17   5.202   2.957  -2.679
   93    HB2  GLU  17           1HB      GLU  17   3.964   3.610  -0.011
   94    HB3  GLU  17           2HB      GLU  17   5.458   4.234  -0.698
   95    HG2  GLU  17           1HG      GLU  17   2.709   4.799  -1.784
   96    HG3  GLU  17           2HG      GLU  17   3.606   5.865  -0.703
   97    H    CYS  18           H        CYS  18   3.148   1.184  -0.412
   98    HA   CYS  18           HA       CYS  18   5.433  -0.591   0.148
   99    HB2  CYS  18           1HB      CYS  18   4.410  -1.029   2.358
  100    HB3  CYS  18           2HB      CYS  18   4.852   0.662   2.150
  101    H    GLY  19           H        GLY  19   1.957  -0.343  -0.380
  102    HA2  GLY  19           1HA      GLY  19   0.801  -1.940  -1.733
  103    HA3  GLY  19           2HA      GLY  19   1.973  -3.154  -1.242
  104    H    ARG  20           H        ARG  20   0.407  -0.951   0.991
  105    HA   ARG  20           HA       ARG  20  -0.557  -3.170   2.549
  106    HB2  ARG  20           1HB      ARG  20  -0.410  -0.218   2.878
  107    HB3  ARG  20           2HB      ARG  20  -1.630  -1.074   3.812
  108    HG2  ARG  20           1HG      ARG  20   0.437  -2.625   4.391
  109    HG3  ARG  20           2HG      ARG  20   1.324  -1.144   4.025
  110    HD2  ARG  20           1HD      ARG  20   0.934  -0.912   6.286
  111    HD3  ARG  20           2HD      ARG  20  -0.428  -0.031   5.595
  112    HE   ARG  20           HE       ARG  20  -1.435  -2.505   5.897
  113   HH11  ARG  20          1HH1      ARG  20   0.304  -0.399   8.056
  114   HH12  ARG  20          2HH1      ARG  20  -0.465  -1.011   9.483
  115   HH21  ARG  20          1HH2      ARG  20  -2.454  -3.320   7.768
  116   HH22  ARG  20          2HH2      ARG  20  -2.033  -2.673   9.318
  117    H    GLY  21           H        GLY  21  -2.887  -2.868   3.500
  118    HA2  GLY  21           1HA      GLY  21  -4.736  -2.225   1.292
  119    HA3  GLY  21           2HA      GLY  21  -4.869  -3.744   2.166
  120    H    PHE  22           H        PHE  22  -6.415  -1.002   1.848
  121    HA   PHE  22           HA       PHE  22  -7.233  -0.934   4.671
  122    HB2  PHE  22           1HB      PHE  22  -7.039   1.516   2.912
  123    HB3  PHE  22           2HB      PHE  22  -7.433   1.466   4.627
  124    HD1  PHE  22           HD2      PHE  22  -4.734   0.953   2.164
  125    HD2  PHE  22           HD1      PHE  22  -5.743   1.433   6.271
  126    HE1  PHE  22           HE2      PHE  22  -2.352   1.232   2.714
  127    HE2  PHE  22           HE1      PHE  22  -3.363   1.713   6.827
  128    HZ   PHE  22           HZ       PHE  22  -1.663   1.611   5.048
  129    H    THR  23           H        THR  23  -9.354  -1.157   4.975
  130    HA   THR  23           HA       THR  23 -11.107  -1.728   2.855
  131    HB   THR  23           HB       THR  23 -12.918  -1.570   4.585
  132    HG1  THR  23           HG1      THR  23 -10.787  -0.451   6.003
  133   HG21  THR  23          3HG2      THR  23 -11.761  -3.345   6.123
  134   HG22  THR  23          1HG2      THR  23 -10.459  -3.232   4.940
  135   HG23  THR  23          2HG2      THR  23 -12.076  -3.715   4.428
  136    H    LEU  24           H        LEU  24 -10.858   1.150   4.935
  137    HA   LEU  24           HA       LEU  24 -12.766   2.564   3.247
  138    HB2  LEU  24           1HB      LEU  24 -11.422   3.188   5.856
  139    HB3  LEU  24           2HB      LEU  24 -12.295   4.423   4.951
  140    HG   LEU  24           HG       LEU  24 -13.526   1.856   5.947
  141   HD11  LEU  24          1HD1      LEU  24 -12.703   3.518   7.708
  142   HD12  LEU  24          2HD1      LEU  24 -14.391   3.012   7.783
  143   HD13  LEU  24          3HD1      LEU  24 -13.972   4.586   7.106
  144   HD21  LEU  24          3HD2      LEU  24 -14.409   3.988   4.187
  145   HD22  LEU  24          1HD2      LEU  24 -15.482   3.769   5.569
  146   HD23  LEU  24          2HD2      LEU  24 -15.130   2.409   4.503
  147    H    LYS  25           H        LYS  25 -12.241   4.068   1.780
  148    HA   LYS  25           HA       LYS  25  -9.726   4.292   0.680
  149    HB2  LYS  25           1HB      LYS  25 -12.074   5.138  -0.136
  150    HB3  LYS  25           2HB      LYS  25 -11.572   6.649   0.611
  151    HG2  LYS  25           1HG      LYS  25  -9.885   5.218  -1.419
  152    HG3  LYS  25           2HG      LYS  25 -11.123   6.395  -1.865
  153    HD2  LYS  25           1HD      LYS  25  -9.979   8.041  -0.367
  154    HD3  LYS  25           2HD      LYS  25  -8.680   6.865  -0.161
  155    HE2  LYS  25           1HE      LYS  25  -8.006   7.036  -2.379
  156    HE3  LYS  25           2HE      LYS  25  -9.553   7.704  -2.899
  157    HZ1  LYS  25           3HZ      LYS  25  -8.827   9.755  -2.534
  158    HZ2  LYS  25           1HZ      LYS  25  -7.277   9.115  -2.308
  159    HZ3  LYS  25           2HZ      LYS  25  -8.286   9.379  -0.976
  160    H    SER  26           H        SER  26 -11.257   6.469   3.037
  161    HA   SER  26           HA       SER  26  -9.323   8.407   3.253
  162    HB2  SER  26           1HB      SER  26 -10.088   8.651   5.643
  163    HB3  SER  26           2HB      SER  26 -11.390   8.644   4.454
  164    HG   SER  26           HG       SER  26 -11.673   7.274   6.377
  165    H    HIS  27           H        HIS  27  -9.501   5.393   5.145
  166    HA   HIS  27           HA       HIS  27  -7.341   5.578   6.755
  167    HB2  HIS  27           1HB      HIS  27  -8.299   3.208   5.156
  168    HB3  HIS  27           2HB      HIS  27  -7.008   3.079   6.346
  169    HD1  HIS  27           HD1      HIS  27  -9.779   1.620   6.589
  170    HD2  HIS  27           HD2      HIS  27  -8.751   5.181   8.467
  171    HE1  HIS  27           HE1      HIS  27 -11.299   1.791   8.585
  172    H    LEU  28           H        LEU  28  -7.090   4.107   3.512
  173    HA   LEU  28           HA       LEU  28  -4.324   3.989   3.395
  174    HB2  LEU  28           1HB      LEU  28  -5.642   2.822   1.790
  175    HB3  LEU  28           2HB      LEU  28  -6.368   4.319   1.212
  176    HG   LEU  28           HG       LEU  28  -4.090   4.981   0.376
  177   HD11  LEU  28          1HD1      LEU  28  -3.264   2.145   0.407
  178   HD12  LEU  28          2HD1      LEU  28  -3.121   3.030   1.925
  179   HD13  LEU  28          3HD1      LEU  28  -2.293   3.615   0.483
  180   HD21  LEU  28          3HD2      LEU  28  -4.775   2.442  -0.984
  181   HD22  LEU  28          1HD2      LEU  28  -4.531   4.057  -1.648
  182   HD23  LEU  28          2HD2      LEU  28  -6.051   3.653  -0.849
  183    H    ASN  29           H        ASN  29  -6.489   6.602   2.366
  184    HA   ASN  29           HA       ASN  29  -4.638   8.299   1.198
  185    HB2  ASN  29           1HB      ASN  29  -7.074   8.678   1.151
  186    HB3  ASN  29           2HB      ASN  29  -7.040   9.082   2.866
  187   HD21  ASN  29          1HD2      ASN  29  -7.354  11.173   3.072
  188   HD22  ASN  29          2HD2      ASN  29  -6.589  12.413   2.144
  189    H    GLN  30           H        GLN  30  -5.647   8.169   4.608
  190    HA   GLN  30           HA       GLN  30  -3.772  10.166   5.426
  191    HB2  GLN  30           1HB      GLN  30  -5.234   8.150   7.137
  192    HB3  GLN  30           2HB      GLN  30  -4.476   9.639   7.687
  193    HG2  GLN  30           1HG      GLN  30  -6.078  10.929   6.344
  194    HG3  GLN  30           2HG      GLN  30  -6.858   9.424   5.860
  195   HE21  GLN  30          1HE2      GLN  30  -7.776   8.099   7.571
  196   HE22  GLN  30          2HE2      GLN  30  -8.427   8.871   8.972
  197    H    HIS  31           H        HIS  31  -3.395   6.994   4.517
  198    HA   HIS  31           HA       HIS  31  -1.240   6.392   6.381
  199    HB2  HIS  31           1HB      HIS  31  -2.380   4.431   5.999
  200    HB3  HIS  31           2HB      HIS  31  -2.770   4.856   4.335
  201    HD1  HIS  31           HD1      HIS  31   0.053   3.492   6.428
  202    HD2  HIS  31           HD2      HIS  31  -1.021   3.898   2.435
  203    HE1  HIS  31           HE1      HIS  31   1.735   2.137   5.139
  204    H    GLN  32           H        GLN  32  -1.727   7.270   3.019
  205    HA   GLN  32           HA       GLN  32   0.871   6.755   2.080
  206    HB2  GLN  32           1HB      GLN  32  -1.404   8.462   1.178
  207    HB3  GLN  32           2HB      GLN  32   0.174   8.722   0.447
  208    HG2  GLN  32           1HG      GLN  32   0.254   6.396  -0.252
  209    HG3  GLN  32           2HG      GLN  32  -1.305   6.102   0.516
  210   HE21  GLN  32          1HE2      GLN  32  -0.341   5.940  -2.313
  211   HE22  GLN  32          2HE2      GLN  32  -1.476   6.879  -3.216
  212    H    ARG  33           H        ARG  33  -0.198   9.003   4.331
  213    HA   ARG  33           HA       ARG  33   1.461  11.215   3.767
  214    HB2  ARG  33           1HB      ARG  33   0.583  10.357   6.521
  215    HB3  ARG  33           2HB      ARG  33   0.938  11.985   5.958
  216    HG2  ARG  33           1HG      ARG  33  -1.469  10.293   5.445
  217    HG3  ARG  33           2HG      ARG  33  -1.370  11.952   6.039
  218    HD2  ARG  33           1HD      ARG  33  -0.593  11.109   3.252
  219    HD3  ARG  33           2HD      ARG  33  -2.187  11.727   3.684
  220    HE   ARG  33           HE       ARG  33   0.260  13.241   3.424
  221   HH11  ARG  33          1HH1      ARG  33  -2.980  13.151   4.694
  222   HH12  ARG  33          2HH1      ARG  33  -3.126  14.874   4.801
  223   HH21  ARG  33          1HH2      ARG  33   0.081  15.511   3.560
  224   HH22  ARG  33          2HH2      ARG  33  -1.384  16.215   4.155
  225    H    ILE  34           H        ILE  34   2.182   8.093   4.877
  226    HA   ILE  34           HA       ILE  34   4.560   8.817   6.352
  227    HB   ILE  34           HB       ILE  34   4.869   6.533   6.786
  228   HG12  ILE  34          1HG1      ILE  34   3.082   6.008   4.404
  229   HG13  ILE  34          2HG1      ILE  34   4.802   5.656   4.537
  230   HG21  ILE  34          1HG2      ILE  34   2.159   5.878   6.840
  231   HG22  ILE  34          2HG2      ILE  34   3.100   6.632   8.126
  232   HG23  ILE  34          3HG2      ILE  34   2.214   7.635   6.978
  233   HD11  ILE  34          3HD1      ILE  34   3.936   3.588   4.903
  234   HD12  ILE  34          1HD1      ILE  34   3.994   4.184   6.562
  235   HD13  ILE  34          2HD1      ILE  34   2.474   4.210   5.667
  236    H    HIS  35           H        HIS  35   3.718   7.902   3.106
  237    HA   HIS  35           HA       HIS  35   6.509   7.484   2.366
  238    HB2  HIS  35           1HB      HIS  35   4.106   7.399   0.541
  239    HB3  HIS  35           2HB      HIS  35   5.697   6.695   0.264
  240    HD1  HIS  35           HD1      HIS  35   6.302   4.778   2.225
  241    HD2  HIS  35           HD2      HIS  35   2.314   5.563   1.366
  242    HE1  HIS  35           HE1      HIS  35   5.028   2.776   3.058
  243    H    THR  36           H        THR  36   3.919   9.804   1.981
  244    HA   THR  36           HA       THR  36   5.172  11.370  -0.036
  245    HB   THR  36           HB       THR  36   2.678  11.351   0.729
  246    HG1  THR  36           HG1      THR  36   4.268  13.415  -0.263
  247   HG21  THR  36          3HG2      THR  36   2.085  13.137   2.264
  248   HG22  THR  36          1HG2      THR  36   3.786  13.540   2.491
  249   HG23  THR  36          2HG2      THR  36   3.163  11.994   3.066
  250    H    GLY  37           H        GLY  37   6.583  13.030   0.105
  251    HA2  GLY  37           1HA      GLY  37   7.027  14.806   2.127
  252    HA3  GLY  37           2HA      GLY  37   7.986  13.407   2.587
  253    H    GLU  38           H        GLU  38   9.604  15.294   2.357
  254    HA   GLU  38           HA       GLU  38  10.374  16.069  -0.276
  255    HB2  GLU  38           1HB      GLU  38  11.889  16.203   2.337
  256    HB3  GLU  38           2HB      GLU  38  12.403  16.965   0.839
  257    HG2  GLU  38           1HG      GLU  38   9.993  18.043   0.989
  258    HG3  GLU  38           2HG      GLU  38  10.228  17.717   2.705
  259    H    LYS  39           H        LYS  39  11.337  14.827  -1.724
  260    HA   LYS  39           HA       LYS  39  13.512  13.073  -0.934
  261    HB2  LYS  39           1HB      LYS  39  11.149  11.873  -0.948
  262    HB3  LYS  39           2HB      LYS  39  11.436  11.830  -2.683
  263    HG2  LYS  39           1HG      LYS  39  13.379  10.515  -2.428
  264    HG3  LYS  39           2HG      LYS  39  13.428  10.796  -0.686
  265    HD2  LYS  39           1HD      LYS  39  12.595   8.577  -1.083
  266    HD3  LYS  39           2HD      LYS  39  11.267   9.577  -0.490
  267    HE2  LYS  39           1HE      LYS  39  10.367   8.338  -2.276
  268    HE3  LYS  39           2HE      LYS  39  10.658   9.950  -2.926
  269    HZ1  LYS  39           3HZ      LYS  39  12.840   9.030  -3.748
  270    HZ2  LYS  39           1HZ      LYS  39  11.454   8.453  -4.527
  271    HZ3  LYS  39           2HZ      LYS  39  12.242   7.491  -3.381
  272    HA   PRO  40           HA       PRO  40  15.115  14.576  -4.753
  273    HB2  PRO  40           1HB      PRO  40  17.105  12.762  -5.101
  274    HB3  PRO  40           2HB      PRO  40  17.188  14.062  -3.907
  275    HG2  PRO  40           1HG      PRO  40  16.463  11.183  -3.525
  276    HG3  PRO  40           2HG      PRO  40  17.495  12.219  -2.522
  277    HD2  PRO  40           1HD      PRO  40  14.925  11.662  -1.878
  278    HD3  PRO  40           2HD      PRO  40  15.697  13.209  -1.473
  279    H    SER  41           H        SER  41  15.140  14.109  -6.961
  280    HA   SER  41           HA       SER  41  14.297  13.201  -8.874
  281    HB2  SER  41           1HB      SER  41  16.184  11.643  -8.418
  282    HB3  SER  41           2HB      SER  41  15.068  10.589  -7.551
  283    HG   SER  41           HG       SER  41  14.353  11.343 -10.133
  284    H    GLY  42           H        GLY  42  12.345  13.788  -6.974
  285    HA2  GLY  42           1HA      GLY  42  10.551  11.551  -6.688
  286    HA3  GLY  42           2HA      GLY  42  10.220  13.219  -6.245
  287    HA   PRO  43           HA       PRO  43   7.820  13.912  -9.845
  288    HB2  PRO  43           1HB      PRO  43   8.794  16.198 -10.940
  289    HB3  PRO  43           2HB      PRO  43   7.878  16.171  -9.428
  290    HG2  PRO  43           1HG      PRO  43  10.839  16.305  -9.847
  291    HG3  PRO  43           2HG      PRO  43   9.829  17.207  -8.702
  292    HD2  PRO  43           1HD      PRO  43  11.285  15.044  -7.970
  293    HD3  PRO  43           2HD      PRO  43   9.733  15.452  -7.211
  294    H    SER  44           H        SER  44   7.724  13.909 -12.169
  295    HA   SER  44           HA       SER  44  10.197  13.492 -13.635
  296    HB2  SER  44           1HB      SER  44   9.685  11.242 -12.802
  297    HB3  SER  44           2HB      SER  44   8.062  11.349 -13.484
  298    HG   SER  44           HG       SER  44   8.874  11.191 -15.490
  299    H    SER  45           H        SER  45  10.047  14.083 -15.739
  300    HA   SER  45           HA       SER  45   8.181  15.810 -16.666
  301    HB2  SER  45           1HB      SER  45  10.222  15.442 -17.897
  302    HB3  SER  45           2HB      SER  45   9.756  13.783 -18.268
  303    HG   SER  45           HG       SER  45   8.544  14.480 -19.845
  304    H    GLY  46           H        GLY  46   8.145  12.303 -17.321
  305    HA2  GLY  46           1HA      GLY  46   6.452  11.018 -18.272
  306    HA3  GLY  46           2HA      GLY  46   5.596  11.645 -16.872
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1   9.856 -15.433   2.290
    2    HA2  GLY   1           1HA      GLY   1   8.533 -16.827   3.751
    3    HA3  GLY   1           2HA      GLY   1  10.027 -17.494   4.390
    4    H    SER   2           H        SER   2   7.815 -14.802   4.465
    5    HA   SER   2           HA       SER   2   9.090 -13.906   6.961
    6    HB2  SER   2           1HB      SER   2   8.016 -12.179   4.723
    7    HB3  SER   2           2HB      SER   2   8.404 -11.564   6.329
    8    HG   SER   2           HG       SER   2  10.550 -12.225   5.999
    9    H    SER   3           H        SER   3   7.623 -12.716   8.402
   10    HA   SER   3           HA       SER   3   5.134 -14.091   8.658
   11    HB2  SER   3           1HB      SER   3   6.172 -11.701  10.201
   12    HB3  SER   3           2HB      SER   3   4.824 -12.734  10.675
   13    HG   SER   3           HG       SER   3   6.347 -14.484  10.732
   14    H    GLY   4           H        GLY   4   3.035 -13.018   8.891
   15    HA2  GLY   4           1HA      GLY   4   2.771 -10.477   7.459
   16    HA3  GLY   4           2HA      GLY   4   1.939 -11.877   6.798
   17    H    SER   5           H        SER   5  -0.044 -10.725   7.091
   18    HA   SER   5           HA       SER   5  -1.132 -11.107   9.769
   19    HB2  SER   5           1HB      SER   5  -0.321  -8.726   9.603
   20    HB3  SER   5           2HB      SER   5  -1.499  -8.481   8.314
   21    HG   SER   5           HG       SER   5  -2.305  -7.862  10.374
   22    H    SER   6           H        SER   6  -2.709 -12.509   9.334
   23    HA   SER   6           HA       SER   6  -4.330 -12.150   6.920
   24    HB2  SER   6           1HB      SER   6  -4.275 -14.481   8.851
   25    HB3  SER   6           2HB      SER   6  -5.102 -14.430   7.294
   26    HG   SER   6           HG       SER   6  -2.997 -14.116   6.343
   27    H    GLY   7           H        GLY   7  -5.669 -10.456   7.545
   28    HA2  GLY   7           1HA      GLY   7  -7.733 -11.223   9.497
   29    HA3  GLY   7           2HA      GLY   7  -6.962  -9.650   9.633
   30    H    SER   8           H        SER   8  -6.791  -8.953   6.940
   31    HA   SER   8           HA       SER   8  -9.624  -8.463   6.369
   32    HB2  SER   8           1HB      SER   8  -7.108  -7.045   5.474
   33    HB3  SER   8           2HB      SER   8  -8.713  -6.658   4.855
   34    HG   SER   8           HG       SER   8  -8.354  -6.737   7.624
   35    H    SER   9           H        SER   9 -10.203 -10.333   5.293
   36    HA   SER   9           HA       SER   9  -8.691 -11.516   3.218
   37    HB2  SER   9           1HB      SER   9 -11.674 -11.713   3.696
   38    HB3  SER   9           2HB      SER   9 -10.689 -12.831   2.752
   39    HG   SER   9           HG       SER   9 -10.798 -12.458   5.532
   40    H    THR  10           H        THR  10 -11.754  -9.698   2.998
   41    HA   THR  10           HA       THR  10 -11.204  -9.148   0.185
   42    HB   THR  10           HB       THR  10 -13.494  -8.242   0.111
   43    HG1  THR  10           HG1      THR  10 -14.441  -7.716   1.921
   44   HG21  THR  10          3HG2      THR  10 -14.576 -10.505   1.066
   45   HG22  THR  10          1HG2      THR  10 -12.883 -10.994   1.013
   46   HG23  THR  10          2HG2      THR  10 -13.686 -10.433  -0.454
   47    H    LYS  11           H        LYS  11  -9.547  -7.620   0.331
   48    HA   LYS  11           HA       LYS  11  -9.835  -5.239   1.908
   49    HB2  LYS  11           1HB      LYS  11  -7.690  -4.717   1.258
   50    HB3  LYS  11           2HB      LYS  11  -7.668  -6.463   1.050
   51    HG2  LYS  11           1HG      LYS  11  -8.457  -5.808  -1.393
   52    HG3  LYS  11           2HG      LYS  11  -7.625  -4.306  -0.981
   53    HD2  LYS  11           1HD      LYS  11  -6.336  -6.990  -0.580
   54    HD3  LYS  11           2HD      LYS  11  -6.263  -6.147  -2.129
   55    HE2  LYS  11           1HE      LYS  11  -4.347  -5.352  -1.184
   56    HE3  LYS  11           2HE      LYS  11  -5.483  -4.144  -0.586
   57    HZ1  LYS  11           3HZ      LYS  11  -3.965  -5.051   1.130
   58    HZ2  LYS  11           1HZ      LYS  11  -4.693  -6.566   0.936
   59    HZ3  LYS  11           2HZ      LYS  11  -5.602  -5.257   1.502
   60    H    SER  12           H        SER  12  -9.497  -3.058   0.766
   61    HA   SER  12           HA       SER  12 -11.286  -2.924  -1.574
   62    HB2  SER  12           1HB      SER  12 -12.124  -2.004   0.702
   63    HB3  SER  12           2HB      SER  12 -11.003  -0.675   0.405
   64    HG   SER  12           HG       SER  12 -12.163  -0.668  -1.769
   65    H    HIS  13           H        HIS  13  -9.047  -0.731   0.130
   66    HA   HIS  13           HA       HIS  13  -7.935   0.021  -2.487
   67    HB2  HIS  13           1HB      HIS  13  -7.604   1.556   0.088
   68    HB3  HIS  13           2HB      HIS  13  -7.340   2.127  -1.557
   69    HD1  HIS  13           HD1      HIS  13  -9.319   3.103  -2.779
   70    HD2  HIS  13           HD2      HIS  13 -10.370   1.287   0.807
   71    HE1  HIS  13           HE1      HIS  13 -11.726   3.721  -2.392
   72    H    GLN  14           H        GLN  14  -5.715   0.075  -2.818
   73    HA   GLN  14           HA       GLN  14  -4.061  -1.142  -0.711
   74    HB2  GLN  14           1HB      GLN  14  -4.492  -2.878  -2.317
   75    HB3  GLN  14           2HB      GLN  14  -4.091  -1.810  -3.655
   76    HG2  GLN  14           1HG      GLN  14  -1.765  -1.675  -2.665
   77    HG3  GLN  14           2HG      GLN  14  -2.242  -3.015  -1.623
   78   HE21  GLN  14          1HE2      GLN  14  -0.925  -4.556  -2.440
   79   HE22  GLN  14          2HE2      GLN  14  -1.023  -5.157  -4.057
   80    H    CYS  15           H        CYS  15  -2.067  -0.278  -0.409
   81    HA   CYS  15           HA       CYS  15  -1.541   2.284  -1.580
   82    HB2  CYS  15           1HB      CYS  15  -1.013   1.705   0.792
   83    HB3  CYS  15           2HB      CYS  15   0.250   0.627   0.207
   84    H    HIS  16           H        HIS  16   0.355   2.885  -2.747
   85    HA   HIS  16           HA       HIS  16   1.374   0.708  -4.439
   86    HB2  HIS  16           1HB      HIS  16   0.155   2.571  -5.565
   87    HB3  HIS  16           2HB      HIS  16   1.397   3.682  -4.994
   88    HD1  HIS  16           HD1      HIS  16   2.006   4.243  -7.465
   89    HD2  HIS  16           HD2      HIS  16   2.606   0.273  -6.396
   90    HE1  HIS  16           HE1      HIS  16   3.416   3.258  -9.300
   91    H    GLU  17           H        GLU  17   2.271   3.030  -2.084
   92    HA   GLU  17           HA       GLU  17   5.039   3.221  -2.771
   93    HB2  GLU  17           1HB      GLU  17   3.846   3.732  -0.050
   94    HB3  GLU  17           2HB      GLU  17   5.305   4.429  -0.739
   95    HG2  GLU  17           1HG      GLU  17   2.625   4.914  -1.978
   96    HG3  GLU  17           2HG      GLU  17   3.193   5.875  -0.613
   97    H    CYS  18           H        CYS  18   3.187   1.339  -0.403
   98    HA   CYS  18           HA       CYS  18   5.576  -0.336   0.016
   99    HB2  CYS  18           1HB      CYS  18   4.603  -0.925   2.214
  100    HB3  CYS  18           2HB      CYS  18   4.927   0.799   2.065
  101    H    GLY  19           H        GLY  19   2.076  -0.321  -0.443
  102    HA2  GLY  19           1HA      GLY  19   1.117  -1.978  -1.937
  103    HA3  GLY  19           2HA      GLY  19   2.278  -3.136  -1.305
  104    H    ARG  20           H        ARG  20   0.888  -1.082   1.036
  105    HA   ARG  20           HA       ARG  20  -0.344  -3.267   2.381
  106    HB2  ARG  20           1HB      ARG  20  -0.051  -0.344   2.863
  107    HB3  ARG  20           2HB      ARG  20  -1.329  -1.186   3.728
  108    HG2  ARG  20           1HG      ARG  20   0.618  -2.863   4.295
  109    HG3  ARG  20           2HG      ARG  20   1.619  -1.447   3.970
  110    HD2  ARG  20           1HD      ARG  20   0.469  -0.176   5.648
  111    HD3  ARG  20           2HD      ARG  20  -0.713  -1.464   5.878
  112    HE   ARG  20           HE       ARG  20   0.752  -2.467   7.304
  113   HH11  ARG  20          1HH1      ARG  20   2.530  -0.303   5.235
  114   HH12  ARG  20          2HH1      ARG  20   4.037  -0.551   6.053
  115   HH21  ARG  20          1HH2      ARG  20   2.731  -2.801   8.389
  116   HH22  ARG  20          2HH2      ARG  20   4.151  -1.972   7.846
  117    H    GLY  21           H        GLY  21  -2.694  -2.626   3.353
  118    HA2  GLY  21           1HA      GLY  21  -4.445  -1.742   1.180
  119    HA3  GLY  21           2HA      GLY  21  -4.652  -3.385   1.769
  120    H    PHE  22           H        PHE  22  -6.430  -0.980   1.825
  121    HA   PHE  22           HA       PHE  22  -7.122  -1.176   4.663
  122    HB2  PHE  22           1HB      PHE  22  -7.005   1.444   3.154
  123    HB3  PHE  22           2HB      PHE  22  -7.539   1.229   4.818
  124    HD1  PHE  22           HD2      PHE  22  -4.609   0.943   2.577
  125    HD2  PHE  22           HD1      PHE  22  -6.005   1.222   6.588
  126    HE1  PHE  22           HE2      PHE  22  -2.298   1.270   3.355
  127    HE2  PHE  22           HE1      PHE  22  -3.697   1.551   7.373
  128    HZ   PHE  22           HZ       PHE  22  -1.839   1.574   5.756
  129    H    THR  23           H        THR  23  -9.348  -0.519   5.116
  130    HA   THR  23           HA       THR  23 -11.118  -1.440   3.027
  131    HB   THR  23           HB       THR  23 -12.147  -0.350   5.613
  132    HG1  THR  23           HG1      THR  23 -10.402  -1.604   6.290
  133   HG21  THR  23          3HG2      THR  23 -12.873  -2.915   4.225
  134   HG22  THR  23          1HG2      THR  23 -13.545  -1.367   3.714
  135   HG23  THR  23          2HG2      THR  23 -13.836  -1.958   5.350
  136    H    LEU  24           H        LEU  24 -11.146   1.443   5.135
  137    HA   LEU  24           HA       LEU  24 -12.922   2.849   3.380
  138    HB2  LEU  24           1HB      LEU  24 -11.371   3.640   5.828
  139    HB3  LEU  24           2HB      LEU  24 -12.345   4.793   4.918
  140    HG   LEU  24           HG       LEU  24 -13.286   3.569   7.054
  141   HD11  LEU  24          1HD1      LEU  24 -15.461   4.068   6.312
  142   HD12  LEU  24          2HD1      LEU  24 -15.040   3.781   4.624
  143   HD13  LEU  24          3HD1      LEU  24 -14.406   5.197   5.463
  144   HD21  LEU  24          3HD2      LEU  24 -14.709   1.633   6.284
  145   HD22  LEU  24          1HD2      LEU  24 -12.979   1.311   6.412
  146   HD23  LEU  24          2HD2      LEU  24 -13.710   1.586   4.830
  147    H    LYS  25           H        LYS  25 -12.485   4.534   2.001
  148    HA   LYS  25           HA       LYS  25 -10.031   4.531   0.646
  149    HB2  LYS  25           1HB      LYS  25 -12.013   5.258  -0.492
  150    HB3  LYS  25           2HB      LYS  25 -12.284   6.540   0.681
  151    HG2  LYS  25           1HG      LYS  25 -11.432   7.580  -1.251
  152    HG3  LYS  25           2HG      LYS  25 -10.103   7.545  -0.089
  153    HD2  LYS  25           1HD      LYS  25  -9.504   5.298  -1.277
  154    HD3  LYS  25           2HD      LYS  25 -10.483   5.954  -2.591
  155    HE2  LYS  25           1HE      LYS  25  -8.448   6.783  -3.197
  156    HE3  LYS  25           2HE      LYS  25  -8.987   8.092  -2.146
  157    HZ1  LYS  25           3HZ      LYS  25  -7.745   7.047  -0.324
  158    HZ2  LYS  25           1HZ      LYS  25  -6.738   7.483  -1.612
  159    HZ3  LYS  25           2HZ      LYS  25  -7.174   5.865  -1.391
  160    H    SER  26           H        SER  26 -11.300   6.650   3.169
  161    HA   SER  26           HA       SER  26  -9.252   8.576   3.103
  162    HB2  SER  26           1HB      SER  26 -11.138   7.693   5.288
  163    HB3  SER  26           2HB      SER  26  -9.981   9.005   5.513
  164    HG   SER  26           HG       SER  26 -11.801   8.965   3.350
  165    H    HIS  27           H        HIS  27  -9.596   5.570   4.939
  166    HA   HIS  27           HA       HIS  27  -7.474   5.728   6.665
  167    HB2  HIS  27           1HB      HIS  27  -8.453   3.329   5.107
  168    HB3  HIS  27           2HB      HIS  27  -7.317   3.231   6.449
  169    HD1  HIS  27           HD1      HIS  27  -9.585   1.652   7.117
  170    HD2  HIS  27           HD2      HIS  27  -9.777   5.781   7.541
  171    HE1  HIS  27           HE1      HIS  27 -11.464   2.075   8.733
  172    H    LEU  28           H        LEU  28  -7.261   4.100   3.495
  173    HA   LEU  28           HA       LEU  28  -4.512   3.819   3.419
  174    HB2  LEU  28           1HB      LEU  28  -5.664   2.643   1.793
  175    HB3  LEU  28           2HB      LEU  28  -6.613   4.047   1.308
  176    HG   LEU  28           HG       LEU  28  -4.486   4.991   0.322
  177   HD11  LEU  28          1HD1      LEU  28  -2.968   3.500   1.612
  178   HD12  LEU  28          2HD1      LEU  28  -2.660   3.510  -0.124
  179   HD13  LEU  28          3HD1      LEU  28  -3.514   2.154   0.611
  180   HD21  LEU  28          3HD2      LEU  28  -5.272   2.381  -0.936
  181   HD22  LEU  28          1HD2      LEU  28  -4.807   3.890  -1.720
  182   HD23  LEU  28          2HD2      LEU  28  -6.365   3.766  -0.901
  183    H    ASN  29           H        ASN  29  -6.473   6.480   2.100
  184    HA   ASN  29           HA       ASN  29  -4.489   8.019   0.975
  185    HB2  ASN  29           1HB      ASN  29  -6.952   8.481   0.893
  186    HB3  ASN  29           2HB      ASN  29  -6.838   9.114   2.533
  187   HD21  ASN  29          1HD2      ASN  29  -7.821  10.794   0.788
  188   HD22  ASN  29          2HD2      ASN  29  -6.675  12.002   0.324
  189    H    GLN  30           H        GLN  30  -5.616   8.096   4.347
  190    HA   GLN  30           HA       GLN  30  -3.784  10.080   5.194
  191    HB2  GLN  30           1HB      GLN  30  -5.540   8.094   6.579
  192    HB3  GLN  30           2HB      GLN  30  -4.319   8.953   7.509
  193    HG2  GLN  30           1HG      GLN  30  -6.220  10.463   5.772
  194    HG3  GLN  30           2HG      GLN  30  -6.723   9.894   7.363
  195   HE21  GLN  30          1HE2      GLN  30  -5.774  10.769   9.200
  196   HE22  GLN  30          2HE2      GLN  30  -4.869  12.240   9.157
  197    H    HIS  31           H        HIS  31  -3.604   6.601   4.920
  198    HA   HIS  31           HA       HIS  31  -1.269   6.254   6.503
  199    HB2  HIS  31           1HB      HIS  31  -2.362   4.250   6.244
  200    HB3  HIS  31           2HB      HIS  31  -2.814   4.588   4.576
  201    HD1  HIS  31           HD1      HIS  31  -0.022   3.209   6.654
  202    HD2  HIS  31           HD2      HIS  31  -0.974   3.761   2.648
  203    HE1  HIS  31           HE1      HIS  31   1.682   1.880   5.369
  204    H    GLN  32           H        GLN  32  -1.845   6.907   3.097
  205    HA   GLN  32           HA       GLN  32   0.725   6.408   2.113
  206    HB2  GLN  32           1HB      GLN  32  -1.432   8.311   1.208
  207    HB3  GLN  32           2HB      GLN  32   0.073   8.095   0.324
  208    HG2  GLN  32           1HG      GLN  32  -0.517   5.608   0.295
  209    HG3  GLN  32           2HG      GLN  32  -2.134   6.122   0.776
  210   HE21  GLN  32          1HE2      GLN  32  -2.933   5.275  -1.187
  211   HE22  GLN  32          2HE2      GLN  32  -2.746   6.139  -2.672
  212    H    ARG  33           H        ARG  33  -0.282   8.727   4.321
  213    HA   ARG  33           HA       ARG  33   1.400  10.898   3.625
  214    HB2  ARG  33           1HB      ARG  33   0.148  10.081   6.248
  215    HB3  ARG  33           2HB      ARG  33   1.057  11.571   6.033
  216    HG2  ARG  33           1HG      ARG  33  -0.546  12.274   4.305
  217    HG3  ARG  33           2HG      ARG  33  -1.475  10.802   4.597
  218    HD2  ARG  33           1HD      ARG  33  -2.581  12.387   5.885
  219    HD3  ARG  33           2HD      ARG  33  -1.526  11.590   7.051
  220    HE   ARG  33           HE       ARG  33  -0.353  13.922   5.858
  221   HH11  ARG  33          1HH1      ARG  33  -2.430  12.752   8.396
  222   HH12  ARG  33          2HH1      ARG  33  -2.157  14.117   9.427
  223   HH21  ARG  33          1HH2      ARG  33   0.014  15.725   7.207
  224   HH22  ARG  33          2HH2      ARG  33  -0.768  15.808   8.749
  225    H    ILE  34           H        ILE  34   2.013   7.845   5.030
  226    HA   ILE  34           HA       ILE  34   4.387   8.590   6.466
  227    HB   ILE  34           HB       ILE  34   4.688   6.294   6.939
  228   HG12  ILE  34          1HG1      ILE  34   2.737   5.700   4.703
  229   HG13  ILE  34          2HG1      ILE  34   4.478   5.450   4.638
  230   HG21  ILE  34          1HG2      ILE  34   1.979   5.713   7.111
  231   HG22  ILE  34          2HG2      ILE  34   2.965   6.525   8.327
  232   HG23  ILE  34          3HG2      ILE  34   2.057   7.474   7.150
  233   HD11  ILE  34          3HD1      ILE  34   2.387   3.899   6.060
  234   HD12  ILE  34          1HD1      ILE  34   3.770   3.341   5.120
  235   HD13  ILE  34          2HD1      ILE  34   4.007   3.966   6.752
  236    H    HIS  35           H        HIS  35   3.674   8.206   3.220
  237    HA   HIS  35           HA       HIS  35   6.467   7.538   2.563
  238    HB2  HIS  35           1HB      HIS  35   4.086   7.378   0.710
  239    HB3  HIS  35           2HB      HIS  35   5.705   6.749   0.424
  240    HD1  HIS  35           HD1      HIS  35   6.396   4.877   2.425
  241    HD2  HIS  35           HD2      HIS  35   2.388   5.436   1.483
  242    HE1  HIS  35           HE1      HIS  35   5.218   2.809   3.240
  243    H    THR  36           H        THR  36   3.893   9.852   2.159
  244    HA   THR  36           HA       THR  36   4.775  11.389   0.053
  245    HB   THR  36           HB       THR  36   3.720  13.343   1.224
  246    HG1  THR  36           HG1      THR  36   3.828  11.513   3.324
  247   HG21  THR  36          3HG2      THR  36   2.131  12.315  -0.046
  248   HG22  THR  36          1HG2      THR  36   1.446  11.984   1.544
  249   HG23  THR  36          2HG2      THR  36   2.384  10.743   0.712
  250    H    GLY  37           H        GLY  37   6.474  12.668  -0.331
  251    HA2  GLY  37           1HA      GLY  37   8.672  12.775   1.429
  252    HA3  GLY  37           2HA      GLY  37   8.476  13.747  -0.022
  253    H    GLU  38           H        GLU  38   9.305  14.184   2.949
  254    HA   GLU  38           HA       GLU  38   7.628  16.571   3.363
  255    HB2  GLU  38           1HB      GLU  38   7.725  14.563   5.093
  256    HB3  GLU  38           2HB      GLU  38   9.194  15.383   5.606
  257    HG2  GLU  38           1HG      GLU  38   6.383  16.431   5.619
  258    HG3  GLU  38           2HG      GLU  38   7.467  16.184   6.988
  259    H    LYS  39           H        LYS  39   8.986  17.862   2.062
  260    HA   LYS  39           HA       LYS  39  10.889  19.030   1.484
  261    HB2  LYS  39           1HB      LYS  39  11.561  20.572   3.251
  262    HB3  LYS  39           2HB      LYS  39   9.812  20.391   3.222
  263    HG2  LYS  39           1HG      LYS  39   9.759  19.252   5.216
  264    HG3  LYS  39           2HG      LYS  39  11.422  18.684   5.060
  265    HD2  LYS  39           1HD      LYS  39  12.313  20.721   5.746
  266    HD3  LYS  39           2HD      LYS  39  10.831  21.605   5.372
  267    HE2  LYS  39           1HE      LYS  39  10.871  21.486   7.710
  268    HE3  LYS  39           2HE      LYS  39   9.748  20.217   7.223
  269    HZ1  LYS  39           3HZ      LYS  39  12.577  19.867   8.052
  270    HZ2  LYS  39           1HZ      LYS  39  11.610  18.626   7.429
  271    HZ3  LYS  39           2HZ      LYS  39  11.200  19.363   8.895
  272    HA   PRO  40           HA       PRO  40  13.799  15.775   3.320
  273    HB2  PRO  40           1HB      PRO  40  14.176  14.341   1.046
  274    HB3  PRO  40           2HB      PRO  40  12.892  13.981   2.207
  275    HG2  PRO  40           1HG      PRO  40  12.745  15.491  -0.374
  276    HG3  PRO  40           2HG      PRO  40  11.625  14.282   0.280
  277    HD2  PRO  40           1HD      PRO  40  11.143  16.942   0.425
  278    HD3  PRO  40           2HD      PRO  40  10.596  15.804   1.672
  279    H    SER  41           H        SER  41  15.972  15.100   2.149
  280    HA   SER  41           HA       SER  41  17.086  17.583   1.041
  281    HB2  SER  41           1HB      SER  41  18.104  16.777   3.139
  282    HB3  SER  41           2HB      SER  41  18.511  15.253   2.351
  283    HG   SER  41           HG       SER  41  19.622  16.768   0.771
  284    H    GLY  42           H        GLY  42  16.895  17.463  -1.131
  285    HA2  GLY  42           1HA      GLY  42  17.735  16.864  -3.224
  286    HA3  GLY  42           2HA      GLY  42  18.490  15.456  -2.491
  287    HA   PRO  43           HA       PRO  43  13.841  14.379  -3.421
  288    HB2  PRO  43           1HB      PRO  43  12.641  15.985  -5.251
  289    HB3  PRO  43           2HB      PRO  43  12.565  16.288  -3.511
  290    HG2  PRO  43           1HG      PRO  43  14.340  17.533  -5.575
  291    HG3  PRO  43           2HG      PRO  43  13.472  18.303  -4.234
  292    HD2  PRO  43           1HD      PRO  43  16.113  17.718  -4.115
  293    HD3  PRO  43           2HD      PRO  43  15.063  17.686  -2.684
  294    H    SER  44           H        SER  44  15.446  16.023  -6.152
  295    HA   SER  44           HA       SER  44  15.735  15.347  -8.331
  296    HB2  SER  44           1HB      SER  44  17.537  14.212  -6.837
  297    HB3  SER  44           2HB      SER  44  16.639  12.729  -7.160
  298    HG   SER  44           HG       SER  44  17.424  14.426  -9.268
  299    H    SER  45           H        SER  45  13.092  15.018  -7.691
  300    HA   SER  45           HA       SER  45  12.198  12.354  -8.284
  301    HB2  SER  45           1HB      SER  45  10.993  14.208  -6.904
  302    HB3  SER  45           2HB      SER  45  10.444  14.786  -8.477
  303    HG   SER  45           HG       SER  45   9.732  12.515  -8.787
  304    H    GLY  46           H        GLY  46  11.953  15.468 -10.014
  305    HA2  GLY  46           1HA      GLY  46  12.570  15.579 -12.360
  306    HA3  GLY  46           2HA      GLY  46  11.974  13.935 -12.536
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1  18.621 -16.704  -7.449
    2    HA2  GLY   1           1HA      GLY   1  16.728 -15.205  -7.240
    3    HA3  GLY   1           2HA      GLY   1  16.099 -16.821  -7.523
    4    H    SER   2           H        SER   2  15.702 -14.165  -5.679
    5    HA   SER   2           HA       SER   2  14.450 -15.727  -3.527
    6    HB2  SER   2           1HB      SER   2  16.248 -13.322  -3.226
    7    HB3  SER   2           2HB      SER   2  15.125 -13.823  -1.962
    8    HG   SER   2           HG       SER   2  16.588 -15.205  -1.395
    9    H    SER   3           H        SER   3  12.513 -14.950  -2.771
   10    HA   SER   3           HA       SER   3  11.530 -12.346  -3.466
   11    HB2  SER   3           1HB      SER   3  10.620 -14.771  -4.982
   12    HB3  SER   3           2HB      SER   3   9.492 -13.449  -4.682
   13    HG   SER   3           HG       SER   3  11.965 -12.673  -5.619
   14    H    GLY   4           H        GLY   4   9.346 -11.963  -2.619
   15    HA2  GLY   4           1HA      GLY   4   8.031 -13.896  -0.999
   16    HA3  GLY   4           2HA      GLY   4   9.023 -12.834  -0.010
   17    H    SER   5           H        SER   5   6.168 -13.110  -1.953
   18    HA   SER   5           HA       SER   5   5.363 -10.527  -2.344
   19    HB2  SER   5           1HB      SER   5   4.158 -12.807  -2.829
   20    HB3  SER   5           2HB      SER   5   3.364 -12.496  -1.285
   21    HG   SER   5           HG       SER   5   3.462 -10.466  -3.219
   22    H    SER   6           H        SER   6   4.813  -8.843  -1.116
   23    HA   SER   6           HA       SER   6   5.128  -8.968   1.715
   24    HB2  SER   6           1HB      SER   6   4.452  -6.564   1.642
   25    HB3  SER   6           2HB      SER   6   5.766  -6.952   0.532
   26    HG   SER   6           HG       SER   6   4.222  -7.033  -1.148
   27    H    GLY   7           H        GLY   7   3.555 -10.467   2.412
   28    HA2  GLY   7           1HA      GLY   7   1.550 -10.950   3.436
   29    HA3  GLY   7           2HA      GLY   7   1.064  -9.287   3.140
   30    H    SER   8           H        SER   8  -0.083 -12.171   2.726
   31    HA   SER   8           HA       SER   8  -0.841 -11.913  -0.092
   32    HB2  SER   8           1HB      SER   8  -1.316 -14.187   1.850
   33    HB3  SER   8           2HB      SER   8  -1.717 -14.202   0.133
   34    HG   SER   8           HG       SER   8   0.672 -14.635   1.360
   35    H    SER   9           H        SER   9  -2.256 -10.128   0.196
   36    HA   SER   9           HA       SER   9  -4.958 -10.842   0.593
   37    HB2  SER   9           1HB      SER   9  -4.608 -10.792   2.934
   38    HB3  SER   9           2HB      SER   9  -3.601  -9.347   2.834
   39    HG   SER   9           HG       SER   9  -6.212  -9.139   1.896
   40    H    THR  10           H        THR  10  -6.055  -9.587  -0.751
   41    HA   THR  10           HA       THR  10  -4.938  -6.953  -1.442
   42    HB   THR  10           HB       THR  10  -5.110  -8.487  -3.341
   43    HG1  THR  10           HG1      THR  10  -6.530  -7.083  -4.634
   44   HG21  THR  10          3HG2      THR  10  -7.510  -9.270  -2.132
   45   HG22  THR  10          1HG2      THR  10  -6.852  -9.843  -3.664
   46   HG23  THR  10          2HG2      THR  10  -7.978  -8.486  -3.641
   47    H    LYS  11           H        LYS  11  -6.067  -5.147  -1.054
   48    HA   LYS  11           HA       LYS  11  -8.845  -5.443  -0.114
   49    HB2  LYS  11           1HB      LYS  11  -6.870  -4.598   1.443
   50    HB3  LYS  11           2HB      LYS  11  -7.204  -3.068   0.642
   51    HG2  LYS  11           1HG      LYS  11  -8.612  -2.842   2.394
   52    HG3  LYS  11           2HG      LYS  11  -9.696  -3.717   1.310
   53    HD2  LYS  11           1HD      LYS  11  -7.926  -5.315   3.081
   54    HD3  LYS  11           2HD      LYS  11  -9.290  -4.476   3.825
   55    HE2  LYS  11           1HE      LYS  11  -9.432  -6.416   1.518
   56    HE3  LYS  11           2HE      LYS  11  -9.897  -6.751   3.186
   57    HZ1  LYS  11           3HZ      LYS  11 -11.878  -5.846   2.843
   58    HZ2  LYS  11           1HZ      LYS  11 -11.511  -5.762   1.194
   59    HZ3  LYS  11           2HZ      LYS  11 -11.212  -4.432   2.195
   60    H    SER  12           H        SER  12 -10.300  -3.681  -0.578
   61    HA   SER  12           HA       SER  12 -10.604  -2.964  -3.145
   62    HB2  SER  12           1HB      SER  12 -11.229  -1.163  -0.792
   63    HB3  SER  12           2HB      SER  12 -11.936  -1.028  -2.401
   64    HG   SER  12           HG       SER  12 -12.391  -2.923  -0.401
   65    H    HIS  13           H        HIS  13  -9.035  -0.801  -0.778
   66    HA   HIS  13           HA       HIS  13  -7.670   0.522  -3.026
   67    HB2  HIS  13           1HB      HIS  13  -7.845   1.691  -0.267
   68    HB3  HIS  13           2HB      HIS  13  -7.642   2.516  -1.810
   69    HD1  HIS  13           HD1      HIS  13  -9.825   2.674  -3.330
   70    HD2  HIS  13           HD2      HIS  13 -10.438   1.434   0.587
   71    HE1  HIS  13           HE1      HIS  13 -12.291   2.941  -2.919
   72    H    GLN  14           H        GLN  14  -5.778  -0.527  -3.289
   73    HA   GLN  14           HA       GLN  14  -4.166  -1.149  -0.920
   74    HB2  GLN  14           1HB      GLN  14  -4.688  -2.856  -2.786
   75    HB3  GLN  14           2HB      GLN  14  -3.502  -1.969  -3.735
   76    HG2  GLN  14           1HG      GLN  14  -2.165  -3.574  -2.847
   77    HG3  GLN  14           2HG      GLN  14  -2.013  -2.339  -1.599
   78   HE21  GLN  14          1HE2      GLN  14  -1.566  -5.117  -1.257
   79   HE22  GLN  14          2HE2      GLN  14  -2.724  -5.698  -0.115
   80    H    CYS  15           H        CYS  15  -2.269  -0.167  -0.496
   81    HA   CYS  15           HA       CYS  15  -1.665   2.301  -1.728
   82    HB2  CYS  15           1HB      CYS  15  -1.115   1.680   0.638
   83    HB3  CYS  15           2HB      CYS  15   0.160   0.637   0.016
   84    H    HIS  16           H        HIS  16   0.485   2.852  -2.664
   85    HA   HIS  16           HA       HIS  16   1.349   0.733  -4.517
   86    HB2  HIS  16           1HB      HIS  16   0.922   3.659  -4.846
   87    HB3  HIS  16           2HB      HIS  16   2.245   2.928  -5.750
   88    HD1  HIS  16           HD1      HIS  16   1.563   1.028  -7.474
   89    HD2  HIS  16           HD2      HIS  16  -1.591   3.197  -5.859
   90    HE1  HIS  16           HE1      HIS  16  -0.410   0.551  -8.957
   91    H    GLU  17           H        GLU  17   2.344   2.968  -2.086
   92    HA   GLU  17           HA       GLU  17   5.139   2.920  -2.706
   93    HB2  GLU  17           1HB      GLU  17   3.902   3.605  -0.042
   94    HB3  GLU  17           2HB      GLU  17   5.453   4.137  -0.678
   95    HG2  GLU  17           1HG      GLU  17   2.776   4.894  -1.826
   96    HG3  GLU  17           2HG      GLU  17   3.720   5.889  -0.719
   97    H    CYS  18           H        CYS  18   3.035   1.201  -0.444
   98    HA   CYS  18           HA       CYS  18   5.259  -0.661   0.086
   99    HB2  CYS  18           1HB      CYS  18   4.255  -1.080   2.298
  100    HB3  CYS  18           2HB      CYS  18   4.710   0.609   2.098
  101    H    GLY  19           H        GLY  19   1.784  -0.291  -0.402
  102    HA2  GLY  19           1HA      GLY  19   0.565  -1.828  -1.770
  103    HA3  GLY  19           2HA      GLY  19   1.702  -3.087  -1.309
  104    H    ARG  20           H        ARG  20   0.471  -0.973   1.136
  105    HA   ARG  20           HA       ARG  20  -0.622  -3.147   2.609
  106    HB2  ARG  20           1HB      ARG  20  -0.386  -0.206   2.984
  107    HB3  ARG  20           2HB      ARG  20  -1.607  -1.045   3.932
  108    HG2  ARG  20           1HG      ARG  20   0.412  -2.662   4.454
  109    HG3  ARG  20           2HG      ARG  20   1.351  -1.220   4.063
  110    HD2  ARG  20           1HD      ARG  20   0.376   0.019   5.801
  111    HD3  ARG  20           2HD      ARG  20  -0.946  -1.132   5.993
  112    HE   ARG  20           HE       ARG  20   0.409  -2.433   7.320
  113   HH11  ARG  20          1HH1      ARG  20   2.312   0.016   5.738
  114   HH12  ARG  20          2HH1      ARG  20   3.731  -0.292   6.682
  115   HH21  ARG  20          1HH2      ARG  20   2.271  -2.848   8.569
  116   HH22  ARG  20          2HH2      ARG  20   3.708  -1.922   8.292
  117    H    GLY  21           H        GLY  21  -2.853  -3.274   3.391
  118    HA2  GLY  21           1HA      GLY  21  -4.749  -2.437   1.286
  119    HA3  GLY  21           2HA      GLY  21  -4.906  -3.912   2.227
  120    H    PHE  22           H        PHE  22  -6.283  -1.042   1.817
  121    HA   PHE  22           HA       PHE  22  -7.073  -0.839   4.647
  122    HB2  PHE  22           1HB      PHE  22  -6.730   1.419   2.664
  123    HB3  PHE  22           2HB      PHE  22  -7.404   1.596   4.281
  124    HD1  PHE  22           HD1      PHE  22  -5.978   1.331   6.255
  125    HD2  PHE  22           HD2      PHE  22  -4.382   1.190   2.312
  126    HE1  PHE  22           HE1      PHE  22  -3.716   1.669   7.163
  127    HE2  PHE  22           HE2      PHE  22  -2.118   1.527   3.213
  128    HZ   PHE  22           HZ       PHE  22  -1.782   1.766   5.641
  129    H    THR  23           H        THR  23  -9.176  -1.077   5.027
  130    HA   THR  23           HA       THR  23 -10.998  -1.711   2.966
  131    HB   THR  23           HB       THR  23 -11.572  -0.971   5.842
  132    HG1  THR  23           HG1      THR  23 -11.456  -3.565   4.685
  133   HG21  THR  23          3HG2      THR  23 -13.389  -2.771   4.392
  134   HG22  THR  23          1HG2      THR  23 -13.403  -1.098   3.837
  135   HG23  THR  23          2HG2      THR  23 -13.749  -1.470   5.526
  136    H    LEU  24           H        LEU  24 -10.677   1.172   5.023
  137    HA   LEU  24           HA       LEU  24 -12.658   2.563   3.386
  138    HB2  LEU  24           1HB      LEU  24 -11.339   3.158   6.013
  139    HB3  LEU  24           2HB      LEU  24 -12.222   4.401   5.129
  140    HG   LEU  24           HG       LEU  24 -13.449   1.793   6.011
  141   HD11  LEU  24          1HD1      LEU  24 -12.565   3.490   7.813
  142   HD12  LEU  24          2HD1      LEU  24 -14.147   2.729   7.978
  143   HD13  LEU  24          3HD1      LEU  24 -14.022   4.379   7.368
  144   HD21  LEU  24          3HD2      LEU  24 -15.076   2.455   4.645
  145   HD22  LEU  24          1HD2      LEU  24 -14.319   4.028   4.389
  146   HD23  LEU  24          2HD2      LEU  24 -15.376   3.774   5.778
  147    H    LYS  25           H        LYS  25 -12.095   3.898   1.806
  148    HA   LYS  25           HA       LYS  25  -9.585   4.261   0.803
  149    HB2  LYS  25           1HB      LYS  25 -11.500   4.911  -0.484
  150    HB3  LYS  25           2HB      LYS  25 -11.955   6.129   0.700
  151    HG2  LYS  25           1HG      LYS  25 -11.008   7.307  -1.094
  152    HG3  LYS  25           2HG      LYS  25  -9.767   7.279   0.160
  153    HD2  LYS  25           1HD      LYS  25  -8.528   6.706  -1.689
  154    HD3  LYS  25           2HD      LYS  25  -8.988   5.110  -1.092
  155    HE2  LYS  25           1HE      LYS  25 -10.637   4.850  -2.740
  156    HE3  LYS  25           2HE      LYS  25 -10.646   6.570  -3.126
  157    HZ1  LYS  25           3HZ      LYS  25  -9.438   5.728  -4.857
  158    HZ2  LYS  25           1HZ      LYS  25  -8.736   4.494  -3.936
  159    HZ3  LYS  25           2HZ      LYS  25  -8.185   6.085  -3.778
  160    H    SER  26           H        SER  26 -11.251   6.403   3.097
  161    HA   SER  26           HA       SER  26  -9.428   8.434   3.328
  162    HB2  SER  26           1HB      SER  26 -10.235   8.707   5.667
  163    HB3  SER  26           2HB      SER  26 -11.550   8.479   4.514
  164    HG   SER  26           HG       SER  26 -12.108   6.980   5.895
  165    H    HIS  27           H        HIS  27  -9.366   5.304   4.995
  166    HA   HIS  27           HA       HIS  27  -7.178   5.706   6.645
  167    HB2  HIS  27           1HB      HIS  27  -8.125   3.207   5.237
  168    HB3  HIS  27           2HB      HIS  27  -6.843   3.206   6.444
  169    HD1  HIS  27           HD1      HIS  27  -9.411   1.613   6.932
  170    HD2  HIS  27           HD2      HIS  27  -8.828   5.520   8.222
  171    HE1  HIS  27           HE1      HIS  27 -10.998   1.930   8.857
  172    H    LEU  28           H        LEU  28  -7.106   4.117   3.447
  173    HA   LEU  28           HA       LEU  28  -4.378   3.888   3.164
  174    HB2  LEU  28           1HB      LEU  28  -5.713   2.822   1.567
  175    HB3  LEU  28           2HB      LEU  28  -6.573   4.307   1.166
  176    HG   LEU  28           HG       LEU  28  -4.452   5.149   0.128
  177   HD11  LEU  28          1HD1      LEU  28  -3.219   3.165   1.466
  178   HD12  LEU  28          2HD1      LEU  28  -2.558   3.937   0.026
  179   HD13  LEU  28          3HD1      LEU  28  -3.417   2.403  -0.112
  180   HD21  LEU  28          3HD2      LEU  28  -6.270   4.223  -1.213
  181   HD22  LEU  28          1HD2      LEU  28  -5.605   2.603  -1.006
  182   HD23  LEU  28          2HD2      LEU  28  -4.699   3.820  -1.906
  183    H    ASN  29           H        ASN  29  -6.432   6.657   2.348
  184    HA   ASN  29           HA       ASN  29  -4.513   8.271   1.140
  185    HB2  ASN  29           1HB      ASN  29  -7.095   8.753   2.537
  186    HB3  ASN  29           2HB      ASN  29  -6.044  10.144   2.283
  187   HD21  ASN  29          1HD2      ASN  29  -7.077   7.293   0.431
  188   HD22  ASN  29          2HD2      ASN  29  -7.463   8.162  -1.011
  189    H    GLN  30           H        GLN  30  -5.670   8.614   4.499
  190    HA   GLN  30           HA       GLN  30  -3.628  10.331   5.329
  191    HB2  GLN  30           1HB      GLN  30  -5.535  10.233   6.702
  192    HB3  GLN  30           2HB      GLN  30  -5.474   8.479   6.812
  193    HG2  GLN  30           1HG      GLN  30  -4.818   9.602   8.898
  194    HG3  GLN  30           2HG      GLN  30  -3.544   8.580   8.235
  195   HE21  GLN  30          1HE2      GLN  30  -2.046   9.772   9.496
  196   HE22  GLN  30          2HE2      GLN  30  -1.498  11.327   8.982
  197    H    HIS  31           H        HIS  31  -3.512   7.027   4.607
  198    HA   HIS  31           HA       HIS  31  -1.356   6.353   6.399
  199    HB2  HIS  31           1HB      HIS  31  -2.555   4.449   5.931
  200    HB3  HIS  31           2HB      HIS  31  -2.899   4.942   4.275
  201    HD1  HIS  31           HD1      HIS  31  -0.092   3.499   6.360
  202    HD2  HIS  31           HD2      HIS  31  -1.231   3.880   2.383
  203    HE1  HIS  31           HE1      HIS  31   1.539   2.097   5.057
  204    H    GLN  32           H        GLN  32  -1.712   7.114   2.963
  205    HA   GLN  32           HA       GLN  32   0.907   6.606   2.149
  206    HB2  GLN  32           1HB      GLN  32  -1.292   8.360   1.144
  207    HB3  GLN  32           2HB      GLN  32   0.316   8.546   0.457
  208    HG2  GLN  32           1HG      GLN  32   0.211   5.990   0.116
  209    HG3  GLN  32           2HG      GLN  32  -1.525   6.196   0.341
  210   HE21  GLN  32          1HE2      GLN  32  -1.072   5.214  -1.955
  211   HE22  GLN  32          2HE2      GLN  32  -1.088   6.373  -3.236
  212    H    ARG  33           H        ARG  33  -0.408   9.198   4.016
  213    HA   ARG  33           HA       ARG  33   1.392  11.250   3.572
  214    HB2  ARG  33           1HB      ARG  33   0.344  10.531   6.306
  215    HB3  ARG  33           2HB      ARG  33   0.756  12.126   5.692
  216    HG2  ARG  33           1HG      ARG  33  -1.643  10.443   5.117
  217    HG3  ARG  33           2HG      ARG  33  -1.554  12.125   5.642
  218    HD2  ARG  33           1HD      ARG  33  -0.656  11.133   2.941
  219    HD3  ARG  33           2HD      ARG  33  -2.241  11.833   3.266
  220    HE   ARG  33           HE       ARG  33  -0.243  13.606   4.145
  221   HH11  ARG  33          1HH1      ARG  33  -1.607  12.328   1.208
  222   HH12  ARG  33          2HH1      ARG  33  -1.226  13.731   0.267
  223   HH21  ARG  33          1HH2      ARG  33   0.264  15.459   2.916
  224   HH22  ARG  33          2HH2      ARG  33  -0.160  15.511   1.239
  225    H    ILE  34           H        ILE  34   1.985   8.173   4.883
  226    HA   ILE  34           HA       ILE  34   4.237   8.878   6.515
  227    HB   ILE  34           HB       ILE  34   4.583   6.557   6.841
  228   HG12  ILE  34          1HG1      ILE  34   2.816   6.121   4.424
  229   HG13  ILE  34          2HG1      ILE  34   4.549   5.826   4.518
  230   HG21  ILE  34          1HG2      ILE  34   1.870   7.622   6.914
  231   HG22  ILE  34          2HG2      ILE  34   1.930   5.860   6.878
  232   HG23  ILE  34          3HG2      ILE  34   2.778   6.745   8.146
  233   HD11  ILE  34          3HD1      ILE  34   3.709   3.714   4.766
  234   HD12  ILE  34          1HD1      ILE  34   3.872   4.212   6.450
  235   HD13  ILE  34          2HD1      ILE  34   2.294   4.262   5.664
  236    H    HIS  35           H        HIS  35   3.763   7.679   3.231
  237    HA   HIS  35           HA       HIS  35   6.586   7.421   2.724
  238    HB2  HIS  35           1HB      HIS  35   4.365   7.456   0.679
  239    HB3  HIS  35           2HB      HIS  35   5.968   6.745   0.514
  240    HD1  HIS  35           HD1      HIS  35   6.392   4.694   2.340
  241    HD2  HIS  35           HD2      HIS  35   2.472   5.649   1.347
  242    HE1  HIS  35           HE1      HIS  35   5.026   2.684   2.985
  243    H    THR  36           H        THR  36   4.137   9.854   2.321
  244    HA   THR  36           HA       THR  36   6.085  11.572   0.928
  245    HB   THR  36           HB       THR  36   4.104  11.220  -0.429
  246    HG1  THR  36           HG1      THR  36   3.875  13.817   0.702
  247   HG21  THR  36          3HG2      THR  36   2.503  10.642   1.300
  248   HG22  THR  36          1HG2      THR  36   1.890  11.994   0.350
  249   HG23  THR  36          2HG2      THR  36   2.575  12.279   1.950
  250    H    GLY  37           H        GLY  37   6.136  11.214   3.746
  251    HA2  GLY  37           1HA      GLY  37   5.586  13.981   4.557
  252    HA3  GLY  37           2HA      GLY  37   4.952  12.675   5.547
  253    H    GLU  38           H        GLU  38   6.168  12.058   7.202
  254    HA   GLU  38           HA       GLU  38   8.728  13.190   7.661
  255    HB2  GLU  38           1HB      GLU  38   6.976  12.405   9.380
  256    HB3  GLU  38           2HB      GLU  38   7.641  10.798   9.127
  257    HG2  GLU  38           1HG      GLU  38   9.512  13.014   9.766
  258    HG3  GLU  38           2HG      GLU  38   8.503  12.361  11.055
  259    H    LYS  39           H        LYS  39  10.713  11.980   8.069
  260    HA   LYS  39           HA       LYS  39  12.415  10.812   7.041
  261    HB2  LYS  39           1HB      LYS  39  12.210   8.394   7.444
  262    HB3  LYS  39           2HB      LYS  39  11.688   9.333   8.836
  263    HG2  LYS  39           1HG      LYS  39   9.454   8.810   8.515
  264    HG3  LYS  39           2HG      LYS  39   9.697   8.374   6.822
  265    HD2  LYS  39           1HD      LYS  39  10.593   6.304   7.351
  266    HD3  LYS  39           2HD      LYS  39  11.050   6.805   8.980
  267    HE2  LYS  39           1HE      LYS  39   8.598   6.959   9.507
  268    HE3  LYS  39           2HE      LYS  39   8.285   6.208   7.944
  269    HZ1  LYS  39           3HZ      LYS  39  10.182   4.642   9.229
  270    HZ2  LYS  39           1HZ      LYS  39   8.566   4.253   8.913
  271    HZ3  LYS  39           2HZ      LYS  39   8.989   4.979  10.381
  272    HA   PRO  40           HA       PRO  40   9.989  10.207   3.029
  273    HB2  PRO  40           1HB      PRO  40  11.002  12.356   1.713
  274    HB3  PRO  40           2HB      PRO  40   9.537  12.436   2.700
  275    HG2  PRO  40           1HG      PRO  40  12.336  13.241   3.394
  276    HG3  PRO  40           2HG      PRO  40  10.813  14.084   3.733
  277    HD2  PRO  40           1HD      PRO  40  12.103  12.603   5.596
  278    HD3  PRO  40           2HD      PRO  40  10.335  12.753   5.553
  279    H    SER  41           H        SER  41  11.107  10.310   0.742
  280    HA   SER  41           HA       SER  41  13.475   8.683   0.957
  281    HB2  SER  41           1HB      SER  41  11.922   9.660  -1.450
  282    HB3  SER  41           2HB      SER  41  13.282   8.540  -1.529
  283    HG   SER  41           HG       SER  41  11.589   7.210  -1.407
  284    H    GLY  42           H        GLY  42  15.374   9.103  -0.481
  285    HA2  GLY  42           1HA      GLY  42  15.979  11.995  -0.568
  286    HA3  GLY  42           2HA      GLY  42  17.151  10.801  -0.029
  287    HA   PRO  43           HA       PRO  43  16.593  10.129  -4.795
  288    HB2  PRO  43           1HB      PRO  43  15.215  12.054  -6.124
  289    HB3  PRO  43           2HB      PRO  43  14.444  10.615  -5.446
  290    HG2  PRO  43           1HG      PRO  43  14.592  13.388  -4.329
  291    HG3  PRO  43           2HG      PRO  43  13.213  12.275  -4.379
  292    HD2  PRO  43           1HD      PRO  43  14.712  12.636  -2.154
  293    HD3  PRO  43           2HD      PRO  43  13.946  11.084  -2.547
  294    H    SER  44           H        SER  44  18.328  10.661  -5.978
  295    HA   SER  44           HA       SER  44  19.158  13.440  -6.218
  296    HB2  SER  44           1HB      SER  44  20.258  12.298  -4.155
  297    HB3  SER  44           2HB      SER  44  21.229  11.439  -5.352
  298    HG   SER  44           HG       SER  44  21.022  14.254  -5.043
  299    H    SER  45           H        SER  45  20.745  13.781  -7.887
  300    HA   SER  45           HA       SER  45  20.256  12.423 -10.241
  301    HB2  SER  45           1HB      SER  45  22.005  13.685 -11.210
  302    HB3  SER  45           2HB      SER  45  21.404  14.694  -9.894
  303    HG   SER  45           HG       SER  45  23.209  13.336  -8.735
  304    H    GLY  46           H        GLY  46  21.532  10.980 -11.511
  305    HA2  GLY  46           1HA      GLY  46  23.776   9.686 -11.284
  306    HA3  GLY  46           2HA      GLY  46  22.993   9.052  -9.844
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1   8.506 -30.351  -7.505
    2    HA2  GLY   1           1HA      GLY   1   8.808 -28.686  -5.892
    3    HA3  GLY   1           2HA      GLY   1   9.600 -27.688  -7.102
    4    H    SER   2           H        SER   2   7.519 -26.974  -5.171
    5    HA   SER   2           HA       SER   2   5.707 -25.697  -7.050
    6    HB2  SER   2           1HB      SER   2   4.410 -27.645  -6.593
    7    HB3  SER   2           2HB      SER   2   4.775 -27.567  -4.869
    8    HG   SER   2           HG       SER   2   2.722 -26.747  -5.202
    9    H    SER   3           H        SER   3   4.890 -23.759  -6.323
   10    HA   SER   3           HA       SER   3   6.190 -22.679  -3.955
   11    HB2  SER   3           1HB      SER   3   5.956 -21.541  -6.307
   12    HB3  SER   3           2HB      SER   3   4.360 -21.083  -5.715
   13    HG   SER   3           HG       SER   3   6.774 -20.574  -4.316
   14    H    GLY   4           H        GLY   4   4.868 -21.159  -2.565
   15    HA2  GLY   4           1HA      GLY   4   2.245 -22.405  -2.017
   16    HA3  GLY   4           2HA      GLY   4   3.316 -21.795  -0.765
   17    H    SER   5           H        SER   5   1.010 -20.962  -3.234
   18    HA   SER   5           HA       SER   5   1.251 -18.146  -3.044
   19    HB2  SER   5           1HB      SER   5   0.128 -19.423  -4.914
   20    HB3  SER   5           2HB      SER   5  -1.234 -19.683  -3.825
   21    HG   SER   5           HG       SER   5  -0.252 -17.084  -4.271
   22    H    SER   6           H        SER   6   1.368 -17.811  -0.756
   23    HA   SER   6           HA       SER   6  -1.236 -18.012   0.609
   24    HB2  SER   6           1HB      SER   6   0.049 -17.959   2.730
   25    HB3  SER   6           2HB      SER   6   0.481 -19.340   1.721
   26    HG   SER   6           HG       SER   6   1.926 -16.902   1.735
   27    H    GLY   7           H        GLY   7  -1.948 -16.019  -0.295
   28    HA2  GLY   7           1HA      GLY   7  -1.500 -13.774   1.335
   29    HA3  GLY   7           2HA      GLY   7  -0.547 -13.591  -0.130
   30    H    SER   8           H        SER   8  -3.738 -15.080   0.230
   31    HA   SER   8           HA       SER   8  -4.744 -13.451  -1.936
   32    HB2  SER   8           1HB      SER   8  -6.221 -15.489  -0.255
   33    HB3  SER   8           2HB      SER   8  -6.733 -14.833  -1.810
   34    HG   SER   8           HG       SER   8  -5.619 -16.369  -2.687
   35    H    SER   9           H        SER   9  -5.798 -11.597  -1.717
   36    HA   SER   9           HA       SER   9  -7.632 -11.074   0.398
   37    HB2  SER   9           1HB      SER   9  -5.395 -10.723   1.528
   38    HB3  SER   9           2HB      SER   9  -5.132  -9.374   0.423
   39    HG   SER   9           HG       SER   9  -6.827  -8.298   1.330
   40    H    THR  10           H        THR  10  -9.175 -10.146  -0.767
   41    HA   THR  10           HA       THR  10  -8.494  -8.407  -3.002
   42    HB   THR  10           HB       THR  10 -10.912  -8.433  -3.500
   43    HG1  THR  10           HG1      THR  10 -10.980  -9.595  -0.979
   44   HG21  THR  10          3HG2      THR  10 -10.522 -11.296  -3.125
   45   HG22  THR  10          1HG2      THR  10  -9.106 -10.497  -3.807
   46   HG23  THR  10          2HG2      THR  10 -10.669 -10.362  -4.613
   47    H    LYS  11           H        LYS  11  -7.686  -6.609  -1.831
   48    HA   LYS  11           HA       LYS  11  -9.546  -5.191  -0.087
   49    HB2  LYS  11           1HB      LYS  11  -6.934  -5.537   0.219
   50    HB3  LYS  11           2HB      LYS  11  -6.859  -4.098  -0.788
   51    HG2  LYS  11           1HG      LYS  11  -6.788  -3.356   1.447
   52    HG3  LYS  11           2HG      LYS  11  -8.414  -2.999   0.859
   53    HD2  LYS  11           1HD      LYS  11  -8.710  -3.915   3.010
   54    HD3  LYS  11           2HD      LYS  11  -9.110  -5.217   1.888
   55    HE2  LYS  11           1HE      LYS  11  -7.750  -6.364   3.310
   56    HE3  LYS  11           2HE      LYS  11  -6.536  -5.762   2.183
   57    HZ1  LYS  11           3HZ      LYS  11  -5.596  -5.126   4.132
   58    HZ2  LYS  11           1HZ      LYS  11  -7.073  -4.960   4.941
   59    HZ3  LYS  11           2HZ      LYS  11  -6.554  -3.757   3.871
   60    H    SER  12           H        SER  12 -10.367  -3.162  -0.512
   61    HA   SER  12           HA       SER  12 -10.819  -2.521  -3.240
   62    HB2  SER  12           1HB      SER  12 -11.510  -1.219  -0.625
   63    HB3  SER  12           2HB      SER  12 -11.775  -0.350  -2.137
   64    HG   SER  12           HG       SER  12 -13.244  -2.312  -1.034
   65    H    HIS  13           H        HIS  13  -9.356  -0.464  -0.719
   66    HA   HIS  13           HA       HIS  13  -7.776   0.852  -2.812
   67    HB2  HIS  13           1HB      HIS  13  -8.004   1.811   0.029
   68    HB3  HIS  13           2HB      HIS  13  -7.634   2.739  -1.421
   69    HD1  HIS  13           HD1      HIS  13  -9.692   3.193  -3.055
   70    HD2  HIS  13           HD2      HIS  13 -10.659   1.700   0.699
   71    HE1  HIS  13           HE1      HIS  13 -12.153   3.626  -2.774
   72    H    GLN  14           H        GLN  14  -5.711   0.331  -3.037
   73    HA   GLN  14           HA       GLN  14  -4.250  -0.684  -0.688
   74    HB2  GLN  14           1HB      GLN  14  -4.830  -2.398  -2.493
   75    HB3  GLN  14           2HB      GLN  14  -3.689  -1.542  -3.521
   76    HG2  GLN  14           1HG      GLN  14  -1.952  -1.929  -1.761
   77    HG3  GLN  14           2HG      GLN  14  -3.114  -2.969  -0.940
   78   HE21  GLN  14          1HE2      GLN  14  -0.957  -4.241  -1.477
   79   HE22  GLN  14          2HE2      GLN  14  -1.074  -5.241  -2.881
   80    H    CYS  15           H        CYS  15  -2.120  -0.038  -0.437
   81    HA   CYS  15           HA       CYS  15  -1.452   2.488  -1.604
   82    HB2  CYS  15           1HB      CYS  15  -0.916   1.666   0.771
   83    HB3  CYS  15           2HB      CYS  15   0.411   0.776   0.031
   84    H    HIS  16           H        HIS  16   0.656   2.928  -2.625
   85    HA   HIS  16           HA       HIS  16   1.438   0.722  -4.415
   86    HB2  HIS  16           1HB      HIS  16   0.502   2.337  -5.820
   87    HB3  HIS  16           2HB      HIS  16   1.159   3.675  -4.882
   88    HD1  HIS  16           HD1      HIS  16   3.077   4.795  -5.952
   89    HD2  HIS  16           HD2      HIS  16   2.756   0.827  -7.140
   90    HE1  HIS  16           HE1      HIS  16   4.907   4.450  -7.642
   91    H    GLU  17           H        GLU  17   2.483   2.912  -2.021
   92    HA   GLU  17           HA       GLU  17   5.267   2.902  -2.762
   93    HB2  GLU  17           1HB      GLU  17   4.113   3.684  -0.088
   94    HB3  GLU  17           2HB      GLU  17   5.639   4.196  -0.795
   95    HG2  GLU  17           1HG      GLU  17   2.926   4.902  -1.885
   96    HG3  GLU  17           2HG      GLU  17   3.895   5.939  -0.840
   97    H    CYS  18           H        CYS  18   3.226   1.261  -0.390
   98    HA   CYS  18           HA       CYS  18   5.476  -0.556   0.179
   99    HB2  CYS  18           1HB      CYS  18   4.527  -0.914   2.402
  100    HB3  CYS  18           2HB      CYS  18   4.848   0.797   2.139
  101    H    GLY  19           H        GLY  19   2.021  -0.258  -0.412
  102    HA2  GLY  19           1HA      GLY  19   0.852  -1.869  -1.733
  103    HA3  GLY  19           2HA      GLY  19   1.991  -3.092  -1.190
  104    H    ARG  20           H        ARG  20   0.617  -0.866   1.091
  105    HA   ARG  20           HA       ARG  20  -0.514  -3.024   2.602
  106    HB2  ARG  20           1HB      ARG  20  -0.157  -0.098   2.967
  107    HB3  ARG  20           2HB      ARG  20  -1.450  -0.861   3.881
  108    HG2  ARG  20           1HG      ARG  20   0.441  -2.575   4.505
  109    HG3  ARG  20           2HG      ARG  20   1.492  -1.218   4.093
  110    HD2  ARG  20           1HD      ARG  20   1.122  -0.969   6.383
  111    HD3  ARG  20           2HD      ARG  20  -0.009   0.163   5.644
  112    HE   ARG  20           HE       ARG  20  -1.428  -2.158   5.952
  113   HH11  ARG  20          1HH1      ARG  20   0.334  -0.019   8.058
  114   HH12  ARG  20          2HH1      ARG  20  -0.660  -0.347   9.439
  115   HH21  ARG  20          1HH2      ARG  20  -2.744  -2.600   7.763
  116   HH22  ARG  20          2HH2      ARG  20  -2.409  -1.816   9.270
  117    H    GLY  21           H        GLY  21  -2.779  -2.940   3.421
  118    HA2  GLY  21           1HA      GLY  21  -4.612  -2.027   1.289
  119    HA3  GLY  21           2HA      GLY  21  -4.815  -3.557   2.130
  120    H    PHE  22           H        PHE  22  -6.531  -1.093   1.859
  121    HA   PHE  22           HA       PHE  22  -7.219  -0.916   4.693
  122    HB2  PHE  22           1HB      PHE  22  -6.937   1.528   2.932
  123    HB3  PHE  22           2HB      PHE  22  -7.458   1.510   4.613
  124    HD1  PHE  22           HD2      PHE  22  -4.597   0.996   2.355
  125    HD2  PHE  22           HD1      PHE  22  -5.891   1.394   6.391
  126    HE1  PHE  22           HE2      PHE  22  -2.259   1.244   3.077
  127    HE2  PHE  22           HE1      PHE  22  -3.554   1.643   7.119
  128    HZ   PHE  22           HZ       PHE  22  -1.734   1.567   5.461
  129    H    THR  23           H        THR  23  -9.321  -1.243   4.971
  130    HA   THR  23           HA       THR  23 -11.094  -1.719   2.857
  131    HB   THR  23           HB       THR  23 -11.881  -0.986   5.682
  132    HG1  THR  23           HG1      THR  23 -10.943  -3.417   4.556
  133   HG21  THR  23          3HG2      THR  23 -13.265  -2.225   3.357
  134   HG22  THR  23          1HG2      THR  23 -13.883  -1.110   4.574
  135   HG23  THR  23          2HG2      THR  23 -13.661  -2.814   4.971
  136    H    LEU  24           H        LEU  24 -10.815   1.094   5.017
  137    HA   LEU  24           HA       LEU  24 -12.758   2.555   3.413
  138    HB2  LEU  24           1HB      LEU  24 -11.408   3.018   6.037
  139    HB3  LEU  24           2HB      LEU  24 -12.139   4.372   5.178
  140    HG   LEU  24           HG       LEU  24 -13.699   1.895   5.857
  141   HD11  LEU  24          1HD1      LEU  24 -14.568   3.319   7.782
  142   HD12  LEU  24          2HD1      LEU  24 -13.112   4.291   7.568
  143   HD13  LEU  24          3HD1      LEU  24 -12.978   2.581   7.979
  144   HD21  LEU  24          3HD2      LEU  24 -15.183   4.316   5.900
  145   HD22  LEU  24          1HD2      LEU  24 -15.327   2.954   4.789
  146   HD23  LEU  24          2HD2      LEU  24 -14.227   4.281   4.417
  147    H    LYS  25           H        LYS  25 -12.232   3.971   1.881
  148    HA   LYS  25           HA       LYS  25  -9.739   4.263   0.786
  149    HB2  LYS  25           1HB      LYS  25 -12.138   5.113   0.044
  150    HB3  LYS  25           2HB      LYS  25 -11.556   6.629   0.719
  151    HG2  LYS  25           1HG      LYS  25  -9.981   5.088  -1.316
  152    HG3  LYS  25           2HG      LYS  25 -11.224   6.256  -1.771
  153    HD2  LYS  25           1HD      LYS  25 -10.029   8.052  -0.909
  154    HD3  LYS  25           2HD      LYS  25  -9.051   7.023   0.141
  155    HE2  LYS  25           1HE      LYS  25  -7.522   7.493  -1.493
  156    HE3  LYS  25           2HE      LYS  25  -8.240   6.028  -2.161
  157    HZ1  LYS  25           3HZ      LYS  25  -8.030   8.417  -3.437
  158    HZ2  LYS  25           1HZ      LYS  25  -9.643   8.407  -2.928
  159    HZ3  LYS  25           2HZ      LYS  25  -9.052   7.147  -3.888
  160    H    SER  26           H        SER  26 -11.291   6.497   3.085
  161    HA   SER  26           HA       SER  26  -9.369   8.423   3.313
  162    HB2  SER  26           1HB      SER  26 -11.527   8.471   4.515
  163    HB3  SER  26           2HB      SER  26 -10.935   7.223   5.610
  164    HG   SER  26           HG       SER  26 -10.228   9.922   5.427
  165    H    HIS  27           H        HIS  27  -9.519   5.452   5.278
  166    HA   HIS  27           HA       HIS  27  -7.321   5.682   6.833
  167    HB2  HIS  27           1HB      HIS  27  -8.381   3.275   5.365
  168    HB3  HIS  27           2HB      HIS  27  -7.013   3.154   6.468
  169    HD1  HIS  27           HD1      HIS  27  -9.486   1.592   7.166
  170    HD2  HIS  27           HD2      HIS  27  -8.871   5.506   8.416
  171    HE1  HIS  27           HE1      HIS  27 -10.938   1.885   9.199
  172    H    LEU  28           H        LEU  28  -7.143   4.039   3.669
  173    HA   LEU  28           HA       LEU  28  -4.393   3.894   3.480
  174    HB2  LEU  28           1HB      LEU  28  -5.640   2.680   1.915
  175    HB3  LEU  28           2HB      LEU  28  -6.546   4.103   1.404
  176    HG   LEU  28           HG       LEU  28  -4.482   4.972   0.334
  177   HD11  LEU  28          1HD1      LEU  28  -3.396   2.372   1.347
  178   HD12  LEU  28          2HD1      LEU  28  -2.701   3.989   1.456
  179   HD13  LEU  28          3HD1      LEU  28  -2.723   3.142  -0.090
  180   HD21  LEU  28          3HD2      LEU  28  -5.812   4.022  -1.256
  181   HD22  LEU  28          1HD2      LEU  28  -5.825   2.446  -0.466
  182   HD23  LEU  28          2HD2      LEU  28  -4.409   2.960  -1.384
  183    H    ASN  29           H        ASN  29  -6.450   6.373   1.939
  184    HA   ASN  29           HA       ASN  29  -4.607   8.020   0.850
  185    HB2  ASN  29           1HB      ASN  29  -7.203   8.278   1.121
  186    HB3  ASN  29           2HB      ASN  29  -6.767   9.284   2.499
  187   HD21  ASN  29          1HD2      ASN  29  -7.561  11.145   1.563
  188   HD22  ASN  29          2HD2      ASN  29  -6.775  11.928   0.238
  189    H    GLN  30           H        GLN  30  -5.628   8.146   4.258
  190    HA   GLN  30           HA       GLN  30  -3.777  10.172   4.981
  191    HB2  GLN  30           1HB      GLN  30  -5.451   8.223   6.538
  192    HB3  GLN  30           2HB      GLN  30  -4.288   9.263   7.350
  193    HG2  GLN  30           1HG      GLN  30  -6.600  10.175   5.652
  194    HG3  GLN  30           2HG      GLN  30  -6.516  10.219   7.413
  195   HE21  GLN  30          1HE2      GLN  30  -5.692  11.777   4.489
  196   HE22  GLN  30          2HE2      GLN  30  -4.880  13.139   5.175
  197    H    HIS  31           H        HIS  31  -3.607   6.701   4.779
  198    HA   HIS  31           HA       HIS  31  -1.283   6.361   6.381
  199    HB2  HIS  31           1HB      HIS  31  -2.377   4.357   6.135
  200    HB3  HIS  31           2HB      HIS  31  -2.825   4.682   4.463
  201    HD1  HIS  31           HD1      HIS  31  -0.114   3.220   6.561
  202    HD2  HIS  31           HD2      HIS  31  -0.909   3.928   2.545
  203    HE1  HIS  31           HE1      HIS  31   1.609   1.899   5.291
  204    H    GLN  32           H        GLN  32  -1.831   6.882   2.935
  205    HA   GLN  32           HA       GLN  32   0.716   6.386   1.959
  206    HB2  GLN  32           1HB      GLN  32  -1.480   8.237   1.095
  207    HB3  GLN  32           2HB      GLN  32   0.065   8.249   0.256
  208    HG2  GLN  32           1HG      GLN  32  -0.290   5.700   0.054
  209    HG3  GLN  32           2HG      GLN  32  -1.974   6.072   0.423
  210   HE21  GLN  32          1HE2      GLN  32  -1.434   4.907  -1.929
  211   HE22  GLN  32          2HE2      GLN  32  -1.619   6.028  -3.230
  212    H    ARG  33           H        ARG  33  -0.274   8.789   4.125
  213    HA   ARG  33           HA       ARG  33   1.468  10.898   3.472
  214    HB2  ARG  33           1HB      ARG  33   0.262  10.050   6.107
  215    HB3  ARG  33           2HB      ARG  33   1.194  11.527   5.902
  216    HG2  ARG  33           1HG      ARG  33  -0.479  12.124   4.071
  217    HG3  ARG  33           2HG      ARG  33  -1.471  10.820   4.728
  218    HD2  ARG  33           1HD      ARG  33  -2.085  13.009   5.657
  219    HD3  ARG  33           2HD      ARG  33  -1.502  11.900   6.898
  220    HE   ARG  33           HE       ARG  33   0.678  13.389   6.035
  221   HH11  ARG  33          1HH1      ARG  33  -2.368  13.928   7.632
  222   HH12  ARG  33          2HH1      ARG  33  -1.806  15.305   8.522
  223   HH21  ARG  33          1HH2      ARG  33   1.429  15.200   7.200
  224   HH22  ARG  33          2HH2      ARG  33   0.354  16.028   8.275
  225    H    ILE  34           H        ILE  34   1.951   7.901   5.195
  226    HA   ILE  34           HA       ILE  34   4.402   8.563   6.444
  227    HB   ILE  34           HB       ILE  34   4.660   6.263   6.924
  228   HG12  ILE  34          1HG1      ILE  34   2.697   5.725   4.685
  229   HG13  ILE  34          2HG1      ILE  34   4.423   5.381   4.657
  230   HG21  ILE  34          1HG2      ILE  34   2.962   6.583   8.332
  231   HG22  ILE  34          2HG2      ILE  34   2.033   7.478   7.131
  232   HG23  ILE  34          3HG2      ILE  34   1.966   5.716   7.163
  233   HD11  ILE  34          3HD1      ILE  34   3.909   3.911   6.722
  234   HD12  ILE  34          1HD1      ILE  34   2.244   3.995   6.148
  235   HD13  ILE  34          2HD1      ILE  34   3.502   3.322   5.110
  236    H    HIS  35           H        HIS  35   3.652   8.234   3.214
  237    HA   HIS  35           HA       HIS  35   6.420   7.498   2.524
  238    HB2  HIS  35           1HB      HIS  35   3.988   7.329   0.736
  239    HB3  HIS  35           2HB      HIS  35   5.606   6.732   0.379
  240    HD1  HIS  35           HD1      HIS  35   6.385   4.934   2.489
  241    HD2  HIS  35           HD2      HIS  35   2.388   5.275   1.409
  242    HE1  HIS  35           HE1      HIS  35   5.288   2.820   3.296
  243    H    THR  36           H        THR  36   4.078   9.971   2.486
  244    HA   THR  36           HA       THR  36   5.407  11.471   0.364
  245    HB   THR  36           HB       THR  36   3.602  13.003   0.435
  246    HG1  THR  36           HG1      THR  36   2.490  13.388   2.210
  247   HG21  THR  36          3HG2      THR  36   3.062  10.161   0.368
  248   HG22  THR  36          1HG2      THR  36   2.416  11.450  -0.646
  249   HG23  THR  36          2HG2      THR  36   1.648  11.073   0.896
  250    H    GLY  37           H        GLY  37   7.123  11.083   2.437
  251    HA2  GLY  37           1HA      GLY  37   7.372  13.813   3.498
  252    HA3  GLY  37           2HA      GLY  37   7.479  12.456   4.610
  253    H    GLU  38           H        GLU  38   9.609  13.427   5.064
  254    HA   GLU  38           HA       GLU  38  11.656  13.391   3.086
  255    HB2  GLU  38           1HB      GLU  38  13.189  13.801   4.932
  256    HB3  GLU  38           2HB      GLU  38  11.770  14.829   5.078
  257    HG2  GLU  38           1HG      GLU  38  10.862  13.021   6.649
  258    HG3  GLU  38           2HG      GLU  38  12.522  12.430   6.701
  259    H    LYS  39           H        LYS  39  13.442  11.973   2.921
  260    HA   LYS  39           HA       LYS  39  13.549   9.525   4.401
  261    HB2  LYS  39           1HB      LYS  39  13.240   8.064   2.369
  262    HB3  LYS  39           2HB      LYS  39  11.774   8.817   2.982
  263    HG2  LYS  39           1HG      LYS  39  11.483   9.243   0.780
  264    HG3  LYS  39           2HG      LYS  39  12.441  10.666   1.195
  265    HD2  LYS  39           1HD      LYS  39  14.479   9.436   0.497
  266    HD3  LYS  39           2HD      LYS  39  13.453   8.096  -0.021
  267    HE2  LYS  39           1HE      LYS  39  13.937   9.377  -1.958
  268    HE3  LYS  39           2HE      LYS  39  12.266   9.730  -1.521
  269    HZ1  LYS  39           3HZ      LYS  39  13.031  11.770  -0.451
  270    HZ2  LYS  39           1HZ      LYS  39  13.443  11.745  -2.092
  271    HZ3  LYS  39           2HZ      LYS  39  14.622  11.435  -0.919
  272    HA   PRO  40           HA       PRO  40  17.754   9.915   3.164
  273    HB2  PRO  40           1HB      PRO  40  18.600   7.388   3.684
  274    HB3  PRO  40           2HB      PRO  40  18.252   8.565   4.956
  275    HG2  PRO  40           1HG      PRO  40  16.544   6.336   3.919
  276    HG3  PRO  40           2HG      PRO  40  16.824   6.844   5.594
  277    HD2  PRO  40           1HD      PRO  40  14.594   7.527   4.218
  278    HD3  PRO  40           2HD      PRO  40  15.315   8.580   5.453
  279    H    SER  41           H        SER  41  18.840   9.776   1.290
  280    HA   SER  41           HA       SER  41  18.106   7.635  -0.595
  281    HB2  SER  41           1HB      SER  41  18.467  10.581  -1.153
  282    HB3  SER  41           2HB      SER  41  18.497   9.360  -2.424
  283    HG   SER  41           HG       SER  41  16.362   8.818  -1.074
  284    H    GLY  42           H        GLY  42  19.773   7.412  -2.381
  285    HA2  GLY  42           1HA      GLY  42  22.427   7.455  -1.127
  286    HA3  GLY  42           2HA      GLY  42  21.943   6.436  -2.474
  287    HA   PRO  43           HA       PRO  43  24.008   9.235  -5.157
  288    HB2  PRO  43           1HB      PRO  43  22.745   8.629  -7.483
  289    HB3  PRO  43           2HB      PRO  43  23.930   7.558  -6.726
  290    HG2  PRO  43           1HG      PRO  43  20.940   7.436  -6.640
  291    HG3  PRO  43           2HG      PRO  43  22.108   6.119  -6.855
  292    HD2  PRO  43           1HD      PRO  43  20.914   6.634  -4.480
  293    HD3  PRO  43           2HD      PRO  43  22.562   5.984  -4.599
  294    H    SER  44           H        SER  44  23.637  11.069  -6.575
  295    HA   SER  44           HA       SER  44  21.004  12.325  -6.151
  296    HB2  SER  44           1HB      SER  44  22.025  14.428  -5.808
  297    HB3  SER  44           2HB      SER  44  23.010  13.302  -4.875
  298    HG   SER  44           HG       SER  44  24.393  14.571  -6.056
  299    H    SER  45           H        SER  45  20.459  14.003  -7.775
  300    HA   SER  45           HA       SER  45  21.675  13.497 -10.401
  301    HB2  SER  45           1HB      SER  45  18.711  13.514  -9.788
  302    HB3  SER  45           2HB      SER  45  19.394  13.513 -11.414
  303    HG   SER  45           HG       SER  45  18.789  11.406 -10.419
  304    H    GLY  46           H        GLY  46  22.228  15.316 -11.401
  305    HA2  GLY  46           1HA      GLY  46  20.928  17.821 -10.527
  306    HA3  GLY  46           2HA      GLY  46  22.605  17.711 -11.040
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1   9.899 -11.370  12.715
    2    HA2  GLY   1           1HA      GLY   1  10.259  -9.276  11.392
    3    HA3  GLY   1           2HA      GLY   1  11.268 -10.259  10.342
    4    H    SER   2           H        SER   2   7.982 -10.400  11.726
    5    HA   SER   2           HA       SER   2   6.823 -11.988   9.783
    6    HB2  SER   2           1HB      SER   2   5.841 -11.078  12.007
    7    HB3  SER   2           2HB      SER   2   5.302  -9.712  11.030
    8    HG   SER   2           HG       SER   2   4.760 -12.239  10.021
    9    H    SER   3           H        SER   3   5.741 -11.614   7.863
   10    HA   SER   3           HA       SER   3   6.641  -9.299   6.382
   11    HB2  SER   3           1HB      SER   3   6.712 -11.426   5.244
   12    HB3  SER   3           2HB      SER   3   5.005 -11.714   5.577
   13    HG   SER   3           HG       SER   3   4.501 -10.529   3.917
   14    H    GLY   4           H        GLY   4   3.484 -10.762   7.166
   15    HA2  GLY   4           1HA      GLY   4   1.927  -8.924   8.075
   16    HA3  GLY   4           2HA      GLY   4   2.215  -8.188   6.506
   17    H    SER   5           H        SER   5   1.543  -9.400   4.596
   18    HA   SER   5           HA       SER   5  -1.037 -10.053   4.432
   19    HB2  SER   5           1HB      SER   5   0.642 -10.040   2.538
   20    HB3  SER   5           2HB      SER   5   1.034 -11.703   2.974
   21    HG   SER   5           HG       SER   5  -1.637 -11.367   2.757
   22    H    SER   6           H        SER   6  -2.310 -11.358   5.550
   23    HA   SER   6           HA       SER   6  -1.240 -13.960   6.428
   24    HB2  SER   6           1HB      SER   6  -2.764 -13.848   8.333
   25    HB3  SER   6           2HB      SER   6  -1.742 -12.410   8.295
   26    HG   SER   6           HG       SER   6  -3.431 -11.198   7.785
   27    H    GLY   7           H        GLY   7  -2.302 -13.705   3.879
   28    HA2  GLY   7           1HA      GLY   7  -3.648 -15.528   2.931
   29    HA3  GLY   7           2HA      GLY   7  -4.848 -15.178   4.167
   30    H    SER   8           H        SER   8  -5.272 -15.283   1.327
   31    HA   SER   8           HA       SER   8  -5.293 -12.939  -0.065
   32    HB2  SER   8           1HB      SER   8  -6.168 -15.184  -0.838
   33    HB3  SER   8           2HB      SER   8  -7.668 -14.808   0.008
   34    HG   SER   8           HG       SER   8  -7.561 -12.781  -1.328
   35    H    SER   9           H        SER   9  -5.995 -10.970   0.380
   36    HA   SER   9           HA       SER   9  -8.222 -10.655   2.275
   37    HB2  SER   9           1HB      SER   9  -6.044  -8.698   1.502
   38    HB3  SER   9           2HB      SER   9  -7.347  -8.366   2.643
   39    HG   SER   9           HG       SER   9  -6.468  -9.734   4.075
   40    H    THR  10           H        THR  10 -10.079  -9.766   1.629
   41    HA   THR  10           HA       THR  10 -10.386  -9.054  -1.161
   42    HB   THR  10           HB       THR  10 -12.097 -10.437  -0.045
   43    HG1  THR  10           HG1      THR  10 -12.610  -8.043  -1.332
   44   HG21  THR  10          3HG2      THR  10 -13.067  -8.018   1.423
   45   HG22  THR  10          1HG2      THR  10 -11.828  -9.043   2.146
   46   HG23  THR  10          2HG2      THR  10 -13.401  -9.723   1.729
   47    H    LYS  11           H        LYS  11  -8.726  -7.234   0.000
   48    HA   LYS  11           HA       LYS  11 -10.164  -4.928   0.930
   49    HB2  LYS  11           1HB      LYS  11  -7.658  -5.690   1.327
   50    HB3  LYS  11           2HB      LYS  11  -7.376  -4.733  -0.121
   51    HG2  LYS  11           1HG      LYS  11  -6.988  -3.298   1.703
   52    HG3  LYS  11           2HG      LYS  11  -8.561  -2.837   1.047
   53    HD2  LYS  11           1HD      LYS  11  -8.807  -2.880   3.403
   54    HD3  LYS  11           2HD      LYS  11  -9.592  -4.341   2.797
   55    HE2  LYS  11           1HE      LYS  11  -6.724  -4.507   3.554
   56    HE3  LYS  11           2HE      LYS  11  -7.913  -4.389   4.850
   57    HZ1  LYS  11           3HZ      LYS  11  -8.629  -6.305   2.838
   58    HZ2  LYS  11           1HZ      LYS  11  -8.567  -6.477   4.520
   59    HZ3  LYS  11           2HZ      LYS  11  -7.164  -6.675   3.598
   60    H    SER  12           H        SER  12 -10.069  -2.825  -0.160
   61    HA   SER  12           HA       SER  12 -10.352  -3.142  -3.073
   62    HB2  SER  12           1HB      SER  12 -11.732  -1.357  -1.086
   63    HB3  SER  12           2HB      SER  12 -11.686  -0.928  -2.796
   64    HG   SER  12           HG       SER  12 -12.413  -3.375  -2.852
   65    H    HIS  13           H        HIS  13  -9.461  -0.654  -0.676
   66    HA   HIS  13           HA       HIS  13  -7.830   0.707  -2.657
   67    HB2  HIS  13           1HB      HIS  13  -8.106   1.440   0.255
   68    HB3  HIS  13           2HB      HIS  13  -7.644   2.482  -1.088
   69    HD1  HIS  13           HD1      HIS  13  -9.719   2.647  -2.980
   70    HD2  HIS  13           HD2      HIS  13 -10.678   1.799   0.972
   71    HE1  HIS  13           HE1      HIS  13 -12.155   3.224  -2.741
   72    H    GLN  14           H        GLN  14  -5.743   0.314  -2.942
   73    HA   GLN  14           HA       GLN  14  -4.192  -0.778  -0.692
   74    HB2  GLN  14           1HB      GLN  14  -4.812  -2.456  -2.527
   75    HB3  GLN  14           2HB      GLN  14  -3.702  -1.563  -3.557
   76    HG2  GLN  14           1HG      GLN  14  -2.023  -1.951  -1.602
   77    HG3  GLN  14           2HG      GLN  14  -3.129  -3.255  -1.174
   78   HE21  GLN  14          1HE2      GLN  14  -0.673  -2.190  -3.299
   79   HE22  GLN  14          2HE2      GLN  14  -0.571  -3.619  -4.265
   80    H    CYS  15           H        CYS  15  -2.118  -0.026  -0.447
   81    HA   CYS  15           HA       CYS  15  -1.528   2.495  -1.678
   82    HB2  CYS  15           1HB      CYS  15  -1.003   1.851   0.720
   83    HB3  CYS  15           2HB      CYS  15   0.308   0.867   0.080
   84    H    HIS  16           H        HIS  16   0.554   2.979  -2.708
   85    HA   HIS  16           HA       HIS  16   1.408   0.757  -4.440
   86    HB2  HIS  16           1HB      HIS  16   1.103   3.698  -4.911
   87    HB3  HIS  16           2HB      HIS  16   2.275   2.790  -5.861
   88    HD1  HIS  16           HD1      HIS  16   1.050   0.457  -6.919
   89    HD2  HIS  16           HD2      HIS  16  -1.280   3.811  -6.156
   90    HE1  HIS  16           HE1      HIS  16  -1.016   0.173  -8.324
   91    H    GLU  17           H        GLU  17   2.433   3.093  -2.124
   92    HA   GLU  17           HA       GLU  17   5.215   3.050  -2.766
   93    HB2  GLU  17           1HB      GLU  17   4.009   3.745  -0.091
   94    HB3  GLU  17           2HB      GLU  17   5.542   4.291  -0.756
   95    HG2  GLU  17           1HG      GLU  17   2.815   5.019  -1.802
   96    HG3  GLU  17           2HG      GLU  17   3.851   6.045  -0.812
   97    H    CYS  18           H        CYS  18   3.166   1.327  -0.457
   98    HA   CYS  18           HA       CYS  18   5.424  -0.493   0.071
   99    HB2  CYS  18           1HB      CYS  18   4.445  -0.913   2.289
  100    HB3  CYS  18           2HB      CYS  18   4.847   0.787   2.073
  101    H    GLY  19           H        GLY  19   1.923  -0.210  -0.338
  102    HA2  GLY  19           1HA      GLY  19   0.698  -1.760  -1.680
  103    HA3  GLY  19           2HA      GLY  19   1.898  -2.986  -1.301
  104    H    ARG  20           H        ARG  20   0.188  -0.823   0.922
  105    HA   ARG  20           HA       ARG  20  -0.612  -3.130   2.498
  106    HB2  ARG  20           1HB      ARG  20  -0.434  -0.194   2.951
  107    HB3  ARG  20           2HB      ARG  20  -1.612  -1.090   3.901
  108    HG2  ARG  20           1HG      ARG  20   0.389  -2.666   4.412
  109    HG3  ARG  20           2HG      ARG  20   1.364  -1.285   3.907
  110    HD2  ARG  20           1HD      ARG  20   0.494   0.082   5.621
  111    HD3  ARG  20           2HD      ARG  20  -0.814  -1.050   5.963
  112    HE   ARG  20           HE       ARG  20   0.613  -2.243   7.300
  113   HH11  ARG  20          1HH1      ARG  20   2.458  -0.053   5.320
  114   HH12  ARG  20          2HH1      ARG  20   3.950  -0.358   6.145
  115   HH21  ARG  20          1HH2      ARG  20   2.572  -2.653   8.394
  116   HH22  ARG  20          2HH2      ARG  20   4.014  -1.838   7.893
  117    H    GLY  21           H        GLY  21  -2.848  -3.206   3.392
  118    HA2  GLY  21           1HA      GLY  21  -4.786  -2.427   1.302
  119    HA3  GLY  21           2HA      GLY  21  -4.915  -3.891   2.265
  120    H    PHE  22           H        PHE  22  -6.389  -1.105   1.837
  121    HA   PHE  22           HA       PHE  22  -7.128  -0.870   4.675
  122    HB2  PHE  22           1HB      PHE  22  -6.778   1.410   2.717
  123    HB3  PHE  22           2HB      PHE  22  -7.418   1.568   4.349
  124    HD1  PHE  22           HD1      PHE  22  -5.942   1.127   6.296
  125    HD2  PHE  22           HD2      PHE  22  -4.455   1.290   2.311
  126    HE1  PHE  22           HE1      PHE  22  -3.659   1.426   7.163
  127    HE2  PHE  22           HE2      PHE  22  -2.170   1.588   3.172
  128    HZ   PHE  22           HZ       PHE  22  -1.769   1.656   5.601
  129    H    THR  23           H        THR  23  -9.243  -1.023   5.065
  130    HA   THR  23           HA       THR  23 -11.067  -1.617   2.975
  131    HB   THR  23           HB       THR  23 -11.722  -0.917   5.843
  132    HG1  THR  23           HG1      THR  23 -11.607  -3.196   6.152
  133   HG21  THR  23          3HG2      THR  23 -13.292  -2.797   4.134
  134   HG22  THR  23          1HG2      THR  23 -13.524  -1.060   3.939
  135   HG23  THR  23          2HG2      THR  23 -13.817  -1.819   5.504
  136    H    LEU  24           H        LEU  24 -10.721   1.190   5.132
  137    HA   LEU  24           HA       LEU  24 -12.737   2.648   3.620
  138    HB2  LEU  24           1HB      LEU  24 -11.113   3.422   6.039
  139    HB3  LEU  24           2HB      LEU  24 -12.371   4.416   5.307
  140    HG   LEU  24           HG       LEU  24 -12.851   1.695   6.515
  141   HD11  LEU  24          1HD1      LEU  24 -12.067   3.611   8.066
  142   HD12  LEU  24          2HD1      LEU  24 -13.504   2.687   8.501
  143   HD13  LEU  24          3HD1      LEU  24 -13.670   4.283   7.770
  144   HD21  LEU  24          3HD2      LEU  24 -14.776   1.875   5.408
  145   HD22  LEU  24          1HD2      LEU  24 -14.452   3.551   4.961
  146   HD23  LEU  24          2HD2      LEU  24 -15.184   3.180   6.523
  147    H    LYS  25           H        LYS  25 -12.215   3.810   1.903
  148    HA   LYS  25           HA       LYS  25  -9.800   4.173   0.751
  149    HB2  LYS  25           1HB      LYS  25 -11.956   4.845  -0.258
  150    HB3  LYS  25           2HB      LYS  25 -11.994   6.253   0.795
  151    HG2  LYS  25           1HG      LYS  25 -11.219   7.060  -1.252
  152    HG3  LYS  25           2HG      LYS  25  -9.768   6.899  -0.259
  153    HD2  LYS  25           1HD      LYS  25  -9.400   4.658  -1.318
  154    HD3  LYS  25           2HD      LYS  25 -10.731   5.026  -2.417
  155    HE2  LYS  25           1HE      LYS  25  -9.454   7.131  -3.026
  156    HE3  LYS  25           2HE      LYS  25  -8.086   6.437  -2.157
  157    HZ1  LYS  25           3HZ      LYS  25  -9.382   5.465  -4.625
  158    HZ2  LYS  25           1HZ      LYS  25  -8.450   4.429  -3.665
  159    HZ3  LYS  25           2HZ      LYS  25  -7.748   5.806  -4.351
  160    H    SER  26           H        SER  26 -11.236   6.316   3.186
  161    HA   SER  26           HA       SER  26  -9.345   8.324   3.236
  162    HB2  SER  26           1HB      SER  26 -11.438   8.384   4.536
  163    HB3  SER  26           2HB      SER  26 -10.801   7.143   5.615
  164    HG   SER  26           HG       SER  26  -9.045   8.681   6.024
  165    H    HIS  27           H        HIS  27  -9.368   5.384   5.255
  166    HA   HIS  27           HA       HIS  27  -7.115   5.654   6.712
  167    HB2  HIS  27           1HB      HIS  27  -8.209   3.233   5.302
  168    HB3  HIS  27           2HB      HIS  27  -6.768   3.125   6.309
  169    HD1  HIS  27           HD1      HIS  27  -9.378   1.623   7.025
  170    HD2  HIS  27           HD2      HIS  27  -8.311   5.345   8.529
  171    HE1  HIS  27           HE1      HIS  27 -10.641   1.862   9.187
  172    H    LEU  28           H        LEU  28  -7.064   4.102   3.497
  173    HA   LEU  28           HA       LEU  28  -4.325   3.935   3.195
  174    HB2  LEU  28           1HB      LEU  28  -5.729   2.814   1.653
  175    HB3  LEU  28           2HB      LEU  28  -6.515   4.316   1.170
  176    HG   LEU  28           HG       LEU  28  -4.396   5.031   0.104
  177   HD11  LEU  28          1HD1      LEU  28  -2.911   3.636   1.523
  178   HD12  LEU  28          2HD1      LEU  28  -2.591   3.485  -0.205
  179   HD13  LEU  28          3HD1      LEU  28  -3.472   2.214   0.643
  180   HD21  LEU  28          3HD2      LEU  28  -6.203   3.890  -1.151
  181   HD22  LEU  28          1HD2      LEU  28  -5.381   2.354  -0.874
  182   HD23  LEU  28          2HD2      LEU  28  -4.598   3.613  -1.830
  183    H    ASN  29           H        ASN  29  -6.405   6.492   1.820
  184    HA   ASN  29           HA       ASN  29  -4.553   8.159   0.756
  185    HB2  ASN  29           1HB      ASN  29  -7.161   8.640   2.117
  186    HB3  ASN  29           2HB      ASN  29  -6.153  10.040   1.761
  187   HD21  ASN  29          1HD2      ASN  29  -8.087   7.493   0.455
  188   HD22  ASN  29          2HD2      ASN  29  -8.119   8.068  -1.174
  189    H    GLN  30           H        GLN  30  -5.652   8.341   4.146
  190    HA   GLN  30           HA       GLN  30  -3.750  10.279   4.920
  191    HB2  GLN  30           1HB      GLN  30  -5.925   9.579   6.104
  192    HB3  GLN  30           2HB      GLN  30  -4.974   8.274   6.800
  193    HG2  GLN  30           1HG      GLN  30  -3.661   9.717   8.045
  194    HG3  GLN  30           2HG      GLN  30  -4.049  11.104   7.029
  195   HE21  GLN  30          1HE2      GLN  30  -6.275  11.897   7.127
  196   HE22  GLN  30          2HE2      GLN  30  -7.124  11.802   8.628
  197    H    HIS  31           H        HIS  31  -3.640   6.808   4.680
  198    HA   HIS  31           HA       HIS  31  -1.369   6.377   6.319
  199    HB2  HIS  31           1HB      HIS  31  -2.447   4.390   5.953
  200    HB3  HIS  31           2HB      HIS  31  -2.879   4.805   4.297
  201    HD1  HIS  31           HD1      HIS  31  -0.185   3.228   6.338
  202    HD2  HIS  31           HD2      HIS  31  -0.965   4.123   2.356
  203    HE1  HIS  31           HE1      HIS  31   1.534   1.958   5.014
  204    H    GLN  32           H        GLN  32  -1.758   6.848   2.824
  205    HA   GLN  32           HA       GLN  32   0.803   6.425   1.946
  206    HB2  GLN  32           1HB      GLN  32  -1.175   8.527   1.062
  207    HB3  GLN  32           2HB      GLN  32   0.308   8.160   0.192
  208    HG2  GLN  32           1HG      GLN  32  -0.475   5.829  -0.072
  209    HG3  GLN  32           2HG      GLN  32  -1.995   6.290   0.694
  210   HE21  GLN  32          1HE2      GLN  32  -2.051   5.203  -1.777
  211   HE22  GLN  32          2HE2      GLN  32  -2.471   6.397  -2.952
  212    H    ARG  33           H        ARG  33  -0.304   8.895   4.044
  213    HA   ARG  33           HA       ARG  33   1.526  10.942   3.566
  214    HB2  ARG  33           1HB      ARG  33   0.247  10.046   6.152
  215    HB3  ARG  33           2HB      ARG  33   1.156  11.541   5.972
  216    HG2  ARG  33           1HG      ARG  33  -0.461  12.245   4.223
  217    HG3  ARG  33           2HG      ARG  33  -1.409  10.801   4.584
  218    HD2  ARG  33           1HD      ARG  33  -1.762  11.544   6.849
  219    HD3  ARG  33           2HD      ARG  33  -0.687  12.919   6.603
  220    HE   ARG  33           HE       ARG  33  -2.952  12.820   4.816
  221   HH11  ARG  33          1HH1      ARG  33  -1.713  13.956   7.864
  222   HH12  ARG  33          2HH1      ARG  33  -2.861  15.247   7.998
  223   HH21  ARG  33          1HH2      ARG  33  -4.469  14.515   4.980
  224   HH22  ARG  33          2HH2      ARG  33  -4.429  15.563   6.358
  225    H    ILE  34           H        ILE  34   1.874   7.926   5.319
  226    HA   ILE  34           HA       ILE  34   4.280   8.496   6.658
  227    HB   ILE  34           HB       ILE  34   4.500   6.175   7.051
  228   HG12  ILE  34          1HG1      ILE  34   2.546   5.659   4.800
  229   HG13  ILE  34          2HG1      ILE  34   4.293   5.504   4.649
  230   HG21  ILE  34          1HG2      ILE  34   2.742   6.523   8.391
  231   HG22  ILE  34          2HG2      ILE  34   1.838   7.372   7.138
  232   HG23  ILE  34          3HG2      ILE  34   1.828   5.610   7.191
  233   HD11  ILE  34          3HD1      ILE  34   4.124   3.844   6.582
  234   HD12  ILE  34          1HD1      ILE  34   2.393   3.831   6.244
  235   HD13  ILE  34          2HD1      ILE  34   3.539   3.333   4.999
  236    H    HIS  35           H        HIS  35   3.679   8.267   3.378
  237    HA   HIS  35           HA       HIS  35   6.464   7.514   2.790
  238    HB2  HIS  35           1HB      HIS  35   4.103   7.534   0.898
  239    HB3  HIS  35           2HB      HIS  35   5.724   6.941   0.546
  240    HD1  HIS  35           HD1      HIS  35   6.416   4.978   2.535
  241    HD2  HIS  35           HD2      HIS  35   2.457   5.459   1.367
  242    HE1  HIS  35           HE1      HIS  35   5.268   2.827   3.148
  243    H    THR  36           H        THR  36   3.992   9.947   2.346
  244    HA   THR  36           HA       THR  36   5.055  11.549   0.386
  245    HB   THR  36           HB       THR  36   3.939  13.452   1.448
  246    HG1  THR  36           HG1      THR  36   3.364  11.723   3.633
  247   HG21  THR  36          3HG2      THR  36   2.363  12.244   0.280
  248   HG22  THR  36          1HG2      THR  36   1.669  12.205   1.900
  249   HG23  THR  36          2HG2      THR  36   2.558  10.810   1.288
  250    H    GLY  37           H        GLY  37   6.909  12.610   0.146
  251    HA2  GLY  37           1HA      GLY  37   8.199  14.379   1.636
  252    HA3  GLY  37           2HA      GLY  37   8.682  12.897   2.448
  253    H    GLU  38           H        GLU  38  10.859  13.631   1.844
  254    HA   GLU  38           HA       GLU  38  11.504  12.878  -0.932
  255    HB2  GLU  38           1HB      GLU  38  12.636  15.029   0.829
  256    HB3  GLU  38           2HB      GLU  38  13.598  14.347  -0.474
  257    HG2  GLU  38           1HG      GLU  38  10.854  15.319  -1.080
  258    HG3  GLU  38           2HG      GLU  38  12.144  16.495  -0.836
  259    H    LYS  39           H        LYS  39  13.996  12.350  -1.039
  260    HA   LYS  39           HA       LYS  39  15.347  10.505  -0.683
  261    HB2  LYS  39           1HB      LYS  39  15.482  12.256   1.746
  262    HB3  LYS  39           2HB      LYS  39  16.440  10.783   1.676
  263    HG2  LYS  39           1HG      LYS  39  16.573  12.701  -0.598
  264    HG3  LYS  39           2HG      LYS  39  17.435  13.071   0.898
  265    HD2  LYS  39           1HD      LYS  39  19.068  11.905  -0.186
  266    HD3  LYS  39           2HD      LYS  39  18.244  10.561   0.608
  267    HE2  LYS  39           1HE      LYS  39  17.327   9.795  -1.339
  268    HE3  LYS  39           2HE      LYS  39  17.272  11.398  -2.071
  269    HZ1  LYS  39           3HZ      LYS  39  18.917   9.903  -3.103
  270    HZ2  LYS  39           1HZ      LYS  39  19.762   9.840  -1.639
  271    HZ3  LYS  39           2HZ      LYS  39  19.618  11.306  -2.469
  272    HA   PRO  40           HA       PRO  40  12.130   8.244   1.951
  273    HB2  PRO  40           1HB      PRO  40  11.041   6.769  -0.052
  274    HB3  PRO  40           2HB      PRO  40  10.433   8.364   0.407
  275    HG2  PRO  40           1HG      PRO  40  12.252   7.606  -1.846
  276    HG3  PRO  40           2HG      PRO  40  10.883   8.733  -1.845
  277    HD2  PRO  40           1HD      PRO  40  13.456   9.565  -1.695
  278    HD3  PRO  40           2HD      PRO  40  12.124  10.435  -0.907
  279    H    SER  41           H        SER  41  13.511   6.901   2.989
  280    HA   SER  41           HA       SER  41  15.534   5.357   1.953
  281    HB2  SER  41           1HB      SER  41  15.554   4.168   4.009
  282    HB3  SER  41           2HB      SER  41  14.957   5.779   4.406
  283    HG   SER  41           HG       SER  41  12.793   4.652   3.973
  284    H    GLY  42           H        GLY  42  15.661   3.578   0.743
  285    HA2  GLY  42           1HA      GLY  42  13.202   1.973   0.399
  286    HA3  GLY  42           2HA      GLY  42  14.306   2.327  -0.922
  287    HA   PRO  43           HA       PRO  43  16.293  -1.508  -0.130
  288    HB2  PRO  43           1HB      PRO  43  18.712  -1.001  -1.254
  289    HB3  PRO  43           2HB      PRO  43  17.249  -1.276  -2.206
  290    HG2  PRO  43           1HG      PRO  43  18.564   1.307  -1.458
  291    HG3  PRO  43           2HG      PRO  43  17.872   0.814  -3.014
  292    HD2  PRO  43           1HD      PRO  43  16.554   2.418  -1.276
  293    HD3  PRO  43           2HD      PRO  43  15.715   1.274  -2.343
  294    H    SER  44           H        SER  44  16.323  -1.191   2.203
  295    HA   SER  44           HA       SER  44  18.735  -0.019   3.339
  296    HB2  SER  44           1HB      SER  44  16.121  -0.976   4.442
  297    HB3  SER  44           2HB      SER  44  17.514  -0.866   5.518
  298    HG   SER  44           HG       SER  44  16.030   1.061   5.170
  299    H    SER  45           H        SER  45  17.045  -3.153   3.399
  300    HA   SER  45           HA       SER  45  19.643  -4.474   3.700
  301    HB2  SER  45           1HB      SER  45  17.328  -4.634   5.579
  302    HB3  SER  45           2HB      SER  45  18.269  -6.097   5.290
  303    HG   SER  45           HG       SER  45  20.078  -5.077   6.053
  304    H    GLY  46           H        GLY  46  19.464  -6.866   3.313
  305    HA2  GLY  46           1HA      GLY  46  18.667  -7.560   0.859
  306    HA3  GLY  46           2HA      GLY  46  18.588  -8.706   2.188
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1   6.942  -3.605  -4.224
    2    HA2  GLY   1           1HA      GLY   1   5.907  -4.537  -6.764
    3    HA3  GLY   1           2HA      GLY   1   7.497  -5.163  -6.352
    4    H    SER   2           H        SER   2   4.356  -5.941  -6.324
    5    HA   SER   2           HA       SER   2   4.747  -8.062  -4.418
    6    HB2  SER   2           1HB      SER   2   4.052  -6.423  -2.824
    7    HB3  SER   2           2HB      SER   2   2.755  -5.855  -3.875
    8    HG   SER   2           HG       SER   2   1.527  -7.433  -3.207
    9    H    SER   3           H        SER   3   3.675  -9.825  -5.058
   10    HA   SER   3           HA       SER   3   1.562  -9.480  -7.083
   11    HB2  SER   3           1HB      SER   3   3.783 -11.457  -6.805
   12    HB3  SER   3           2HB      SER   3   2.276 -11.995  -7.545
   13    HG   SER   3           HG       SER   3   2.559  -9.986  -8.878
   14    H    GLY   4           H        GLY   4  -0.194  -9.425  -5.698
   15    HA2  GLY   4           1HA      GLY   4  -1.757 -10.206  -4.189
   16    HA3  GLY   4           2HA      GLY   4  -1.540 -11.704  -5.080
   17    H    SER   5           H        SER   5  -0.628  -9.895  -2.231
   18    HA   SER   5           HA       SER   5   1.290 -11.418  -1.055
   19    HB2  SER   5           1HB      SER   5   0.283 -10.788   1.139
   20    HB3  SER   5           2HB      SER   5   0.418  -9.428   0.025
   21    HG   SER   5           HG       SER   5  -1.619  -9.319   0.818
   22    H    SER   6           H        SER   6   1.102 -13.023   0.737
   23    HA   SER   6           HA       SER   6  -0.414 -15.284  -0.178
   24    HB2  SER   6           1HB      SER   6   0.656 -16.438   1.778
   25    HB3  SER   6           2HB      SER   6   1.806 -15.680   0.677
   26    HG   SER   6           HG       SER   6   2.228 -15.259   2.920
   27    H    GLY   7           H        GLY   7  -2.577 -14.576   0.090
   28    HA2  GLY   7           1HA      GLY   7  -4.539 -14.967   1.318
   29    HA3  GLY   7           2HA      GLY   7  -3.577 -15.051   2.786
   30    H    SER   8           H        SER   8  -5.874 -13.684   2.928
   31    HA   SER   8           HA       SER   8  -6.867 -11.629   3.202
   32    HB2  SER   8           1HB      SER   8  -4.134 -11.228   4.435
   33    HB3  SER   8           2HB      SER   8  -5.489 -10.124   4.668
   34    HG   SER   8           HG       SER   8  -6.356 -12.573   5.171
   35    H    SER   9           H        SER   9  -5.987 -11.823   0.608
   36    HA   SER   9           HA       SER   9  -4.885  -9.142   0.071
   37    HB2  SER   9           1HB      SER   9  -4.105 -10.056  -2.099
   38    HB3  SER   9           2HB      SER   9  -3.385 -10.892  -0.724
   39    HG   SER   9           HG       SER   9  -5.710 -11.838  -2.030
   40    H    THR  10           H        THR  10  -7.580  -9.406   0.603
   41    HA   THR  10           HA       THR  10  -8.791  -9.057  -2.063
   42    HB   THR  10           HB       THR  10 -10.976  -9.639  -0.969
   43    HG1  THR  10           HG1      THR  10 -10.516 -10.996   1.036
   44   HG21  THR  10          3HG2      THR  10  -9.521 -11.248  -2.285
   45   HG22  THR  10          1HG2      THR  10 -10.678 -11.981  -1.175
   46   HG23  THR  10          2HG2      THR  10  -8.974 -11.877  -0.731
   47    H    LYS  11           H        LYS  11  -7.463  -6.975  -0.709
   48    HA   LYS  11           HA       LYS  11  -9.443  -5.340   0.616
   49    HB2  LYS  11           1HB      LYS  11  -6.802  -5.446   0.913
   50    HB3  LYS  11           2HB      LYS  11  -6.855  -4.209  -0.336
   51    HG2  LYS  11           1HG      LYS  11  -6.810  -3.083   1.738
   52    HG3  LYS  11           2HG      LYS  11  -8.462  -2.948   1.129
   53    HD2  LYS  11           1HD      LYS  11  -8.760  -3.505   3.370
   54    HD3  LYS  11           2HD      LYS  11  -8.919  -5.057   2.542
   55    HE2  LYS  11           1HE      LYS  11  -6.357  -5.238   2.986
   56    HE3  LYS  11           2HE      LYS  11  -6.672  -4.019   4.220
   57    HZ1  LYS  11           3HZ      LYS  11  -7.580  -6.806   4.089
   58    HZ2  LYS  11           1HZ      LYS  11  -8.551  -5.672   4.886
   59    HZ3  LYS  11           2HZ      LYS  11  -6.963  -5.936   5.402
   60    H    SER  12           H        SER  12 -10.099  -3.242  -0.132
   61    HA   SER  12           HA       SER  12 -10.602  -3.230  -2.991
   62    HB2  SER  12           1HB      SER  12 -11.668  -1.673  -0.654
   63    HB3  SER  12           2HB      SER  12 -11.935  -1.099  -2.300
   64    HG   SER  12           HG       SER  12 -12.869  -3.439  -1.053
   65    H    HIS  13           H        HIS  13  -9.105  -1.106  -0.572
   66    HA   HIS  13           HA       HIS  13  -7.821   0.370  -2.774
   67    HB2  HIS  13           1HB      HIS  13  -8.132   1.386   0.047
   68    HB3  HIS  13           2HB      HIS  13  -7.755   2.307  -1.407
   69    HD1  HIS  13           HD1      HIS  13  -9.840   2.215  -3.255
   70    HD2  HIS  13           HD2      HIS  13 -10.731   1.568   0.751
   71    HE1  HIS  13           HE1      HIS  13 -12.310   2.633  -3.039
   72    H    GLN  14           H        GLN  14  -5.802  -0.293  -3.079
   73    HA   GLN  14           HA       GLN  14  -4.189  -1.014  -0.723
   74    HB2  GLN  14           1HB      GLN  14  -4.431  -2.921  -2.147
   75    HB3  GLN  14           2HB      GLN  14  -4.041  -1.976  -3.579
   76    HG2  GLN  14           1HG      GLN  14  -1.759  -1.648  -2.695
   77    HG3  GLN  14           2HG      GLN  14  -2.168  -2.696  -1.337
   78   HE21  GLN  14          1HE2      GLN  14  -1.731  -4.771  -1.549
   79   HE22  GLN  14          2HE2      GLN  14  -1.442  -5.601  -3.036
   80    H    CYS  15           H        CYS  15  -2.205  -0.094  -0.427
   81    HA   CYS  15           HA       CYS  15  -1.726   2.425  -1.644
   82    HB2  CYS  15           1HB      CYS  15  -1.068   1.802   0.693
   83    HB3  CYS  15           2HB      CYS  15   0.199   0.786   0.013
   84    H    HIS  16           H        HIS  16   0.387   3.016  -2.651
   85    HA   HIS  16           HA       HIS  16   1.186   0.935  -4.575
   86    HB2  HIS  16           1HB      HIS  16   1.047   3.936  -4.817
   87    HB3  HIS  16           2HB      HIS  16   1.951   2.948  -5.960
   88    HD1  HIS  16           HD1      HIS  16   0.319   0.876  -6.971
   89    HD2  HIS  16           HD2      HIS  16  -1.466   4.395  -5.671
   90    HE1  HIS  16           HE1      HIS  16  -1.941   0.930  -8.073
   91    H    GLU  17           H        GLU  17   2.298   3.210  -2.199
   92    HA   GLU  17           HA       GLU  17   5.058   3.128  -2.899
   93    HB2  GLU  17           1HB      GLU  17   3.920   3.758  -0.177
   94    HB3  GLU  17           2HB      GLU  17   5.453   4.293  -0.850
   95    HG2  GLU  17           1HG      GLU  17   2.742   5.097  -1.878
   96    HG3  GLU  17           2HG      GLU  17   3.749   6.063  -0.802
   97    H    CYS  18           H        CYS  18   3.081   1.427  -0.495
   98    HA   CYS  18           HA       CYS  18   5.312  -0.461  -0.115
   99    HB2  CYS  18           1HB      CYS  18   4.420  -0.917   2.118
  100    HB3  CYS  18           2HB      CYS  18   4.773   0.798   1.928
  101    H    GLY  19           H        GLY  19   1.806  -0.126  -0.428
  102    HA2  GLY  19           1HA      GLY  19   0.548  -1.634  -1.799
  103    HA3  GLY  19           2HA      GLY  19   1.724  -2.888  -1.437
  104    H    ARG  20           H        ARG  20   0.429  -0.810   1.049
  105    HA   ARG  20           HA       ARG  20  -0.463  -3.043   2.577
  106    HB2  ARG  20           1HB      ARG  20  -0.390  -0.096   2.918
  107    HB3  ARG  20           2HB      ARG  20  -1.575  -0.973   3.877
  108    HG2  ARG  20           1HG      ARG  20   0.410  -2.480   4.540
  109    HG3  ARG  20           2HG      ARG  20   1.408  -1.152   3.944
  110    HD2  ARG  20           1HD      ARG  20   0.144   0.374   5.467
  111    HD3  ARG  20           2HD      ARG  20  -0.650  -1.048   6.143
  112    HE   ARG  20           HE       ARG  20   2.076  -0.193   6.590
  113   HH11  ARG  20          1HH1      ARG  20  -0.231  -2.792   6.793
  114   HH12  ARG  20          2HH1      ARG  20   0.657  -3.660   8.001
  115   HH21  ARG  20          1HH2      ARG  20   3.255  -1.327   8.180
  116   HH22  ARG  20          2HH2      ARG  20   2.639  -2.825   8.790
  117    H    GLY  21           H        GLY  21  -2.768  -2.774   3.655
  118    HA2  GLY  21           1HA      GLY  21  -4.720  -2.320   1.485
  119    HA3  GLY  21           2HA      GLY  21  -4.791  -3.748   2.507
  120    H    PHE  22           H        PHE  22  -6.410  -1.087   1.984
  121    HA   PHE  22           HA       PHE  22  -7.130  -0.759   4.814
  122    HB2  PHE  22           1HB      PHE  22  -6.872   1.491   2.807
  123    HB3  PHE  22           2HB      PHE  22  -7.445   1.654   4.464
  124    HD1  PHE  22           HD2      PHE  22  -4.519   1.024   2.342
  125    HD2  PHE  22           HD1      PHE  22  -5.925   1.666   6.308
  126    HE1  PHE  22           HE2      PHE  22  -2.206   1.385   3.100
  127    HE2  PHE  22           HE1      PHE  22  -3.614   2.029   7.072
  128    HZ   PHE  22           HZ       PHE  22  -1.751   1.887   5.468
  129    H    THR  23           H        THR  23  -9.230  -1.029   5.185
  130    HA   THR  23           HA       THR  23 -11.039  -1.751   3.162
  131    HB   THR  23           HB       THR  23 -11.658  -0.817   5.972
  132    HG1  THR  23           HG1      THR  23 -11.899  -3.315   6.017
  133   HG21  THR  23          3HG2      THR  23 -13.380  -2.702   4.436
  134   HG22  THR  23          1HG2      THR  23 -13.500  -0.978   4.087
  135   HG23  THR  23          2HG2      THR  23 -13.812  -1.571   5.718
  136    H    LEU  24           H        LEU  24 -10.763   1.256   5.045
  137    HA   LEU  24           HA       LEU  24 -12.718   2.534   3.291
  138    HB2  LEU  24           1HB      LEU  24 -11.375   3.447   5.828
  139    HB3  LEU  24           2HB      LEU  24 -12.487   4.443   4.891
  140    HG   LEU  24           HG       LEU  24 -13.276   1.786   6.066
  141   HD11  LEU  24          1HD1      LEU  24 -12.470   3.693   7.687
  142   HD12  LEU  24          2HD1      LEU  24 -13.920   2.753   8.035
  143   HD13  LEU  24          3HD1      LEU  24 -14.062   4.363   7.329
  144   HD21  LEU  24          3HD2      LEU  24 -15.268   2.167   5.150
  145   HD22  LEU  24          1HD2      LEU  24 -14.503   3.458   4.223
  146   HD23  LEU  24          2HD2      LEU  24 -15.305   3.826   5.750
  147    H    LYS  25           H        LYS  25 -12.106   3.698   1.602
  148    HA   LYS  25           HA       LYS  25  -9.601   4.028   0.622
  149    HB2  LYS  25           1HB      LYS  25 -11.627   4.612  -0.627
  150    HB3  LYS  25           2HB      LYS  25 -11.863   6.023   0.396
  151    HG2  LYS  25           1HG      LYS  25 -10.911   6.886  -1.538
  152    HG3  LYS  25           2HG      LYS  25  -9.550   6.763  -0.421
  153    HD2  LYS  25           1HD      LYS  25  -8.688   4.871  -1.505
  154    HD3  LYS  25           2HD      LYS  25 -10.205   4.557  -2.350
  155    HE2  LYS  25           1HE      LYS  25  -8.677   5.453  -3.941
  156    HE3  LYS  25           2HE      LYS  25  -9.859   6.710  -3.582
  157    HZ1  LYS  25           3HZ      LYS  25  -7.015   6.590  -2.919
  158    HZ2  LYS  25           1HZ      LYS  25  -8.042   7.352  -1.811
  159    HZ3  LYS  25           2HZ      LYS  25  -7.957   7.908  -3.406
  160    H    SER  26           H        SER  26 -11.283   6.352   2.727
  161    HA   SER  26           HA       SER  26  -9.426   8.358   2.866
  162    HB2  SER  26           1HB      SER  26 -10.269   8.767   5.194
  163    HB3  SER  26           2HB      SER  26 -11.548   8.569   3.996
  164    HG   SER  26           HG       SER  26 -12.217   6.878   5.039
  165    H    HIS  27           H        HIS  27  -9.563   5.545   5.056
  166    HA   HIS  27           HA       HIS  27  -7.410   5.951   6.637
  167    HB2  HIS  27           1HB      HIS  27  -8.462   3.438   5.377
  168    HB3  HIS  27           2HB      HIS  27  -7.033   3.382   6.405
  169    HD1  HIS  27           HD1      HIS  27  -9.775   2.020   7.116
  170    HD2  HIS  27           HD2      HIS  27  -8.464   5.699   8.532
  171    HE1  HIS  27           HE1      HIS  27 -11.029   2.400   9.262
  172    H    LEU  28           H        LEU  28  -7.148   4.130   3.577
  173    HA   LEU  28           HA       LEU  28  -4.433   3.884   3.422
  174    HB2  LEU  28           1HB      LEU  28  -5.757   2.815   1.791
  175    HB3  LEU  28           2HB      LEU  28  -6.475   4.336   1.266
  176    HG   LEU  28           HG       LEU  28  -4.248   4.989   0.349
  177   HD11  LEU  28          1HD1      LEU  28  -2.412   3.733   0.568
  178   HD12  LEU  28          2HD1      LEU  28  -3.288   2.231   0.272
  179   HD13  LEU  28          3HD1      LEU  28  -3.282   2.945   1.884
  180   HD21  LEU  28          3HD2      LEU  28  -6.207   3.373  -0.727
  181   HD22  LEU  28          1HD2      LEU  28  -4.715   2.503  -1.083
  182   HD23  LEU  28          2HD2      LEU  28  -4.911   4.173  -1.618
  183    H    ASN  29           H        ASN  29  -6.296   6.558   1.965
  184    HA   ASN  29           HA       ASN  29  -4.310   8.113   0.970
  185    HB2  ASN  29           1HB      ASN  29  -6.929   8.743   2.242
  186    HB3  ASN  29           2HB      ASN  29  -5.827  10.083   1.936
  187   HD21  ASN  29          1HD2      ASN  29  -8.433   8.858   0.733
  188   HD22  ASN  29          2HD2      ASN  29  -8.149   8.984  -0.967
  189    H    GLN  30           H        GLN  30  -5.541   8.435   4.305
  190    HA   GLN  30           HA       GLN  30  -3.635  10.258   5.197
  191    HB2  GLN  30           1HB      GLN  30  -5.777   9.490   6.357
  192    HB3  GLN  30           2HB      GLN  30  -4.843   8.119   6.942
  193    HG2  GLN  30           1HG      GLN  30  -3.445   9.481   8.238
  194    HG3  GLN  30           2HG      GLN  30  -3.961  10.946   7.404
  195   HE21  GLN  30          1HE2      GLN  30  -5.337   8.279   9.297
  196   HE22  GLN  30          2HE2      GLN  30  -6.430   9.261  10.206
  197    H    HIS  31           H        HIS  31  -3.504   6.759   4.955
  198    HA   HIS  31           HA       HIS  31  -1.156   6.379   6.485
  199    HB2  HIS  31           1HB      HIS  31  -2.222   4.374   6.192
  200    HB3  HIS  31           2HB      HIS  31  -2.736   4.764   4.553
  201    HD1  HIS  31           HD1      HIS  31   0.113   3.301   6.484
  202    HD2  HIS  31           HD2      HIS  31  -0.952   4.020   2.533
  203    HE1  HIS  31           HE1      HIS  31   1.773   2.019   5.095
  204    H    GLN  32           H        GLN  32  -1.635   6.491   2.953
  205    HA   GLN  32           HA       GLN  32   0.888   6.189   2.030
  206    HB2  GLN  32           1HB      GLN  32  -1.358   7.945   1.131
  207    HB3  GLN  32           2HB      GLN  32   0.201   8.080   0.329
  208    HG2  GLN  32           1HG      GLN  32   0.117   5.872  -0.451
  209    HG3  GLN  32           2HG      GLN  32  -1.186   5.443   0.657
  210   HE21  GLN  32          1HE2      GLN  32  -2.175   4.620  -1.321
  211   HE22  GLN  32          2HE2      GLN  32  -3.077   5.707  -2.315
  212    H    ARG  33           H        ARG  33  -0.294   8.834   3.914
  213    HA   ARG  33           HA       ARG  33   1.506  10.852   3.301
  214    HB2  ARG  33           1HB      ARG  33   0.297  10.131   5.976
  215    HB3  ARG  33           2HB      ARG  33   1.132  11.641   5.637
  216    HG2  ARG  33           1HG      ARG  33  -0.555  12.105   3.869
  217    HG3  ARG  33           2HG      ARG  33  -1.427  10.663   4.394
  218    HD2  ARG  33           1HD      ARG  33  -2.519  12.261   5.614
  219    HD3  ARG  33           2HD      ARG  33  -1.246  11.819   6.751
  220    HE   ARG  33           HE       ARG  33  -0.220  13.886   5.257
  221   HH11  ARG  33          1HH1      ARG  33  -2.973  13.401   7.332
  222   HH12  ARG  33          2HH1      ARG  33  -3.038  15.053   7.850
  223   HH21  ARG  33          1HH2      ARG  33  -0.295  16.064   5.932
  224   HH22  ARG  33          2HH2      ARG  33  -1.515  16.567   7.053
  225    H    ILE  34           H        ILE  34   1.867   8.142   5.555
  226    HA   ILE  34           HA       ILE  34   4.213   8.747   6.809
  227    HB   ILE  34           HB       ILE  34   4.609   6.418   7.126
  228   HG12  ILE  34          1HG1      ILE  34   2.672   5.850   4.875
  229   HG13  ILE  34          2HG1      ILE  34   4.422   5.824   4.692
  230   HG21  ILE  34          1HG2      ILE  34   1.897   5.785   7.153
  231   HG22  ILE  34          2HG2      ILE  34   2.837   6.493   8.465
  232   HG23  ILE  34          3HG2      ILE  34   1.959   7.536   7.347
  233   HD11  ILE  34          3HD1      ILE  34   2.621   3.844   5.847
  234   HD12  ILE  34          1HD1      ILE  34   4.227   3.652   5.145
  235   HD13  ILE  34          2HD1      ILE  34   4.054   4.168   6.822
  236    H    HIS  35           H        HIS  35   3.764   7.845   3.475
  237    HA   HIS  35           HA       HIS  35   6.592   7.440   3.002
  238    HB2  HIS  35           1HB      HIS  35   4.364   7.654   0.970
  239    HB3  HIS  35           2HB      HIS  35   5.969   6.976   0.716
  240    HD1  HIS  35           HD1      HIS  35   6.362   4.926   2.736
  241    HD2  HIS  35           HD2      HIS  35   2.590   5.640   1.147
  242    HE1  HIS  35           HE1      HIS  35   5.050   2.820   3.145
  243    H    THR  36           H        THR  36   4.176   9.935   2.508
  244    HA   THR  36           HA       THR  36   6.133  11.641   1.157
  245    HB   THR  36           HB       THR  36   3.802  11.439   0.247
  246    HG1  THR  36           HG1      THR  36   4.152  14.118   1.013
  247   HG21  THR  36          3HG2      THR  36   2.038  11.714   1.577
  248   HG22  THR  36          1HG2      THR  36   2.556  13.359   1.947
  249   HG23  THR  36          2HG2      THR  36   3.118  12.013   2.939
  250    H    GLY  37           H        GLY  37   5.928  14.055   1.821
  251    HA2  GLY  37           1HA      GLY  37   5.348  15.453   3.829
  252    HA3  GLY  37           2HA      GLY  37   6.081  14.163   4.770
  253    H    GLU  38           H        GLU  38   8.388  13.736   4.406
  254    HA   GLU  38           HA       GLU  38   9.813  16.201   3.643
  255    HB2  GLU  38           1HB      GLU  38  10.519  14.173   5.770
  256    HB3  GLU  38           2HB      GLU  38  11.553  15.510   5.286
  257    HG2  GLU  38           1HG      GLU  38  10.112  17.108   6.186
  258    HG3  GLU  38           2HG      GLU  38   8.762  15.978   6.265
  259    H    LYS  39           H        LYS  39  10.326  15.673   1.555
  260    HA   LYS  39           HA       LYS  39  10.986  13.370   0.354
  261    HB2  LYS  39           1HB      LYS  39  12.636  14.671  -1.042
  262    HB3  LYS  39           2HB      LYS  39  11.029  15.378  -0.923
  263    HG2  LYS  39           1HG      LYS  39  12.264  17.242  -0.570
  264    HG3  LYS  39           2HG      LYS  39  12.157  16.671   1.097
  265    HD2  LYS  39           1HD      LYS  39  14.338  15.404   0.577
  266    HD3  LYS  39           2HD      LYS  39  14.459  16.478  -0.819
  267    HE2  LYS  39           1HE      LYS  39  15.711  17.438   0.983
  268    HE3  LYS  39           2HE      LYS  39  14.263  18.413   0.733
  269    HZ1  LYS  39           3HZ      LYS  39  14.520  16.306   2.809
  270    HZ2  LYS  39           1HZ      LYS  39  13.233  17.388   2.615
  271    HZ3  LYS  39           2HZ      LYS  39  14.752  17.958   3.093
  272    HA   PRO  40           HA       PRO  40  14.486  11.576   2.325
  273    HB2  PRO  40           1HB      PRO  40  15.435  10.075   0.272
  274    HB3  PRO  40           2HB      PRO  40  13.971   9.658   1.170
  275    HG2  PRO  40           1HG      PRO  40  14.244  11.025  -1.479
  276    HG3  PRO  40           2HG      PRO  40  13.110   9.753  -0.988
  277    HD2  PRO  40           1HD      PRO  40  12.404  12.364  -1.116
  278    HD3  PRO  40           2HD      PRO  40  11.701  11.241   0.066
  279    H    SER  41           H        SER  41  16.898  10.970   1.514
  280    HA   SER  41           HA       SER  41  18.976  11.760   1.030
  281    HB2  SER  41           1HB      SER  41  17.534  13.575  -0.918
  282    HB3  SER  41           2HB      SER  41  19.258  13.205  -0.921
  283    HG   SER  41           HG       SER  41  17.951  11.946  -2.411
  284    H    GLY  42           H        GLY  42  17.817  12.777   3.287
  285    HA2  GLY  42           1HA      GLY  42  19.368  14.843   4.080
  286    HA3  GLY  42           2HA      GLY  42  18.021  15.662   3.304
  287    HA   PRO  43           HA       PRO  43  16.041  13.295   7.011
  288    HB2  PRO  43           1HB      PRO  43  17.711  11.916   8.647
  289    HB3  PRO  43           2HB      PRO  43  16.951  11.196   7.222
  290    HG2  PRO  43           1HG      PRO  43  19.720  12.286   7.544
  291    HG3  PRO  43           2HG      PRO  43  19.189  10.804   6.729
  292    HD2  PRO  43           1HD      PRO  43  19.793  13.072   5.379
  293    HD3  PRO  43           2HD      PRO  43  18.553  11.930   4.821
  294    H    SER  44           H        SER  44  19.168  14.807   7.311
  295    HA   SER  44           HA       SER  44  20.091  16.167   8.914
  296    HB2  SER  44           1HB      SER  44  18.778  18.144   9.340
  297    HB3  SER  44           2HB      SER  44  18.435  17.609   7.695
  298    HG   SER  44           HG       SER  44  16.742  16.425   9.404
  299    H    SER  45           H        SER  45  19.373  13.745  10.048
  300    HA   SER  45           HA       SER  45  18.168  14.483  12.627
  301    HB2  SER  45           1HB      SER  45  18.302  11.946  11.065
  302    HB3  SER  45           2HB      SER  45  18.283  11.826  12.824
  303    HG   SER  45           HG       SER  45  16.365  13.122  12.776
  304    H    GLY  46           H        GLY  46  19.337  14.454  14.456
  305    HA2  GLY  46           1HA      GLY  46  22.146  13.576  14.232
  306    HA3  GLY  46           2HA      GLY  46  21.577  14.845  15.307
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1   2.996 -18.648  -4.895
    2    HA2  GLY   1           1HA      GLY   1   2.719 -18.770  -2.258
    3    HA3  GLY   1           2HA      GLY   1   4.201 -17.831  -2.367
    4    H    SER   2           H        SER   2   4.126 -15.705  -3.042
    5    HA   SER   2           HA       SER   2   1.516 -14.457  -2.824
    6    HB2  SER   2           1HB      SER   2   4.238 -13.175  -3.165
    7    HB3  SER   2           2HB      SER   2   2.744 -12.352  -2.716
    8    HG   SER   2           HG       SER   2   4.283 -14.178  -1.218
    9    H    SER   3           H        SER   3   1.744 -15.990  -5.129
   10    HA   SER   3           HA       SER   3   2.339 -14.206  -7.340
   11    HB2  SER   3           1HB      SER   3   1.774 -16.136  -8.762
   12    HB3  SER   3           2HB      SER   3   2.948 -16.578  -7.522
   13    HG   SER   3           HG       SER   3   0.766 -17.095  -6.354
   14    H    GLY   4           H        GLY   4   0.661 -14.203  -9.183
   15    HA2  GLY   4           1HA      GLY   4  -1.573 -14.003  -9.895
   16    HA3  GLY   4           2HA      GLY   4  -2.096 -14.160  -8.225
   17    H    SER   5           H        SER   5  -2.553 -12.146 -10.493
   18    HA   SER   5           HA       SER   5  -1.435  -9.682  -9.641
   19    HB2  SER   5           1HB      SER   5  -3.762 -10.386 -11.426
   20    HB3  SER   5           2HB      SER   5  -3.336  -8.712 -11.067
   21    HG   SER   5           HG       SER   5  -1.313 -10.436 -11.932
   22    H    SER   6           H        SER   6  -4.754 -10.958  -9.347
   23    HA   SER   6           HA       SER   6  -5.024  -9.454  -6.839
   24    HB2  SER   6           1HB      SER   6  -6.123  -8.218  -8.732
   25    HB3  SER   6           2HB      SER   6  -7.198  -9.600  -8.939
   26    HG   SER   6           HG       SER   6  -7.917  -9.264  -6.796
   27    H    GLY   7           H        GLY   7  -4.643 -11.507  -5.833
   28    HA2  GLY   7           1HA      GLY   7  -7.107 -13.057  -5.590
   29    HA3  GLY   7           2HA      GLY   7  -5.668 -13.929  -6.097
   30    H    SER   8           H        SER   8  -3.685 -13.056  -4.583
   31    HA   SER   8           HA       SER   8  -4.162 -14.261  -2.080
   32    HB2  SER   8           1HB      SER   8  -1.888 -13.665  -1.536
   33    HB3  SER   8           2HB      SER   8  -1.939 -14.137  -3.235
   34    HG   SER   8           HG       SER   8  -2.009 -11.899  -3.756
   35    H    SER   9           H        SER   9  -3.854 -10.870  -3.055
   36    HA   SER   9           HA       SER   9  -5.101 -10.109  -0.501
   37    HB2  SER   9           1HB      SER   9  -3.676  -8.086  -0.446
   38    HB3  SER   9           2HB      SER   9  -2.723  -9.567  -0.350
   39    HG   SER   9           HG       SER   9  -2.857  -9.107  -2.874
   40    H    THR  10           H        THR  10  -7.110  -9.920  -1.507
   41    HA   THR  10           HA       THR  10  -7.370  -8.033  -3.722
   42    HB   THR  10           HB       THR  10  -9.464  -9.779  -2.412
   43    HG1  THR  10           HG1      THR  10  -9.197 -10.745  -4.676
   44   HG21  THR  10          3HG2      THR  10  -9.609  -7.632  -4.395
   45   HG22  THR  10          1HG2      THR  10 -10.885  -8.362  -3.422
   46   HG23  THR  10          2HG2      THR  10 -10.366  -9.136  -4.918
   47    H    LYS  11           H        LYS  11  -6.909  -6.106  -2.573
   48    HA   LYS  11           HA       LYS  11  -8.976  -5.298  -0.637
   49    HB2  LYS  11           1HB      LYS  11  -6.385  -5.317  -0.110
   50    HB3  LYS  11           2HB      LYS  11  -6.425  -3.777  -0.960
   51    HG2  LYS  11           1HG      LYS  11  -6.687  -3.171   1.258
   52    HG3  LYS  11           2HG      LYS  11  -8.343  -3.181   0.647
   53    HD2  LYS  11           1HD      LYS  11  -8.269  -5.685   1.473
   54    HD3  LYS  11           2HD      LYS  11  -6.991  -5.063   2.520
   55    HE2  LYS  11           1HE      LYS  11  -9.010  -4.891   3.746
   56    HE3  LYS  11           2HE      LYS  11  -8.601  -3.258   3.223
   57    HZ1  LYS  11           3HZ      LYS  11 -10.620  -5.056   1.995
   58    HZ2  LYS  11           1HZ      LYS  11 -10.166  -3.554   1.361
   59    HZ3  LYS  11           2HZ      LYS  11 -10.923  -3.640   2.871
   60    H    SER  12           H        SER  12 -10.088  -3.398  -0.924
   61    HA   SER  12           HA       SER  12 -10.383  -2.466  -3.590
   62    HB2  SER  12           1HB      SER  12 -11.570  -1.774  -0.942
   63    HB3  SER  12           2HB      SER  12 -11.738  -0.606  -2.253
   64    HG   SER  12           HG       SER  12 -13.464  -1.921  -2.468
   65    H    HIS  13           H        HIS  13  -9.028  -0.987  -0.656
   66    HA   HIS  13           HA       HIS  13  -7.761   1.051  -2.365
   67    HB2  HIS  13           1HB      HIS  13  -8.133   1.319   0.609
   68    HB3  HIS  13           2HB      HIS  13  -7.849   2.587  -0.580
   69    HD1  HIS  13           HD1      HIS  13  -9.974   2.687  -2.436
   70    HD2  HIS  13           HD2      HIS  13 -10.709   1.245   1.391
   71    HE1  HIS  13           HE1      HIS  13 -12.459   2.890  -2.107
   72    H    GLN  14           H        GLN  14  -5.874  -0.009  -2.871
   73    HA   GLN  14           HA       GLN  14  -4.178  -0.853  -0.621
   74    HB2  GLN  14           1HB      GLN  14  -4.594  -2.641  -2.197
   75    HB3  GLN  14           2HB      GLN  14  -4.094  -1.623  -3.541
   76    HG2  GLN  14           1HG      GLN  14  -1.822  -1.548  -2.626
   77    HG3  GLN  14           2HG      GLN  14  -2.331  -2.602  -1.307
   78   HE21  GLN  14          1HE2      GLN  14  -1.773  -4.627  -1.581
   79   HE22  GLN  14          2HE2      GLN  14  -1.637  -5.459  -3.089
   80    H    CYS  15           H        CYS  15  -2.123  -0.054  -0.383
   81    HA   CYS  15           HA       CYS  15  -1.612   2.518  -1.525
   82    HB2  CYS  15           1HB      CYS  15  -0.986   1.787   0.816
   83    HB3  CYS  15           2HB      CYS  15   0.305   0.835   0.091
   84    H    HIS  16           H        HIS  16   0.480   3.077  -2.552
   85    HA   HIS  16           HA       HIS  16   1.264   0.982  -4.466
   86    HB2  HIS  16           1HB      HIS  16   0.158   3.209  -5.233
   87    HB3  HIS  16           2HB      HIS  16   1.741   3.913  -4.914
   88    HD1  HIS  16           HD1      HIS  16   3.693   2.076  -6.107
   89    HD2  HIS  16           HD2      HIS  16  -0.007   2.737  -7.878
   90    HE1  HIS  16           HE1      HIS  16   3.981   1.443  -8.524
   91    H    GLU  17           H        GLU  17   2.389   3.219  -2.072
   92    HA   GLU  17           HA       GLU  17   5.150   3.139  -2.777
   93    HB2  GLU  17           1HB      GLU  17   4.042   3.733  -0.037
   94    HB3  GLU  17           2HB      GLU  17   5.551   4.300  -0.739
   95    HG2  GLU  17           1HG      GLU  17   2.798   5.077  -1.675
   96    HG3  GLU  17           2HG      GLU  17   3.839   6.050  -0.637
   97    H    CYS  18           H        CYS  18   3.175   1.432  -0.373
   98    HA   CYS  18           HA       CYS  18   5.402  -0.463  -0.005
   99    HB2  CYS  18           1HB      CYS  18   4.388  -0.983   2.199
  100    HB3  CYS  18           2HB      CYS  18   4.889   0.699   2.062
  101    H    GLY  19           H        GLY  19   1.888  -0.155  -0.323
  102    HA2  GLY  19           1HA      GLY  19   0.666  -1.649  -1.754
  103    HA3  GLY  19           2HA      GLY  19   1.842  -2.901  -1.384
  104    H    ARG  20           H        ARG  20   0.402  -0.820   1.041
  105    HA   ARG  20           HA       ARG  20  -0.506  -3.104   2.524
  106    HB2  ARG  20           1HB      ARG  20  -0.380  -0.166   2.965
  107    HB3  ARG  20           2HB      ARG  20  -1.562  -1.070   3.902
  108    HG2  ARG  20           1HG      ARG  20   0.557  -2.620   4.333
  109    HG3  ARG  20           2HG      ARG  20   1.391  -1.092   4.039
  110    HD2  ARG  20           1HD      ARG  20   0.288  -0.030   5.830
  111    HD3  ARG  20           2HD      ARG  20  -0.908  -1.320   5.960
  112    HE   ARG  20           HE       ARG  20   0.610  -2.583   7.163
  113   HH11  ARG  20          1HH1      ARG  20   2.138   0.279   5.901
  114   HH12  ARG  20          2HH1      ARG  20   3.563   0.103   6.870
  115   HH21  ARG  20          1HH2      ARG  20   2.482  -2.825   8.444
  116   HH22  ARG  20          2HH2      ARG  20   3.758  -1.663   8.315
  117    H    GLY  21           H        GLY  21  -2.778  -3.052   3.488
  118    HA2  GLY  21           1HA      GLY  21  -4.709  -2.342   1.365
  119    HA3  GLY  21           2HA      GLY  21  -4.809  -3.842   2.276
  120    H    PHE  22           H        PHE  22  -6.470  -1.223   1.933
  121    HA   PHE  22           HA       PHE  22  -7.164  -1.045   4.781
  122    HB2  PHE  22           1HB      PHE  22  -6.950   1.308   2.891
  123    HB3  PHE  22           2HB      PHE  22  -7.535   1.380   4.550
  124    HD1  PHE  22           HD2      PHE  22  -4.595   0.993   2.409
  125    HD2  PHE  22           HD1      PHE  22  -6.015   1.243   6.414
  126    HE1  PHE  22           HE2      PHE  22  -2.294   1.358   3.199
  127    HE2  PHE  22           HE1      PHE  22  -3.716   1.609   7.210
  128    HZ   PHE  22           HZ       PHE  22  -1.851   1.666   5.602
  129    H    THR  23           H        THR  23  -9.318  -0.952   5.229
  130    HA   THR  23           HA       THR  23 -11.128  -1.767   3.184
  131    HB   THR  23           HB       THR  23 -11.748  -0.859   6.001
  132    HG1  THR  23           HG1      THR  23 -11.962  -3.453   5.814
  133   HG21  THR  23          3HG2      THR  23 -13.895  -1.527   5.704
  134   HG22  THR  23          1HG2      THR  23 -13.454  -2.814   4.583
  135   HG23  THR  23          2HG2      THR  23 -13.544  -1.146   4.018
  136    H    LEU  24           H        LEU  24 -10.726   1.222   5.059
  137    HA   LEU  24           HA       LEU  24 -12.734   2.546   3.401
  138    HB2  LEU  24           1HB      LEU  24 -11.368   3.198   5.976
  139    HB3  LEU  24           2HB      LEU  24 -12.106   4.488   5.028
  140    HG   LEU  24           HG       LEU  24 -13.625   2.060   5.960
  141   HD11  LEU  24          1HD1      LEU  24 -14.305   4.441   7.385
  142   HD12  LEU  24          2HD1      LEU  24 -12.581   4.118   7.570
  143   HD13  LEU  24          3HD1      LEU  24 -13.762   2.884   8.011
  144   HD21  LEU  24          3HD2      LEU  24 -14.402   3.566   4.018
  145   HD22  LEU  24          1HD2      LEU  24 -14.723   4.762   5.275
  146   HD23  LEU  24          2HD2      LEU  24 -15.545   3.202   5.312
  147    H    LYS  25           H        LYS  25 -12.255   3.961   1.837
  148    HA   LYS  25           HA       LYS  25  -9.748   4.154   0.692
  149    HB2  LYS  25           1HB      LYS  25 -11.694   4.750  -0.574
  150    HB3  LYS  25           2HB      LYS  25 -12.101   6.040   0.550
  151    HG2  LYS  25           1HG      LYS  25 -11.197   7.102  -1.335
  152    HG3  LYS  25           2HG      LYS  25  -9.917   7.130  -0.119
  153    HD2  LYS  25           1HD      LYS  25  -8.816   6.480  -2.072
  154    HD3  LYS  25           2HD      LYS  25  -9.100   4.958  -1.225
  155    HE2  LYS  25           1HE      LYS  25  -9.710   4.516  -3.441
  156    HE3  LYS  25           2HE      LYS  25 -11.241   4.793  -2.611
  157    HZ1  LYS  25           3HZ      LYS  25 -10.075   6.236  -4.774
  158    HZ2  LYS  25           1HZ      LYS  25 -10.461   7.267  -3.489
  159    HZ3  LYS  25           2HZ      LYS  25 -11.657   6.289  -4.177
  160    H    SER  26           H        SER  26 -11.274   6.288   3.060
  161    HA   SER  26           HA       SER  26  -9.411   8.352   3.074
  162    HB2  SER  26           1HB      SER  26 -10.188   8.782   5.404
  163    HB3  SER  26           2HB      SER  26 -11.515   8.548   4.267
  164    HG   SER  26           HG       SER  26 -11.797   7.371   6.225
  165    H    HIS  27           H        HIS  27  -9.449   5.346   4.962
  166    HA   HIS  27           HA       HIS  27  -7.280   5.731   6.597
  167    HB2  HIS  27           1HB      HIS  27  -8.278   3.247   5.214
  168    HB3  HIS  27           2HB      HIS  27  -6.925   3.203   6.340
  169    HD1  HIS  27           HD1      HIS  27  -9.594   1.712   6.888
  170    HD2  HIS  27           HD2      HIS  27  -8.645   5.487   8.341
  171    HE1  HIS  27           HE1      HIS  27 -11.028   2.027   8.930
  172    H    LEU  28           H        LEU  28  -7.092   4.020   3.469
  173    HA   LEU  28           HA       LEU  28  -4.357   3.853   3.261
  174    HB2  LEU  28           1HB      LEU  28  -5.706   2.699   1.697
  175    HB3  LEU  28           2HB      LEU  28  -6.466   4.191   1.146
  176    HG   LEU  28           HG       LEU  28  -4.292   4.868   0.152
  177   HD11  LEU  28          1HD1      LEU  28  -3.050   3.225   1.748
  178   HD12  LEU  28          2HD1      LEU  28  -2.429   3.517   0.124
  179   HD13  LEU  28          3HD1      LEU  28  -3.352   2.053   0.464
  180   HD21  LEU  28          3HD2      LEU  28  -5.619   4.045  -1.499
  181   HD22  LEU  28          1HD2      LEU  28  -5.854   2.494  -0.693
  182   HD23  LEU  28          2HD2      LEU  28  -4.347   2.823  -1.546
  183    H    ASN  29           H        ASN  29  -6.383   6.412   1.817
  184    HA   ASN  29           HA       ASN  29  -4.523   8.039   0.720
  185    HB2  ASN  29           1HB      ASN  29  -7.092   8.583   2.129
  186    HB3  ASN  29           2HB      ASN  29  -6.064   9.959   1.742
  187   HD21  ASN  29          1HD2      ASN  29  -8.636   8.393   0.692
  188   HD22  ASN  29          2HD2      ASN  29  -8.472   8.588  -1.016
  189    H    GLN  30           H        GLN  30  -5.631   8.474   4.086
  190    HA   GLN  30           HA       GLN  30  -3.670  10.315   4.822
  191    HB2  GLN  30           1HB      GLN  30  -5.664   9.958   6.163
  192    HB3  GLN  30           2HB      GLN  30  -5.160   8.313   6.527
  193    HG2  GLN  30           1HG      GLN  30  -3.186   9.219   7.702
  194    HG3  GLN  30           2HG      GLN  30  -3.797  10.847   7.409
  195   HE21  GLN  30          1HE2      GLN  30  -5.145  11.700   8.842
  196   HE22  GLN  30          2HE2      GLN  30  -5.920  10.842  10.125
  197    H    HIS  31           H        HIS  31  -3.644   6.796   4.866
  198    HA   HIS  31           HA       HIS  31  -1.308   6.406   6.359
  199    HB2  HIS  31           1HB      HIS  31  -2.408   4.419   6.055
  200    HB3  HIS  31           2HB      HIS  31  -2.863   4.800   4.397
  201    HD1  HIS  31           HD1      HIS  31  -0.222   3.160   6.423
  202    HD2  HIS  31           HD2      HIS  31  -0.908   4.158   2.449
  203    HE1  HIS  31           HE1      HIS  31   1.489   1.875   5.103
  204    H    GLN  32           H        GLN  32  -1.784   6.938   2.895
  205    HA   GLN  32           HA       GLN  32   0.745   6.437   1.936
  206    HB2  GLN  32           1HB      GLN  32  -1.299   8.494   1.128
  207    HB3  GLN  32           2HB      GLN  32   0.215   8.298   0.256
  208    HG2  GLN  32           1HG      GLN  32  -0.407   5.879  -0.050
  209    HG3  GLN  32           2HG      GLN  32  -2.001   6.298   0.576
  210   HE21  GLN  32          1HE2      GLN  32  -2.386   5.348  -1.680
  211   HE22  GLN  32          2HE2      GLN  32  -2.500   6.495  -2.966
  212    H    ARG  33           H        ARG  33  -0.214   8.857   4.132
  213    HA   ARG  33           HA       ARG  33   1.658  10.878   3.586
  214    HB2  ARG  33           1HB      ARG  33   0.305  10.042   6.152
  215    HB3  ARG  33           2HB      ARG  33   1.340  11.459   6.031
  216    HG2  ARG  33           1HG      ARG  33  -0.145  12.512   4.499
  217    HG3  ARG  33           2HG      ARG  33  -1.101  11.038   4.326
  218    HD2  ARG  33           1HD      ARG  33  -1.518  11.234   6.841
  219    HD3  ARG  33           2HD      ARG  33  -0.898  12.877   6.691
  220    HE   ARG  33           HE       ARG  33  -2.923  12.413   4.774
  221   HH11  ARG  33          1HH1      ARG  33  -2.453  12.945   8.182
  222   HH12  ARG  33          2HH1      ARG  33  -4.017  13.651   8.421
  223   HH21  ARG  33          1HH2      ARG  33  -4.986  13.340   5.076
  224   HH22  ARG  33          2HH2      ARG  33  -5.457  13.874   6.653
  225    H    ILE  34           H        ILE  34   1.928   7.836   5.284
  226    HA   ILE  34           HA       ILE  34   4.328   8.314   6.665
  227    HB   ILE  34           HB       ILE  34   4.499   5.980   6.987
  228   HG12  ILE  34          1HG1      ILE  34   2.569   5.559   4.698
  229   HG13  ILE  34          2HG1      ILE  34   4.316   5.405   4.552
  230   HG21  ILE  34          1HG2      ILE  34   1.881   7.241   7.104
  231   HG22  ILE  34          2HG2      ILE  34   1.790   5.483   7.024
  232   HG23  ILE  34          3HG2      ILE  34   2.720   6.259   8.305
  233   HD11  ILE  34          3HD1      ILE  34   4.149   3.671   6.404
  234   HD12  ILE  34          1HD1      ILE  34   2.413   3.688   6.101
  235   HD13  ILE  34          2HD1      ILE  34   3.528   3.225   4.815
  236    H    HIS  35           H        HIS  35   3.769   8.229   3.376
  237    HA   HIS  35           HA       HIS  35   6.560   7.476   2.804
  238    HB2  HIS  35           1HB      HIS  35   4.239   7.493   0.867
  239    HB3  HIS  35           2HB      HIS  35   5.864   6.884   0.564
  240    HD1  HIS  35           HD1      HIS  35   6.516   4.851   2.405
  241    HD2  HIS  35           HD2      HIS  35   2.521   5.508   1.471
  242    HE1  HIS  35           HE1      HIS  35   5.321   2.731   3.038
  243    H    THR  36           H        THR  36   5.254  10.113   3.604
  244    HA   THR  36           HA       THR  36   6.085  11.712   1.275
  245    HB   THR  36           HB       THR  36   4.762  13.541   2.163
  246    HG1  THR  36           HG1      THR  36   5.085  12.462   4.454
  247   HG21  THR  36          3HG2      THR  36   3.467  10.873   1.822
  248   HG22  THR  36          1HG2      THR  36   3.383  12.303   0.793
  249   HG23  THR  36          2HG2      THR  36   2.476  12.250   2.305
  250    H    GLY  37           H        GLY  37   6.850  10.894   4.515
  251    HA2  GLY  37           1HA      GLY  37   8.249  13.239   5.275
  252    HA3  GLY  37           2HA      GLY  37   8.449  11.644   5.985
  253    H    GLU  38           H        GLU  38   9.758  10.081   4.654
  254    HA   GLU  38           HA       GLU  38  12.327  11.012   4.279
  255    HB2  GLU  38           1HB      GLU  38  12.738   8.899   3.032
  256    HB3  GLU  38           2HB      GLU  38  11.895   8.658   4.556
  257    HG2  GLU  38           1HG      GLU  38   9.766   8.804   3.026
  258    HG3  GLU  38           2HG      GLU  38  10.912   8.337   1.771
  259    H    LYS  39           H        LYS  39  12.759  12.693   2.974
  260    HA   LYS  39           HA       LYS  39  11.800  12.572   0.193
  261    HB2  LYS  39           1HB      LYS  39  12.357  14.825   2.065
  262    HB3  LYS  39           2HB      LYS  39  12.640  15.090   0.349
  263    HG2  LYS  39           1HG      LYS  39  10.038  13.986   1.336
  264    HG3  LYS  39           2HG      LYS  39  10.357  15.722   1.323
  265    HD2  LYS  39           1HD      LYS  39  10.716  13.998  -1.116
  266    HD3  LYS  39           2HD      LYS  39   9.173  14.754  -0.712
  267    HE2  LYS  39           1HE      LYS  39  11.770  16.246  -1.057
  268    HE3  LYS  39           2HE      LYS  39  10.551  16.064  -2.317
  269    HZ1  LYS  39           3HZ      LYS  39   9.594  17.088   0.225
  270    HZ2  LYS  39           1HZ      LYS  39   9.204  17.562  -1.352
  271    HZ3  LYS  39           2HZ      LYS  39  10.629  18.117  -0.631
  272    HA   PRO  40           HA       PRO  40  16.370  11.736   0.054
  273    HB2  PRO  40           1HB      PRO  40  16.182   9.701  -1.732
  274    HB3  PRO  40           2HB      PRO  40  16.035   9.464   0.013
  275    HG2  PRO  40           1HG      PRO  40  13.883   9.686  -2.056
  276    HG3  PRO  40           2HG      PRO  40  14.010   8.562  -0.690
  277    HD2  PRO  40           1HD      PRO  40  12.444  10.770  -0.619
  278    HD3  PRO  40           2HD      PRO  40  13.245  10.121   0.826
  279    H    SER  41           H        SER  41  14.097  11.499  -2.689
  280    HA   SER  41           HA       SER  41  15.336  13.688  -4.054
  281    HB2  SER  41           1HB      SER  41  16.241  12.520  -5.944
  282    HB3  SER  41           2HB      SER  41  16.922  11.774  -4.498
  283    HG   SER  41           HG       SER  41  15.830   9.989  -4.885
  284    H    GLY  42           H        GLY  42  14.396  13.843  -6.371
  285    HA2  GLY  42           1HA      GLY  42  11.575  13.862  -6.141
  286    HA3  GLY  42           2HA      GLY  42  12.490  14.189  -7.606
  287    HA   PRO  43           HA       PRO  43  10.492   9.791  -7.418
  288    HB2  PRO  43           1HB      PRO  43   7.934  10.279  -8.186
  289    HB3  PRO  43           2HB      PRO  43   8.432  10.215  -6.492
  290    HG2  PRO  43           1HG      PRO  43   7.988  12.599  -8.247
  291    HG3  PRO  43           2HG      PRO  43   7.502  12.346  -6.561
  292    HD2  PRO  43           1HD      PRO  43   9.678  13.804  -7.246
  293    HD3  PRO  43           2HD      PRO  43   9.599  12.854  -5.748
  294    H    SER  44           H        SER  44  11.625   9.243  -9.230
  295    HA   SER  44           HA       SER  44  11.226  10.528 -11.757
  296    HB2  SER  44           1HB      SER  44  12.688   7.977 -11.036
  297    HB3  SER  44           2HB      SER  44  12.735   8.748 -12.621
  298    HG   SER  44           HG       SER  44  13.598  10.617 -11.546
  299    H    SER  45           H        SER  45  10.492   9.458 -13.703
  300    HA   SER  45           HA       SER  45   8.969   8.304 -14.937
  301    HB2  SER  45           1HB      SER  45   9.192   6.317 -12.664
  302    HB3  SER  45           2HB      SER  45   8.368   6.005 -14.192
  303    HG   SER  45           HG       SER  45  10.952   6.951 -14.417
  304    H    GLY  46           H        GLY  46   8.006  10.358 -13.335
  305    HA2  GLY  46           1HA      GLY  46   5.550  10.789 -13.406
  306    HA3  GLY  46           2HA      GLY  46   5.379   9.299 -12.491
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1   6.248 -19.943   2.284
    2    HA2  GLY   1           1HA      GLY   1   4.150 -21.162   2.057
    3    HA3  GLY   1           2HA      GLY   1   5.082 -22.531   1.469
    4    H    SER   2           H        SER   2   5.557 -20.428   4.296
    5    HA   SER   2           HA       SER   2   5.824 -22.818   5.953
    6    HB2  SER   2           1HB      SER   2   7.512 -20.912   6.000
    7    HB3  SER   2           2HB      SER   2   6.271 -19.956   6.811
    8    HG   SER   2           HG       SER   2   7.574 -20.945   8.351
    9    H    SER   3           H        SER   3   4.650 -23.132   7.869
   10    HA   SER   3           HA       SER   3   1.929 -22.643   7.764
   11    HB2  SER   3           1HB      SER   3   1.856 -23.376  10.112
   12    HB3  SER   3           2HB      SER   3   2.931 -24.400   9.161
   13    HG   SER   3           HG       SER   3   3.489 -22.848  11.309
   14    H    GLY   4           H        GLY   4   1.192 -20.598   7.536
   15    HA2  GLY   4           1HA      GLY   4   1.815 -18.726   9.733
   16    HA3  GLY   4           2HA      GLY   4   1.764 -18.187   8.061
   17    H    SER   5           H        SER   5   0.194 -17.138  10.191
   18    HA   SER   5           HA       SER   5  -2.441 -18.217  10.123
   19    HB2  SER   5           1HB      SER   5  -3.083 -16.115  11.269
   20    HB3  SER   5           2HB      SER   5  -1.686 -16.882  12.022
   21    HG   SER   5           HG       SER   5  -1.269 -14.695  11.785
   22    H    SER   6           H        SER   6  -0.862 -15.493   8.495
   23    HA   SER   6           HA       SER   6  -2.885 -14.227   7.239
   24    HB2  SER   6           1HB      SER   6  -1.368 -13.610   5.500
   25    HB3  SER   6           2HB      SER   6  -0.399 -13.807   6.961
   26    HG   SER   6           HG       SER   6  -0.218 -16.107   6.046
   27    H    GLY   7           H        GLY   7  -4.275 -14.539   5.555
   28    HA2  GLY   7           1HA      GLY   7  -4.317 -17.262   4.410
   29    HA3  GLY   7           2HA      GLY   7  -5.760 -16.317   4.745
   30    H    SER   8           H        SER   8  -6.605 -16.220   2.717
   31    HA   SER   8           HA       SER   8  -5.007 -14.752   0.726
   32    HB2  SER   8           1HB      SER   8  -5.124 -17.084   0.025
   33    HB3  SER   8           2HB      SER   8  -6.878 -17.076   0.206
   34    HG   SER   8           HG       SER   8  -5.348 -15.553  -1.638
   35    H    SER   9           H        SER   9  -5.908 -12.783   0.761
   36    HA   SER   9           HA       SER   9  -8.703 -12.546  -0.004
   37    HB2  SER   9           1HB      SER   9  -9.392 -11.199   1.805
   38    HB3  SER   9           2HB      SER   9  -8.503 -12.520   2.563
   39    HG   SER   9           HG       SER   9  -7.700  -9.847   2.154
   40    H    THR  10           H        THR  10  -9.258 -10.173  -0.387
   41    HA   THR  10           HA       THR  10  -6.896  -8.704  -1.353
   42    HB   THR  10           HB       THR  10  -8.017  -9.779  -3.265
   43    HG1  THR  10           HG1      THR  10  -8.659  -7.047  -3.484
   44   HG21  THR  10          3HG2      THR  10 -10.242 -10.006  -3.136
   45   HG22  THR  10          1HG2      THR  10 -10.329  -8.324  -3.658
   46   HG23  THR  10          2HG2      THR  10 -10.386  -8.718  -1.940
   47    H    LYS  11           H        LYS  11  -7.111  -6.420  -1.451
   48    HA   LYS  11           HA       LYS  11  -9.226  -5.379   0.313
   49    HB2  LYS  11           1HB      LYS  11  -6.617  -5.219   0.807
   50    HB3  LYS  11           2HB      LYS  11  -6.752  -3.811  -0.238
   51    HG2  LYS  11           1HG      LYS  11  -7.173  -2.767   1.708
   52    HG3  LYS  11           2HG      LYS  11  -8.815  -3.342   1.410
   53    HD2  LYS  11           1HD      LYS  11  -6.980  -5.187   2.826
   54    HD3  LYS  11           2HD      LYS  11  -7.526  -3.762   3.714
   55    HE2  LYS  11           1HE      LYS  11  -9.440  -5.566   2.262
   56    HE3  LYS  11           2HE      LYS  11  -8.923  -5.895   3.915
   57    HZ1  LYS  11           3HZ      LYS  11 -10.782  -4.662   4.298
   58    HZ2  LYS  11           1HZ      LYS  11 -10.617  -3.736   2.891
   59    HZ3  LYS  11           2HZ      LYS  11  -9.644  -3.412   4.236
   60    H    SER  12           H        SER  12 -10.155  -3.329  -0.174
   61    HA   SER  12           HA       SER  12 -10.698  -2.965  -2.943
   62    HB2  SER  12           1HB      SER  12 -11.353  -1.047  -0.699
   63    HB3  SER  12           2HB      SER  12 -12.169  -1.192  -2.256
   64    HG   SER  12           HG       SER  12 -13.306  -2.785  -1.491
   65    H    HIS  13           H        HIS  13  -9.117  -0.850  -0.546
   66    HA   HIS  13           HA       HIS  13  -7.801   0.549  -2.777
   67    HB2  HIS  13           1HB      HIS  13  -8.092   1.583   0.043
   68    HB3  HIS  13           2HB      HIS  13  -7.650   2.490  -1.400
   69    HD1  HIS  13           HD1      HIS  13  -9.653   2.698  -3.232
   70    HD2  HIS  13           HD2      HIS  13 -10.742   1.642   0.636
   71    HE1  HIS  13           HE1      HIS  13 -12.121   3.154  -3.081
   72    H    GLN  14           H        GLN  14  -5.841  -0.286  -3.107
   73    HA   GLN  14           HA       GLN  14  -4.199  -0.981  -0.766
   74    HB2  GLN  14           1HB      GLN  14  -4.559  -2.865  -2.242
   75    HB3  GLN  14           2HB      GLN  14  -4.030  -1.925  -3.631
   76    HG2  GLN  14           1HG      GLN  14  -1.811  -2.035  -3.034
   77    HG3  GLN  14           2HG      GLN  14  -2.174  -2.321  -1.333
   78   HE21  GLN  14          1HE2      GLN  14  -0.335  -3.898  -2.286
   79   HE22  GLN  14          2HE2      GLN  14  -0.928  -5.487  -2.617
   80    H    CYS  15           H        CYS  15  -2.181  -0.120  -0.504
   81    HA   CYS  15           HA       CYS  15  -1.655   2.373  -1.791
   82    HB2  CYS  15           1HB      CYS  15  -1.080   1.895   0.583
   83    HB3  CYS  15           2HB      CYS  15   0.153   0.769   0.027
   84    H    HIS  16           H        HIS  16   0.473   2.891  -2.781
   85    HA   HIS  16           HA       HIS  16   1.315   0.702  -4.560
   86    HB2  HIS  16           1HB      HIS  16   0.300   2.524  -5.788
   87    HB3  HIS  16           2HB      HIS  16   1.348   3.694  -4.993
   88    HD1  HIS  16           HD1      HIS  16   1.443   0.937  -7.558
   89    HD2  HIS  16           HD2      HIS  16   3.833   4.028  -6.144
   90    HE1  HIS  16           HE1      HIS  16   3.372   1.084  -9.164
   91    H    GLU  17           H        GLU  17   2.375   3.106  -2.289
   92    HA   GLU  17           HA       GLU  17   5.142   3.029  -2.897
   93    HB2  GLU  17           1HB      GLU  17   3.937   3.647  -0.202
   94    HB3  GLU  17           2HB      GLU  17   5.473   4.208  -0.845
   95    HG2  GLU  17           1HG      GLU  17   2.750   4.975  -1.872
   96    HG3  GLU  17           2HG      GLU  17   3.795   5.969  -0.858
   97    H    CYS  18           H        CYS  18   3.136   1.288  -0.550
   98    HA   CYS  18           HA       CYS  18   5.381  -0.579  -0.144
   99    HB2  CYS  18           1HB      CYS  18   4.439  -1.031   2.102
  100    HB3  CYS  18           2HB      CYS  18   4.936   0.647   1.905
  101    H    GLY  19           H        GLY  19   1.866  -0.241  -0.381
  102    HA2  GLY  19           1HA      GLY  19   0.596  -1.764  -1.740
  103    HA3  GLY  19           2HA      GLY  19   1.762  -3.020  -1.350
  104    H    ARG  20           H        ARG  20   0.388  -0.832   1.022
  105    HA   ARG  20           HA       ARG  20  -0.507  -3.044   2.615
  106    HB2  ARG  20           1HB      ARG  20  -0.361  -0.092   2.923
  107    HB3  ARG  20           2HB      ARG  20  -1.544  -0.941   3.909
  108    HG2  ARG  20           1HG      ARG  20   0.490  -2.487   4.478
  109    HG3  ARG  20           2HG      ARG  20   1.428  -1.081   3.970
  110    HD2  ARG  20           1HD      ARG  20   1.196  -0.580   6.179
  111    HD3  ARG  20           2HD      ARG  20  -0.280   0.166   5.567
  112    HE   ARG  20           HE       ARG  20  -1.525  -1.487   6.601
  113   HH11  ARG  20          1HH1      ARG  20   1.874  -2.213   6.806
  114   HH12  ARG  20          2HH1      ARG  20   1.667  -3.473   7.977
  115   HH21  ARG  20          1HH2      ARG  20  -1.810  -3.144   8.143
  116   HH22  ARG  20          2HH2      ARG  20  -0.429  -4.002   8.736
  117    H    GLY  21           H        GLY  21  -2.770  -2.910   3.624
  118    HA2  GLY  21           1HA      GLY  21  -4.729  -2.309   1.494
  119    HA3  GLY  21           2HA      GLY  21  -4.819  -3.762   2.478
  120    H    PHE  22           H        PHE  22  -6.399  -1.064   2.032
  121    HA   PHE  22           HA       PHE  22  -7.092  -0.790   4.875
  122    HB2  PHE  22           1HB      PHE  22  -6.886   1.500   2.909
  123    HB3  PHE  22           2HB      PHE  22  -7.379   1.622   4.595
  124    HD1  PHE  22           HD2      PHE  22  -4.568   1.126   2.309
  125    HD2  PHE  22           HD1      PHE  22  -5.764   1.495   6.377
  126    HE1  PHE  22           HE2      PHE  22  -2.221   1.460   2.964
  127    HE2  PHE  22           HE1      PHE  22  -3.418   1.831   7.039
  128    HZ   PHE  22           HZ       PHE  22  -1.643   1.813   5.332
  129    H    THR  23           H        THR  23  -9.188  -1.061   5.268
  130    HA   THR  23           HA       THR  23 -11.034  -1.826   3.342
  131    HB   THR  23           HB       THR  23 -11.655  -0.594   6.033
  132    HG1  THR  23           HG1      THR  23 -10.361  -2.384   6.352
  133   HG21  THR  23          3HG2      THR  23 -13.383  -2.677   4.856
  134   HG22  THR  23          1HG2      THR  23 -13.437  -1.099   4.071
  135   HG23  THR  23          2HG2      THR  23 -13.810  -1.244   5.789
  136    H    LEU  24           H        LEU  24 -10.939   1.289   5.085
  137    HA   LEU  24           HA       LEU  24 -12.765   2.456   3.156
  138    HB2  LEU  24           1HB      LEU  24 -11.487   3.439   5.688
  139    HB3  LEU  24           2HB      LEU  24 -12.372   4.523   4.616
  140    HG   LEU  24           HG       LEU  24 -13.552   2.082   5.938
  141   HD11  LEU  24          1HD1      LEU  24 -14.595   3.546   7.499
  142   HD12  LEU  24          2HD1      LEU  24 -13.971   4.972   6.670
  143   HD13  LEU  24          3HD1      LEU  24 -12.866   3.893   7.521
  144   HD21  LEU  24          3HD2      LEU  24 -15.667   3.487   5.304
  145   HD22  LEU  24          1HD2      LEU  24 -14.895   2.444   4.110
  146   HD23  LEU  24          2HD2      LEU  24 -14.590   4.181   4.091
  147    H    LYS  25           H        LYS  25 -12.294   4.219   1.824
  148    HA   LYS  25           HA       LYS  25  -9.756   4.203   0.607
  149    HB2  LYS  25           1HB      LYS  25 -11.822   4.867  -0.561
  150    HB3  LYS  25           2HB      LYS  25 -11.923   6.307   0.444
  151    HG2  LYS  25           1HG      LYS  25 -11.014   7.053  -1.569
  152    HG3  LYS  25           2HG      LYS  25  -9.628   6.913  -0.484
  153    HD2  LYS  25           1HD      LYS  25  -9.262   4.608  -1.460
  154    HD3  LYS  25           2HD      LYS  25 -10.461   5.032  -2.684
  155    HE2  LYS  25           1HE      LYS  25  -9.110   6.687  -3.608
  156    HE3  LYS  25           2HE      LYS  25  -8.114   6.818  -2.159
  157    HZ1  LYS  25           3HZ      LYS  25  -8.066   4.720  -4.237
  158    HZ2  LYS  25           1HZ      LYS  25  -7.418   4.443  -2.699
  159    HZ3  LYS  25           2HZ      LYS  25  -6.791   5.677  -3.671
  160    H    SER  26           H        SER  26 -11.258   6.459   2.890
  161    HA   SER  26           HA       SER  26  -9.257   8.399   2.931
  162    HB2  SER  26           1HB      SER  26 -10.162   9.060   5.109
  163    HB3  SER  26           2HB      SER  26 -11.471   8.688   3.987
  164    HG   SER  26           HG       SER  26 -10.431   6.829   5.858
  165    H    HIS  27           H        HIS  27  -9.514   5.340   4.647
  166    HA   HIS  27           HA       HIS  27  -7.494   5.638   6.521
  167    HB2  HIS  27           1HB      HIS  27  -8.525   3.240   5.026
  168    HB3  HIS  27           2HB      HIS  27  -7.215   3.090   6.192
  169    HD1  HIS  27           HD1      HIS  27  -9.793   1.621   6.760
  170    HD2  HIS  27           HD2      HIS  27  -9.061   5.499   8.058
  171    HE1  HIS  27           HE1      HIS  27 -11.321   1.972   8.726
  172    H    LEU  28           H        LEU  28  -7.203   4.240   3.253
  173    HA   LEU  28           HA       LEU  28  -4.437   3.873   3.284
  174    HB2  LEU  28           1HB      LEU  28  -5.657   2.806   1.583
  175    HB3  LEU  28           2HB      LEU  28  -6.408   4.313   1.064
  176    HG   LEU  28           HG       LEU  28  -4.188   5.056   0.217
  177   HD11  LEU  28          1HD1      LEU  28  -3.390   2.217   0.841
  178   HD12  LEU  28          2HD1      LEU  28  -2.774   3.669   1.630
  179   HD13  LEU  28          3HD1      LEU  28  -2.433   3.381  -0.076
  180   HD21  LEU  28          3HD2      LEU  28  -4.169   3.062  -1.571
  181   HD22  LEU  28          1HD2      LEU  28  -5.389   4.336  -1.559
  182   HD23  LEU  28          2HD2      LEU  28  -5.742   2.770  -0.828
  183    H    ASN  29           H        ASN  29  -6.328   6.606   2.005
  184    HA   ASN  29           HA       ASN  29  -4.311   8.187   1.029
  185    HB2  ASN  29           1HB      ASN  29  -6.786   8.663   0.950
  186    HB3  ASN  29           2HB      ASN  29  -6.660   9.252   2.605
  187   HD21  ASN  29          1HD2      ASN  29  -7.462  10.692   0.239
  188   HD22  ASN  29          2HD2      ASN  29  -6.357  12.009   0.063
  189    H    GLN  30           H        GLN  30  -5.594   8.290   4.355
  190    HA   GLN  30           HA       GLN  30  -3.765  10.150   5.357
  191    HB2  GLN  30           1HB      GLN  30  -5.570   8.108   6.545
  192    HB3  GLN  30           2HB      GLN  30  -4.303   8.759   7.576
  193    HG2  GLN  30           1HG      GLN  30  -5.972  10.223   8.045
  194    HG3  GLN  30           2HG      GLN  30  -5.222  11.056   6.684
  195   HE21  GLN  30          1HE2      GLN  30  -8.059   9.739   7.930
  196   HE22  GLN  30          2HE2      GLN  30  -9.040   9.867   6.514
  197    H    HIS  31           H        HIS  31  -3.538   6.670   4.966
  198    HA   HIS  31           HA       HIS  31  -1.244   6.238   6.538
  199    HB2  HIS  31           1HB      HIS  31  -2.237   4.240   6.011
  200    HB3  HIS  31           2HB      HIS  31  -2.658   4.755   4.381
  201    HD1  HIS  31           HD1      HIS  31   0.174   3.303   6.373
  202    HD2  HIS  31           HD2      HIS  31  -0.791   4.142   2.420
  203    HE1  HIS  31           HE1      HIS  31   1.942   2.165   4.993
  204    H    GLN  32           H        GLN  32  -1.589   6.800   3.040
  205    HA   GLN  32           HA       GLN  32   0.999   6.608   2.207
  206    HB2  GLN  32           1HB      GLN  32  -1.164   8.535   1.387
  207    HB3  GLN  32           2HB      GLN  32   0.401   8.504   0.585
  208    HG2  GLN  32           1HG      GLN  32   0.042   6.413  -0.328
  209    HG3  GLN  32           2HG      GLN  32  -1.190   5.994   0.861
  210   HE21  GLN  32          1HE2      GLN  32  -2.057   5.371  -1.413
  211   HE22  GLN  32          2HE2      GLN  32  -3.097   6.545  -2.138
  212    H    ARG  33           H        ARG  33  -0.363   9.029   4.271
  213    HA   ARG  33           HA       ARG  33   1.338  11.168   3.975
  214    HB2  ARG  33           1HB      ARG  33   0.143  10.015   6.498
  215    HB3  ARG  33           2HB      ARG  33   0.964  11.569   6.434
  216    HG2  ARG  33           1HG      ARG  33  -0.691  12.493   5.022
  217    HG3  ARG  33           2HG      ARG  33  -1.406  10.910   4.711
  218    HD2  ARG  33           1HD      ARG  33  -2.868  11.716   6.277
  219    HD3  ARG  33           2HD      ARG  33  -1.707  10.898   7.323
  220    HE   ARG  33           HE       ARG  33  -1.167  13.697   6.828
  221   HH11  ARG  33          1HH1      ARG  33  -2.689  11.342   8.892
  222   HH12  ARG  33          2HH1      ARG  33  -2.726  12.386  10.274
  223   HH21  ARG  33          1HH2      ARG  33  -1.210  15.080   8.641
  224   HH22  ARG  33          2HH2      ARG  33  -1.886  14.512  10.130
  225    H    ILE  34           H        ILE  34   2.108   8.014   5.023
  226    HA   ILE  34           HA       ILE  34   4.465   8.738   6.517
  227    HB   ILE  34           HB       ILE  34   4.876   6.403   6.765
  228   HG12  ILE  34          1HG1      ILE  34   2.754   5.935   4.659
  229   HG13  ILE  34          2HG1      ILE  34   4.487   5.771   4.403
  230   HG21  ILE  34          1HG2      ILE  34   2.154   7.437   7.135
  231   HG22  ILE  34          2HG2      ILE  34   2.299   5.682   7.193
  232   HG23  ILE  34          3HG2      ILE  34   3.250   6.682   8.291
  233   HD11  ILE  34          3HD1      ILE  34   3.885   3.598   4.756
  234   HD12  ILE  34          1HD1      ILE  34   4.310   4.088   6.396
  235   HD13  ILE  34          2HD1      ILE  34   2.617   4.020   5.907
  236    H    HIS  35           H        HIS  35   3.685   7.781   3.244
  237    HA   HIS  35           HA       HIS  35   6.472   7.468   2.504
  238    HB2  HIS  35           1HB      HIS  35   4.047   7.482   0.700
  239    HB3  HIS  35           2HB      HIS  35   5.651   6.866   0.317
  240    HD1  HIS  35           HD1      HIS  35   6.373   4.867   2.215
  241    HD2  HIS  35           HD2      HIS  35   2.366   5.467   1.298
  242    HE1  HIS  35           HE1      HIS  35   5.205   2.742   2.883
  243    H    THR  36           H        THR  36   3.907   9.832   2.209
  244    HA   THR  36           HA       THR  36   5.566  11.549   0.526
  245    HB   THR  36           HB       THR  36   3.205  11.348  -0.082
  246    HG1  THR  36           HG1      THR  36   3.106  13.432  -0.567
  247   HG21  THR  36          3HG2      THR  36   2.636  12.624   2.596
  248   HG22  THR  36          1HG2      THR  36   2.309  10.943   2.178
  249   HG23  THR  36          2HG2      THR  36   1.449  12.242   1.350
  250    H    GLY  37           H        GLY  37   4.016  11.545   3.716
  251    HA2  GLY  37           1HA      GLY  37   4.274  12.951   5.526
  252    HA3  GLY  37           2HA      GLY  37   5.979  12.811   5.126
  253    H    GLU  38           H        GLU  38   5.812  15.030   6.182
  254    HA   GLU  38           HA       GLU  38   4.869  17.099   4.350
  255    HB2  GLU  38           1HB      GLU  38   4.441  17.122   6.875
  256    HB3  GLU  38           2HB      GLU  38   6.140  17.542   7.045
  257    HG2  GLU  38           1HG      GLU  38   5.861  19.610   6.018
  258    HG3  GLU  38           2HG      GLU  38   4.327  19.143   5.284
  259    H    LYS  39           H        LYS  39   6.418  16.906   2.705
  260    HA   LYS  39           HA       LYS  39   8.943  18.226   3.322
  261    HB2  LYS  39           1HB      LYS  39   8.670  15.446   2.255
  262    HB3  LYS  39           2HB      LYS  39   9.999  16.447   1.684
  263    HG2  LYS  39           1HG      LYS  39  10.928  16.626   3.839
  264    HG3  LYS  39           2HG      LYS  39   9.465  15.999   4.604
  265    HD2  LYS  39           1HD      LYS  39  11.101  14.370   2.675
  266    HD3  LYS  39           2HD      LYS  39  11.438  14.402   4.408
  267    HE2  LYS  39           1HE      LYS  39   8.680  13.807   3.409
  268    HE3  LYS  39           2HE      LYS  39   9.909  12.544   3.434
  269    HZ1  LYS  39           3HZ      LYS  39   8.958  14.118   5.766
  270    HZ2  LYS  39           1HZ      LYS  39  10.212  12.984   5.815
  271    HZ3  LYS  39           2HZ      LYS  39   8.636  12.487   5.456
  272    HA   PRO  40           HA       PRO  40   8.314  20.283  -0.502
  273    HB2  PRO  40           1HB      PRO  40  10.855  20.609  -1.400
  274    HB3  PRO  40           2HB      PRO  40  10.196  21.515  -0.034
  275    HG2  PRO  40           1HG      PRO  40  11.945  19.086  -0.028
  276    HG3  PRO  40           2HG      PRO  40  12.046  20.540   0.982
  277    HD2  PRO  40           1HD      PRO  40  10.952  18.226   1.866
  278    HD3  PRO  40           2HD      PRO  40  10.385  19.819   2.408
  279    H    SER  41           H        SER  41   9.162  17.124  -0.389
  280    HA   SER  41           HA       SER  41  10.224  16.410  -2.822
  281    HB2  SER  41           1HB      SER  41   8.228  15.065  -1.024
  282    HB3  SER  41           2HB      SER  41   8.689  14.324  -2.556
  283    HG   SER  41           HG       SER  41  10.947  14.810  -1.654
  284    H    GLY  42           H        GLY  42   6.742  16.686  -2.080
  285    HA2  GLY  42           1HA      GLY  42   5.751  16.211  -4.623
  286    HA3  GLY  42           2HA      GLY  42   4.957  17.220  -3.423
  287    HA   PRO  43           HA       PRO  43   5.649  20.819  -5.817
  288    HB2  PRO  43           1HB      PRO  43   6.332  22.683  -3.965
  289    HB3  PRO  43           2HB      PRO  43   4.693  22.041  -4.123
  290    HG2  PRO  43           1HG      PRO  43   6.845  21.284  -2.185
  291    HG3  PRO  43           2HG      PRO  43   5.114  21.534  -1.893
  292    HD2  PRO  43           1HD      PRO  43   6.207  19.070  -2.153
  293    HD3  PRO  43           2HD      PRO  43   4.551  19.441  -2.676
  294    H    SER  44           H        SER  44   7.291  21.132  -7.172
  295    HA   SER  44           HA       SER  44   9.856  20.428  -7.047
  296    HB2  SER  44           1HB      SER  44   8.796  21.567  -8.991
  297    HB3  SER  44           2HB      SER  44   8.991  23.109  -8.158
  298    HG   SER  44           HG       SER  44  10.690  22.563  -9.684
  299    H    SER  45           H        SER  45   8.659  23.534  -5.797
  300    HA   SER  45           HA       SER  45  10.998  23.625  -4.020
  301    HB2  SER  45           1HB      SER  45   9.947  25.858  -5.760
  302    HB3  SER  45           2HB      SER  45  10.988  26.149  -4.367
  303    HG   SER  45           HG       SER  45  11.674  25.385  -6.834
  304    H    GLY  46           H        GLY  46  10.620  24.373  -1.972
  305    HA2  GLY  46           1HA      GLY  46   8.420  25.912  -1.156
  306    HA3  GLY  46           2HA      GLY  46   8.004  24.216  -0.954
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1  10.095 -24.215  -9.036
    2    HA2  GLY   1           1HA      GLY   1  10.222 -23.009  -6.510
    3    HA3  GLY   1           2HA      GLY   1  11.484 -22.301  -7.507
    4    H    SER   2           H        SER   2   8.008 -22.837  -7.255
    5    HA   SER   2           HA       SER   2   7.511 -20.836  -9.324
    6    HB2  SER   2           1HB      SER   2   5.734 -22.780  -7.854
    7    HB3  SER   2           2HB      SER   2   5.074 -21.491  -8.860
    8    HG   SER   2           HG       SER   2   5.903 -23.843  -9.651
    9    H    SER   3           H        SER   3   6.558 -21.468  -5.949
   10    HA   SER   3           HA       SER   3   5.551 -20.054  -4.423
   11    HB2  SER   3           1HB      SER   3   7.111 -18.436  -3.609
   12    HB3  SER   3           2HB      SER   3   8.066 -19.774  -4.248
   13    HG   SER   3           HG       SER   3   8.683 -17.537  -4.868
   14    H    GLY   4           H        GLY   4   4.266 -19.732  -6.864
   15    HA2  GLY   4           1HA      GLY   4   3.956 -16.814  -7.129
   16    HA3  GLY   4           2HA      GLY   4   3.486 -17.995  -8.342
   17    H    SER   5           H        SER   5   2.644 -16.549  -5.262
   18    HA   SER   5           HA       SER   5  -0.139 -17.363  -5.721
   19    HB2  SER   5           1HB      SER   5   1.438 -17.657  -3.165
   20    HB3  SER   5           2HB      SER   5  -0.325 -17.611  -3.179
   21    HG   SER   5           HG       SER   5  -0.302 -19.614  -3.776
   22    H    SER   6           H        SER   6  -1.113 -15.488  -6.145
   23    HA   SER   6           HA       SER   6  -0.288 -13.046  -4.808
   24    HB2  SER   6           1HB      SER   6  -0.873 -13.182  -7.278
   25    HB3  SER   6           2HB      SER   6  -2.555 -13.365  -6.780
   26    HG   SER   6           HG       SER   6  -2.582 -11.277  -6.655
   27    H    GLY   7           H        GLY   7  -2.216 -11.543  -4.173
   28    HA2  GLY   7           1HA      GLY   7  -4.282 -11.276  -3.067
   29    HA3  GLY   7           2HA      GLY   7  -4.375 -13.020  -2.869
   30    H    SER   8           H        SER   8  -2.251 -10.334  -1.869
   31    HA   SER   8           HA       SER   8  -2.430 -11.325   0.886
   32    HB2  SER   8           1HB      SER   8   0.039 -10.863   1.144
   33    HB3  SER   8           2HB      SER   8  -0.351 -12.249   0.126
   34    HG   SER   8           HG       SER   8   0.848  -9.859  -0.527
   35    H    SER   9           H        SER   9  -3.214  -9.722   2.066
   36    HA   SER   9           HA       SER   9  -3.766  -7.627   2.782
   37    HB2  SER   9           1HB      SER   9  -1.931  -6.242   3.355
   38    HB3  SER   9           2HB      SER   9  -1.293  -7.885   3.400
   39    HG   SER   9           HG       SER   9   0.043  -6.342   2.262
   40    H    THR  10           H        THR  10  -4.598  -8.061   0.196
   41    HA   THR  10           HA       THR  10  -4.113  -5.456  -1.098
   42    HB   THR  10           HB       THR  10  -4.796  -6.553  -3.233
   43    HG1  THR  10           HG1      THR  10  -5.716  -8.443  -2.987
   44   HG21  THR  10          3HG2      THR  10  -2.353  -7.183  -1.703
   45   HG22  THR  10          1HG2      THR  10  -2.535  -6.438  -3.290
   46   HG23  THR  10          2HG2      THR  10  -2.651  -8.190  -3.120
   47    H    LYS  11           H        LYS  11  -5.770  -4.162  -0.621
   48    HA   LYS  11           HA       LYS  11  -8.496  -5.264  -0.834
   49    HB2  LYS  11           1HB      LYS  11  -7.543  -4.386   1.460
   50    HB3  LYS  11           2HB      LYS  11  -7.917  -2.809   0.775
   51    HG2  LYS  11           1HG      LYS  11 -10.201  -3.236   0.720
   52    HG3  LYS  11           2HG      LYS  11  -9.974  -4.983   0.837
   53    HD2  LYS  11           1HD      LYS  11  -9.156  -3.128   3.054
   54    HD3  LYS  11           2HD      LYS  11 -10.802  -3.750   2.923
   55    HE2  LYS  11           1HE      LYS  11 -10.129  -5.949   3.282
   56    HE3  LYS  11           2HE      LYS  11  -8.454  -5.608   2.850
   57    HZ1  LYS  11           3HZ      LYS  11  -7.998  -5.241   4.969
   58    HZ2  LYS  11           1HZ      LYS  11  -9.588  -5.638   5.390
   59    HZ3  LYS  11           2HZ      LYS  11  -9.177  -4.031   5.062
   60    H    SER  12           H        SER  12 -10.151  -3.524  -1.330
   61    HA   SER  12           HA       SER  12 -10.002  -2.536  -3.797
   62    HB2  SER  12           1HB      SER  12 -12.002  -2.307  -2.384
   63    HB3  SER  12           2HB      SER  12 -11.217  -1.015  -1.476
   64    HG   SER  12           HG       SER  12 -12.102  -1.011  -4.156
   65    H    HIS  13           H        HIS  13  -9.113  -0.517  -0.991
   66    HA   HIS  13           HA       HIS  13  -7.598   1.231  -2.785
   67    HB2  HIS  13           1HB      HIS  13  -7.967   1.769   0.140
   68    HB3  HIS  13           2HB      HIS  13  -7.788   2.912  -1.187
   69    HD1  HIS  13           HD1      HIS  13  -9.938   3.201  -2.750
   70    HD2  HIS  13           HD2      HIS  13 -10.550   1.184   0.830
   71    HE1  HIS  13           HE1      HIS  13 -12.427   3.207  -2.392
   72    H    GLN  14           H        GLN  14  -5.860  -0.262  -3.104
   73    HA   GLN  14           HA       GLN  14  -4.200  -0.829  -0.762
   74    HB2  GLN  14           1HB      GLN  14  -4.809  -2.611  -2.479
   75    HB3  GLN  14           2HB      GLN  14  -3.723  -1.778  -3.583
   76    HG2  GLN  14           1HG      GLN  14  -1.967  -2.046  -1.730
   77    HG3  GLN  14           2HG      GLN  14  -3.074  -3.241  -1.056
   78   HE21  GLN  14          1HE2      GLN  14  -0.397  -3.611  -2.112
   79   HE22  GLN  14          2HE2      GLN  14  -0.536  -4.751  -3.403
   80    H    CYS  15           H        CYS  15  -2.184  -0.005  -0.472
   81    HA   CYS  15           HA       CYS  15  -1.526   2.404  -1.858
   82    HB2  CYS  15           1HB      CYS  15  -1.055   1.943   0.576
   83    HB3  CYS  15           2HB      CYS  15   0.227   0.854   0.054
   84    H    HIS  16           H        HIS  16   0.564   2.817  -2.886
   85    HA   HIS  16           HA       HIS  16   1.467   0.479  -4.434
   86    HB2  HIS  16           1HB      HIS  16   0.331   2.427  -5.642
   87    HB3  HIS  16           2HB      HIS  16   1.782   3.357  -5.278
   88    HD1  HIS  16           HD1      HIS  16   4.028   1.563  -5.973
   89    HD2  HIS  16           HD2      HIS  16   0.533   1.659  -8.217
   90    HE1  HIS  16           HE1      HIS  16   4.658   0.671  -8.239
   91    H    GLU  17           H        GLU  17   2.404   2.945  -2.247
   92    HA   GLU  17           HA       GLU  17   5.191   2.977  -2.873
   93    HB2  GLU  17           1HB      GLU  17   3.939   3.740  -0.238
   94    HB3  GLU  17           2HB      GLU  17   5.459   4.309  -0.912
   95    HG2  GLU  17           1HG      GLU  17   2.721   4.901  -2.013
   96    HG3  GLU  17           2HG      GLU  17   3.710   6.001  -1.053
   97    H    CYS  18           H        CYS  18   3.145   1.143  -0.691
   98    HA   CYS  18           HA       CYS  18   5.451  -0.577  -0.078
   99    HB2  CYS  18           1HB      CYS  18   4.517  -0.901   2.211
  100    HB3  CYS  18           2HB      CYS  18   5.065   0.744   1.906
  101    H    GLY  19           H        GLY  19   1.935  -0.272  -0.302
  102    HA2  GLY  19           1HA      GLY  19   0.624  -1.874  -1.494
  103    HA3  GLY  19           2HA      GLY  19   1.830  -3.095  -1.114
  104    H    ARG  20           H        ARG  20  -0.180  -0.817   0.761
  105    HA   ARG  20           HA       ARG  20  -0.752  -3.002   2.635
  106    HB2  ARG  20           1HB      ARG  20  -0.700  -0.022   2.869
  107    HB3  ARG  20           2HB      ARG  20  -1.726  -0.943   3.960
  108    HG2  ARG  20           1HG      ARG  20   0.396  -2.318   4.447
  109    HG3  ARG  20           2HG      ARG  20   1.254  -0.960   3.716
  110    HD2  ARG  20           1HD      ARG  20  -0.261   0.433   5.368
  111    HD3  ARG  20           2HD      ARG  20  -0.298  -1.093   6.252
  112    HE   ARG  20           HE       ARG  20   2.350  -0.289   5.511
  113   HH11  ARG  20          1HH1      ARG  20  -0.183   0.105   7.866
  114   HH12  ARG  20          2HH1      ARG  20   0.894   0.572   9.139
  115   HH21  ARG  20          1HH2      ARG  20   3.779   0.325   7.179
  116   HH22  ARG  20          2HH2      ARG  20   3.148   0.698   8.747
  117    H    GLY  21           H        GLY  21  -2.866  -3.502   3.258
  118    HA2  GLY  21           1HA      GLY  21  -4.893  -2.710   1.282
  119    HA3  GLY  21           2HA      GLY  21  -4.951  -4.149   2.288
  120    H    PHE  22           H        PHE  22  -6.198  -1.108   1.852
  121    HA   PHE  22           HA       PHE  22  -7.016  -0.913   4.676
  122    HB2  PHE  22           1HB      PHE  22  -6.796   1.268   2.591
  123    HB3  PHE  22           2HB      PHE  22  -7.431   1.496   4.218
  124    HD1  PHE  22           HD1      PHE  22  -5.943   1.338   6.163
  125    HD2  PHE  22           HD2      PHE  22  -4.455   1.105   2.182
  126    HE1  PHE  22           HE1      PHE  22  -3.668   1.776   6.991
  127    HE2  PHE  22           HE2      PHE  22  -2.178   1.541   3.004
  128    HZ   PHE  22           HZ       PHE  22  -1.781   1.877   5.411
  129    H    THR  23           H        THR  23  -9.139  -0.916   5.173
  130    HA   THR  23           HA       THR  23 -11.006  -1.792   3.205
  131    HB   THR  23           HB       THR  23 -11.473  -0.890   6.054
  132    HG1  THR  23           HG1      THR  23 -11.603  -3.560   5.192
  133   HG21  THR  23          3HG2      THR  23 -13.562  -0.724   4.963
  134   HG22  THR  23          1HG2      THR  23 -13.578  -2.293   5.768
  135   HG23  THR  23          2HG2      THR  23 -13.281  -2.195   4.032
  136    H    LEU  24           H        LEU  24 -10.697   1.207   5.099
  137    HA   LEU  24           HA       LEU  24 -12.737   2.476   3.444
  138    HB2  LEU  24           1HB      LEU  24 -11.229   3.461   5.861
  139    HB3  LEU  24           2HB      LEU  24 -12.476   4.373   5.014
  140    HG   LEU  24           HG       LEU  24 -12.955   1.724   6.373
  141   HD11  LEU  24          1HD1      LEU  24 -12.365   3.238   8.098
  142   HD12  LEU  24          2HD1      LEU  24 -14.126   3.149   8.083
  143   HD13  LEU  24          3HD1      LEU  24 -13.308   4.540   7.372
  144   HD21  LEU  24          3HD2      LEU  24 -14.455   2.591   4.461
  145   HD22  LEU  24          1HD2      LEU  24 -15.003   3.783   5.640
  146   HD23  LEU  24          2HD2      LEU  24 -15.217   2.062   5.962
  147    H    LYS  25           H        LYS  25 -12.346   4.019   1.954
  148    HA   LYS  25           HA       LYS  25  -9.895   4.236   0.693
  149    HB2  LYS  25           1HB      LYS  25 -11.849   4.908  -0.485
  150    HB3  LYS  25           2HB      LYS  25 -12.265   6.098   0.741
  151    HG2  LYS  25           1HG      LYS  25 -11.414   7.471  -0.857
  152    HG3  LYS  25           2HG      LYS  25  -9.938   7.122   0.045
  153    HD2  LYS  25           1HD      LYS  25 -10.666   5.286  -2.171
  154    HD3  LYS  25           2HD      LYS  25 -10.072   6.891  -2.600
  155    HE2  LYS  25           1HE      LYS  25  -8.073   6.506  -1.237
  156    HE3  LYS  25           2HE      LYS  25  -8.669   4.901  -0.818
  157    HZ1  LYS  25           3HZ      LYS  25  -8.543   4.267  -3.129
  158    HZ2  LYS  25           1HZ      LYS  25  -7.038   4.844  -2.618
  159    HZ3  LYS  25           2HZ      LYS  25  -8.038   5.820  -3.571
  160    H    SER  26           H        SER  26 -11.298   6.322   3.185
  161    HA   SER  26           HA       SER  26  -9.376   8.335   3.196
  162    HB2  SER  26           1HB      SER  26 -11.562   8.323   4.460
  163    HB3  SER  26           2HB      SER  26 -10.790   7.278   5.652
  164    HG   SER  26           HG       SER  26 -10.445   9.265   6.438
  165    H    HIS  27           H        HIS  27  -9.502   5.380   5.180
  166    HA   HIS  27           HA       HIS  27  -7.323   5.597   6.748
  167    HB2  HIS  27           1HB      HIS  27  -8.445   3.260   5.252
  168    HB3  HIS  27           2HB      HIS  27  -6.944   3.060   6.151
  169    HD1  HIS  27           HD1      HIS  27  -9.817   1.769   6.805
  170    HD2  HIS  27           HD2      HIS  27  -8.000   4.960   8.748
  171    HE1  HIS  27           HE1      HIS  27 -10.856   1.842   9.094
  172    H    LEU  28           H        LEU  28  -7.073   4.075   3.528
  173    HA   LEU  28           HA       LEU  28  -4.321   3.985   3.366
  174    HB2  LEU  28           1HB      LEU  28  -5.609   2.831   1.751
  175    HB3  LEU  28           2HB      LEU  28  -6.413   4.312   1.233
  176    HG   LEU  28           HG       LEU  28  -4.178   5.082   0.353
  177   HD11  LEU  28          1HD1      LEU  28  -2.886   3.430   1.748
  178   HD12  LEU  28          2HD1      LEU  28  -2.420   3.528   0.051
  179   HD13  LEU  28          3HD1      LEU  28  -3.413   2.185   0.615
  180   HD21  LEU  28          3HD2      LEU  28  -5.037   2.533  -0.968
  181   HD22  LEU  28          1HD2      LEU  28  -4.506   4.046  -1.703
  182   HD23  LEU  28          2HD2      LEU  28  -6.094   3.945  -0.942
  183    H    ASN  29           H        ASN  29  -6.448   6.548   2.095
  184    HA   ASN  29           HA       ASN  29  -4.677   8.271   0.997
  185    HB2  ASN  29           1HB      ASN  29  -7.218   8.539   1.372
  186    HB3  ASN  29           2HB      ASN  29  -6.772   9.323   2.885
  187   HD21  ASN  29          1HD2      ASN  29  -7.328  11.374   2.470
  188   HD22  ASN  29          2HD2      ASN  29  -6.668  12.332   1.192
  189    H    GLN  30           H        GLN  30  -5.609   8.451   4.439
  190    HA   GLN  30           HA       GLN  30  -3.663  10.318   5.178
  191    HB2  GLN  30           1HB      GLN  30  -4.998   8.186   6.854
  192    HB3  GLN  30           2HB      GLN  30  -4.078   9.540   7.496
  193    HG2  GLN  30           1HG      GLN  30  -6.342  10.121   5.666
  194    HG3  GLN  30           2HG      GLN  30  -6.701   9.607   7.313
  195   HE21  GLN  30          1HE2      GLN  30  -7.544  11.571   7.927
  196   HE22  GLN  30          2HE2      GLN  30  -6.572  12.984   8.140
  197    H    HIS  31           H        HIS  31  -3.550   6.811   4.980
  198    HA   HIS  31           HA       HIS  31  -1.141   6.387   6.352
  199    HB2  HIS  31           1HB      HIS  31  -2.203   4.393   5.975
  200    HB3  HIS  31           2HB      HIS  31  -2.755   4.866   4.371
  201    HD1  HIS  31           HD1      HIS  31   0.200   3.399   6.158
  202    HD2  HIS  31           HD2      HIS  31  -1.063   4.172   2.277
  203    HE1  HIS  31           HE1      HIS  31   1.825   2.188   4.669
  204    H    GLN  32           H        GLN  32  -1.740   6.805   2.866
  205    HA   GLN  32           HA       GLN  32   0.741   6.528   1.818
  206    HB2  GLN  32           1HB      GLN  32  -1.479   8.431   1.174
  207    HB3  GLN  32           2HB      GLN  32   0.047   8.558   0.309
  208    HG2  GLN  32           1HG      GLN  32  -0.163   6.282  -0.472
  209    HG3  GLN  32           2HG      GLN  32  -1.638   6.070   0.470
  210   HE21  GLN  32          1HE2      GLN  32  -1.169   5.833  -2.412
  211   HE22  GLN  32          2HE2      GLN  32  -2.276   6.927  -3.162
  212    H    ARG  33           H        ARG  33  -0.321   9.041   3.952
  213    HA   ARG  33           HA       ARG  33   1.528  11.047   3.455
  214    HB2  ARG  33           1HB      ARG  33   0.374  10.159   6.105
  215    HB3  ARG  33           2HB      ARG  33   1.217  11.679   5.837
  216    HG2  ARG  33           1HG      ARG  33  -0.515  12.298   4.182
  217    HG3  ARG  33           2HG      ARG  33  -1.382  10.816   4.589
  218    HD2  ARG  33           1HD      ARG  33  -0.645  12.920   6.613
  219    HD3  ARG  33           2HD      ARG  33  -2.184  12.900   5.752
  220    HE   ARG  33           HE       ARG  33  -2.145  10.451   6.799
  221   HH11  ARG  33          1HH1      ARG  33  -1.424  13.547   8.219
  222   HH12  ARG  33          2HH1      ARG  33  -1.936  13.083   9.808
  223   HH21  ARG  33          1HH2      ARG  33  -2.822   9.828   8.886
  224   HH22  ARG  33          2HH2      ARG  33  -2.730  10.967  10.187
  225    H    ILE  34           H        ILE  34   1.847   8.168   5.499
  226    HA   ILE  34           HA       ILE  34   4.275   8.642   6.694
  227    HB   ILE  34           HB       ILE  34   4.522   6.317   7.010
  228   HG12  ILE  34          1HG1      ILE  34   2.610   5.827   4.719
  229   HG13  ILE  34          2HG1      ILE  34   4.362   5.752   4.567
  230   HG21  ILE  34          1HG2      ILE  34   2.716   6.319   8.297
  231   HG22  ILE  34          2HG2      ILE  34   1.971   7.555   7.284
  232   HG23  ILE  34          3HG2      ILE  34   1.738   5.848   6.907
  233   HD11  ILE  34          3HD1      ILE  34   4.102   4.055   6.570
  234   HD12  ILE  34          1HD1      ILE  34   2.487   3.878   5.886
  235   HD13  ILE  34          2HD1      ILE  34   3.907   3.554   4.891
  236    H    HIS  35           H        HIS  35   3.627   8.126   3.362
  237    HA   HIS  35           HA       HIS  35   6.440   7.566   2.771
  238    HB2  HIS  35           1HB      HIS  35   4.090   7.648   0.869
  239    HB3  HIS  35           2HB      HIS  35   5.707   7.041   0.520
  240    HD1  HIS  35           HD1      HIS  35   6.349   5.030   2.482
  241    HD2  HIS  35           HD2      HIS  35   2.414   5.584   1.269
  242    HE1  HIS  35           HE1      HIS  35   5.166   2.881   3.035
  243    H    THR  36           H        THR  36   4.065  10.073   2.622
  244    HA   THR  36           HA       THR  36   4.851  11.754   0.648
  245    HB   THR  36           HB       THR  36   3.129  12.090   2.610
  246    HG1  THR  36           HG1      THR  36   2.803  13.725   1.318
  247   HG21  THR  36          3HG2      THR  36   5.327  13.914   3.555
  248   HG22  THR  36          1HG2      THR  36   5.062  12.322   4.264
  249   HG23  THR  36          2HG2      THR  36   3.793  13.545   4.341
  250    H    GLY  37           H        GLY  37   6.516  11.219   3.714
  251    HA2  GLY  37           1HA      GLY  37   8.780  11.509   4.156
  252    HA3  GLY  37           2HA      GLY  37   8.966  12.247   2.572
  253    H    GLU  38           H        GLU  38  10.167  13.211   4.943
  254    HA   GLU  38           HA       GLU  38   8.619  15.584   5.656
  255    HB2  GLU  38           1HB      GLU  38  11.102  14.312   6.783
  256    HB3  GLU  38           2HB      GLU  38  10.619  15.941   7.235
  257    HG2  GLU  38           1HG      GLU  38   9.777  14.539   8.912
  258    HG3  GLU  38           2HG      GLU  38   8.393  14.960   7.906
  259    H    LYS  39           H        LYS  39   9.194  17.636   5.128
  260    HA   LYS  39           HA       LYS  39   9.991  19.192   3.623
  261    HB2  LYS  39           1HB      LYS  39  11.531  19.074   5.714
  262    HB3  LYS  39           2HB      LYS  39  12.699  18.354   4.614
  263    HG2  LYS  39           1HG      LYS  39  12.914  20.297   3.365
  264    HG3  LYS  39           2HG      LYS  39  11.383  20.956   3.947
  265    HD2  LYS  39           1HD      LYS  39  13.697  20.467   5.800
  266    HD3  LYS  39           2HD      LYS  39  13.552  21.963   4.874
  267    HE2  LYS  39           1HE      LYS  39  11.375  20.906   6.666
  268    HE3  LYS  39           2HE      LYS  39  12.620  22.028   7.215
  269    HZ1  LYS  39           3HZ      LYS  39  10.254  22.559   5.733
  270    HZ2  LYS  39           1HZ      LYS  39  11.616  23.129   4.907
  271    HZ3  LYS  39           2HZ      LYS  39  11.309  23.644   6.489
  272    HA   PRO  40           HA       PRO  40  11.544  15.919   0.589
  273    HB2  PRO  40           1HB      PRO  40   9.349  15.897  -1.009
  274    HB3  PRO  40           2HB      PRO  40   9.532  14.829   0.388
  275    HG2  PRO  40           1HG      PRO  40   8.015  17.399   0.154
  276    HG3  PRO  40           2HG      PRO  40   7.536  15.885   0.943
  277    HD2  PRO  40           1HD      PRO  40   8.480  18.014   2.325
  278    HD3  PRO  40           2HD      PRO  40   8.764  16.339   2.839
  279    H    SER  41           H        SER  41  10.798  19.132   0.751
  280    HA   SER  41           HA       SER  41  10.624  20.036  -1.863
  281    HB2  SER  41           1HB      SER  41  11.247  22.164  -1.051
  282    HB3  SER  41           2HB      SER  41  10.482  21.374   0.328
  283    HG   SER  41           HG       SER  41  13.149  22.052  -0.089
  284    H    GLY  42           H        GLY  42  11.946  19.930  -3.550
  285    HA2  GLY  42           1HA      GLY  42  14.381  18.615  -3.583
  286    HA3  GLY  42           2HA      GLY  42  13.858  19.758  -4.811
  287    HA   PRO  43           HA       PRO  43  17.572  21.333  -2.314
  288    HB2  PRO  43           1HB      PRO  43  19.446  21.099  -4.264
  289    HB3  PRO  43           2HB      PRO  43  19.102  19.811  -3.103
  290    HG2  PRO  43           1HG      PRO  43  18.151  20.121  -5.925
  291    HG3  PRO  43           2HG      PRO  43  18.739  18.668  -5.096
  292    HD2  PRO  43           1HD      PRO  43  16.104  19.167  -5.469
  293    HD3  PRO  43           2HD      PRO  43  16.719  18.295  -4.050
  294    H    SER  44           H        SER  44  16.872  23.424  -2.331
  295    HA   SER  44           HA       SER  44  17.385  24.956  -4.792
  296    HB2  SER  44           1HB      SER  44  15.438  26.425  -4.107
  297    HB3  SER  44           2HB      SER  44  15.001  24.808  -4.659
  298    HG   SER  44           HG       SER  44  15.466  25.113  -1.938
  299    H    SER  45           H        SER  45  17.412  27.400  -4.237
  300    HA   SER  45           HA       SER  45  19.485  27.780  -2.305
  301    HB2  SER  45           1HB      SER  45  19.284  30.194  -2.970
  302    HB3  SER  45           2HB      SER  45  19.545  29.095  -4.324
  303    HG   SER  45           HG       SER  45  17.796  29.924  -5.121
  304    H    GLY  46           H        GLY  46  19.369  28.511  -0.263
  305    HA2  GLY  46           1HA      GLY  46  18.275  30.022   1.338
  306    HA3  GLY  46           2HA      GLY  46  16.739  29.461   0.694
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1  15.713 -20.895  -4.890
    2    HA2  GLY   1           1HA      GLY   1  17.460 -19.127  -5.392
    3    HA3  GLY   1           2HA      GLY   1  16.311 -18.560  -6.594
    4    H    SER   2           H        SER   2  14.312 -17.649  -5.880
    5    HA   SER   2           HA       SER   2  14.584 -16.351  -3.273
    6    HB2  SER   2           1HB      SER   2  12.809 -15.754  -5.649
    7    HB3  SER   2           2HB      SER   2  12.743 -14.867  -4.127
    8    HG   SER   2           HG       SER   2  14.918 -15.050  -5.936
    9    H    SER   3           H        SER   3  13.964 -18.164  -2.005
   10    HA   SER   3           HA       SER   3  11.342 -19.320  -2.353
   11    HB2  SER   3           1HB      SER   3  13.480 -20.475  -1.431
   12    HB3  SER   3           2HB      SER   3  13.052 -19.696   0.092
   13    HG   SER   3           HG       SER   3  12.027 -21.911  -0.994
   14    H    GLY   4           H        GLY   4   9.767 -17.820  -2.004
   15    HA2  GLY   4           1HA      GLY   4   9.587 -16.775   0.744
   16    HA3  GLY   4           2HA      GLY   4   9.338 -15.696  -0.620
   17    H    SER   5           H        SER   5   7.582 -16.740   1.635
   18    HA   SER   5           HA       SER   5   5.421 -17.876  -0.006
   19    HB2  SER   5           1HB      SER   5   6.319 -19.023   2.166
   20    HB3  SER   5           2HB      SER   5   5.352 -17.803   2.994
   21    HG   SER   5           HG       SER   5   4.214 -19.781   2.577
   22    H    SER   6           H        SER   6   3.791 -16.596  -0.541
   23    HA   SER   6           HA       SER   6   2.549 -14.777   1.230
   24    HB2  SER   6           1HB      SER   6   4.699 -13.542   0.616
   25    HB3  SER   6           2HB      SER   6   4.035 -13.405  -1.012
   26    HG   SER   6           HG       SER   6   2.371 -12.644   1.076
   27    H    GLY   7           H        GLY   7   0.556 -14.165   0.491
   28    HA2  GLY   7           1HA      GLY   7  -0.265 -15.366  -2.045
   29    HA3  GLY   7           2HA      GLY   7  -1.333 -14.794  -0.772
   30    H    SER   8           H        SER   8  -1.919 -14.166  -3.345
   31    HA   SER   8           HA       SER   8  -0.928 -11.457  -3.821
   32    HB2  SER   8           1HB      SER   8  -2.023 -11.632  -5.998
   33    HB3  SER   8           2HB      SER   8  -1.003 -13.043  -5.722
   34    HG   SER   8           HG       SER   8  -3.226 -13.823  -4.789
   35    H    SER   9           H        SER   9  -2.460 -11.636  -1.550
   36    HA   SER   9           HA       SER   9  -5.213 -11.166  -1.923
   37    HB2  SER   9           1HB      SER   9  -3.414 -10.258   0.338
   38    HB3  SER   9           2HB      SER   9  -5.177 -10.293   0.382
   39    HG   SER   9           HG       SER   9  -4.925 -12.262   1.057
   40    H    THR  10           H        THR  10  -6.376  -9.156  -1.600
   41    HA   THR  10           HA       THR  10  -4.942  -6.672  -1.997
   42    HB   THR  10           HB       THR  10  -6.424  -6.088  -3.992
   43    HG1  THR  10           HG1      THR  10  -6.499  -8.845  -4.531
   44   HG21  THR  10          3HG2      THR  10  -4.575  -8.270  -4.807
   45   HG22  THR  10          1HG2      THR  10  -3.902  -6.913  -3.906
   46   HG23  THR  10          2HG2      THR  10  -4.733  -6.630  -5.435
   47    H    LYS  11           H        LYS  11  -6.041  -4.934  -1.228
   48    HA   LYS  11           HA       LYS  11  -8.739  -5.455  -0.172
   49    HB2  LYS  11           1HB      LYS  11  -6.660  -4.798   1.316
   50    HB3  LYS  11           2HB      LYS  11  -7.061  -3.172   0.781
   51    HG2  LYS  11           1HG      LYS  11  -9.005  -3.109   1.964
   52    HG3  LYS  11           2HG      LYS  11  -9.252  -4.854   1.866
   53    HD2  LYS  11           1HD      LYS  11  -7.204  -5.032   3.401
   54    HD3  LYS  11           2HD      LYS  11  -7.444  -3.309   3.702
   55    HE2  LYS  11           1HE      LYS  11  -9.765  -3.803   4.410
   56    HE3  LYS  11           2HE      LYS  11  -9.434  -5.522   4.199
   57    HZ1  LYS  11           3HZ      LYS  11  -8.377  -3.669   6.228
   58    HZ2  LYS  11           1HZ      LYS  11  -7.495  -5.051   5.810
   59    HZ3  LYS  11           2HZ      LYS  11  -9.059  -5.204   6.434
   60    H    SER  12           H        SER  12 -10.204  -3.574  -0.086
   61    HA   SER  12           HA       SER  12 -10.950  -2.545  -2.427
   62    HB2  SER  12           1HB      SER  12 -10.969  -1.050   0.205
   63    HB3  SER  12           2HB      SER  12 -11.896  -0.573  -1.217
   64    HG   SER  12           HG       SER  12 -13.291  -1.803  -0.113
   65    H    HIS  13           H        HIS  13  -8.751  -0.756  -0.259
   66    HA   HIS  13           HA       HIS  13  -7.671   0.600  -2.643
   67    HB2  HIS  13           1HB      HIS  13  -7.652   1.813   0.112
   68    HB3  HIS  13           2HB      HIS  13  -7.432   2.614  -1.441
   69    HD1  HIS  13           HD1      HIS  13  -9.703   2.579  -2.997
   70    HD2  HIS  13           HD2      HIS  13 -10.166   2.016   1.093
   71    HE1  HIS  13           HE1      HIS  13 -12.124   3.066  -2.521
   72    H    GLN  14           H        GLN  14  -5.822  -0.474  -3.041
   73    HA   GLN  14           HA       GLN  14  -4.053  -1.149  -0.809
   74    HB2  GLN  14           1HB      GLN  14  -4.509  -2.954  -2.365
   75    HB3  GLN  14           2HB      GLN  14  -3.991  -1.959  -3.720
   76    HG2  GLN  14           1HG      GLN  14  -1.771  -2.187  -3.222
   77    HG3  GLN  14           2HG      GLN  14  -2.072  -2.464  -1.507
   78   HE21  GLN  14          1HE2      GLN  14  -0.333  -4.028  -2.982
   79   HE22  GLN  14          2HE2      GLN  14  -0.982  -5.624  -3.114
   80    H    CYS  15           H        CYS  15  -2.136  -0.181  -0.468
   81    HA   CYS  15           HA       CYS  15  -1.575   2.279  -1.801
   82    HB2  CYS  15           1HB      CYS  15  -1.090   1.879   0.603
   83    HB3  CYS  15           2HB      CYS  15   0.161   0.732   0.135
   84    H    HIS  16           H        HIS  16   0.509   2.805  -2.799
   85    HA   HIS  16           HA       HIS  16   1.495   0.556  -4.423
   86    HB2  HIS  16           1HB      HIS  16   1.108   3.470  -5.009
   87    HB3  HIS  16           2HB      HIS  16   2.319   2.557  -5.904
   88    HD1  HIS  16           HD1      HIS  16  -1.270   1.717  -4.931
   89    HD2  HIS  16           HD2      HIS  16   1.199   1.903  -8.267
   90    HE1  HIS  16           HE1      HIS  16  -2.682   0.930  -6.857
   91    H    GLU  17           H        GLU  17   2.378   3.067  -2.215
   92    HA   GLU  17           HA       GLU  17   5.155   3.153  -2.764
   93    HB2  GLU  17           1HB      GLU  17   3.873   3.711  -0.093
   94    HB3  GLU  17           2HB      GLU  17   5.372   4.374  -0.728
   95    HG2  GLU  17           1HG      GLU  17   2.609   4.940  -1.778
   96    HG3  GLU  17           2HG      GLU  17   3.580   6.016  -0.775
   97    H    CYS  18           H        CYS  18   3.180   1.215  -0.574
   98    HA   CYS  18           HA       CYS  18   5.535  -0.486  -0.081
   99    HB2  CYS  18           1HB      CYS  18   4.593  -0.977   2.164
  100    HB3  CYS  18           2HB      CYS  18   5.034   0.716   1.962
  101    H    GLY  19           H        GLY  19   2.015  -0.318  -0.369
  102    HA2  GLY  19           1HA      GLY  19   0.907  -1.950  -1.785
  103    HA3  GLY  19           2HA      GLY  19   2.051  -3.149  -1.201
  104    H    ARG  20           H        ARG  20   0.669  -0.895   1.036
  105    HA   ARG  20           HA       ARG  20  -0.440  -3.003   2.606
  106    HB2  ARG  20           1HB      ARG  20  -0.239  -0.042   2.827
  107    HB3  ARG  20           2HB      ARG  20  -1.472  -0.847   3.788
  108    HG2  ARG  20           1HG      ARG  20   0.554  -2.405   4.444
  109    HG3  ARG  20           2HG      ARG  20   1.484  -0.973   3.998
  110    HD2  ARG  20           1HD      ARG  20   1.076  -0.761   6.306
  111    HD3  ARG  20           2HD      ARG  20  -0.067   0.330   5.524
  112    HE   ARG  20           HE       ARG  20  -1.751  -0.897   6.439
  113   HH11  ARG  20          1HH1      ARG  20   1.099  -2.890   6.277
  114   HH12  ARG  20          2HH1      ARG  20   0.366  -4.232   7.093
  115   HH21  ARG  20          1HH2      ARG  20  -2.727  -2.657   7.514
  116   HH22  ARG  20          2HH2      ARG  20  -1.810  -4.098   7.795
  117    H    GLY  21           H        GLY  21  -2.755  -2.746   3.480
  118    HA2  GLY  21           1HA      GLY  21  -4.589  -2.015   1.289
  119    HA3  GLY  21           2HA      GLY  21  -4.720  -3.579   2.079
  120    H    PHE  22           H        PHE  22  -6.407  -0.986   1.875
  121    HA   PHE  22           HA       PHE  22  -7.164  -0.988   4.712
  122    HB2  PHE  22           1HB      PHE  22  -6.980   1.482   2.975
  123    HB3  PHE  22           2HB      PHE  22  -7.559   1.433   4.637
  124    HD1  PHE  22           HD2      PHE  22  -4.606   1.130   2.474
  125    HD2  PHE  22           HD1      PHE  22  -6.044   1.324   6.475
  126    HE1  PHE  22           HE2      PHE  22  -2.309   1.490   3.279
  127    HE2  PHE  22           HE1      PHE  22  -3.749   1.684   7.286
  128    HZ   PHE  22           HZ       PHE  22  -1.878   1.767   5.688
  129    H    THR  23           H        THR  23  -9.352  -0.761   5.134
  130    HA   THR  23           HA       THR  23 -11.111  -1.628   3.065
  131    HB   THR  23           HB       THR  23 -11.764  -0.627   5.844
  132    HG1  THR  23           HG1      THR  23 -10.494  -2.501   5.904
  133   HG21  THR  23          3HG2      THR  23 -13.914  -1.624   5.578
  134   HG22  THR  23          1HG2      THR  23 -13.461  -2.337   4.030
  135   HG23  THR  23          2HG2      THR  23 -13.650  -0.590   4.175
  136    H    LEU  24           H        LEU  24 -11.092   1.345   5.043
  137    HA   LEU  24           HA       LEU  24 -12.857   2.647   3.139
  138    HB2  LEU  24           1HB      LEU  24 -11.681   3.489   5.776
  139    HB3  LEU  24           2HB      LEU  24 -12.630   4.576   4.764
  140    HG   LEU  24           HG       LEU  24 -13.754   1.954   5.691
  141   HD11  LEU  24          1HD1      LEU  24 -14.859   3.550   7.461
  142   HD12  LEU  24          2HD1      LEU  24 -13.363   4.459   7.250
  143   HD13  LEU  24          3HD1      LEU  24 -13.305   2.777   7.778
  144   HD21  LEU  24          3HD2      LEU  24 -14.692   3.753   3.919
  145   HD22  LEU  24          1HD2      LEU  24 -15.380   4.396   5.410
  146   HD23  LEU  24          2HD2      LEU  24 -15.725   2.736   4.924
  147    H    LYS  25           H        LYS  25 -12.310   4.276   1.771
  148    HA   LYS  25           HA       LYS  25  -9.748   4.457   0.743
  149    HB2  LYS  25           1HB      LYS  25 -11.635   5.215  -0.541
  150    HB3  LYS  25           2HB      LYS  25 -12.016   6.449   0.653
  151    HG2  LYS  25           1HG      LYS  25 -10.998   7.604  -1.101
  152    HG3  LYS  25           2HG      LYS  25  -9.734   7.441   0.121
  153    HD2  LYS  25           1HD      LYS  25  -8.681   6.898  -1.904
  154    HD3  LYS  25           2HD      LYS  25  -9.023   5.340  -1.147
  155    HE2  LYS  25           1HE      LYS  25  -9.757   4.941  -3.282
  156    HE3  LYS  25           2HE      LYS  25 -11.246   5.516  -2.531
  157    HZ1  LYS  25           3HZ      LYS  25 -11.224   7.408  -3.730
  158    HZ2  LYS  25           1HZ      LYS  25 -10.292   6.491  -4.803
  159    HZ3  LYS  25           2HZ      LYS  25  -9.539   7.548  -3.719
  160    H    SER  26           H        SER  26 -11.337   6.565   3.112
  161    HA   SER  26           HA       SER  26  -9.416   8.522   3.392
  162    HB2  SER  26           1HB      SER  26 -11.681   8.410   4.527
  163    HB3  SER  26           2HB      SER  26 -10.941   7.341   5.719
  164    HG   SER  26           HG       SER  26  -9.317   9.201   5.817
  165    H    HIS  27           H        HIS  27  -9.592   5.392   5.061
  166    HA   HIS  27           HA       HIS  27  -7.456   5.610   6.774
  167    HB2  HIS  27           1HB      HIS  27  -8.475   3.238   5.215
  168    HB3  HIS  27           2HB      HIS  27  -7.184   3.097   6.405
  169    HD1  HIS  27           HD1      HIS  27  -9.991   1.711   6.675
  170    HD2  HIS  27           HD2      HIS  27  -8.869   5.272   8.496
  171    HE1  HIS  27           HE1      HIS  27 -11.501   1.949   8.671
  172    H    LEU  28           H        LEU  28  -7.281   4.182   3.506
  173    HA   LEU  28           HA       LEU  28  -4.514   3.941   3.387
  174    HB2  LEU  28           1HB      LEU  28  -5.822   2.822   1.769
  175    HB3  LEU  28           2HB      LEU  28  -6.586   4.321   1.245
  176    HG   LEU  28           HG       LEU  28  -4.362   5.036   0.340
  177   HD11  LEU  28          1HD1      LEU  28  -2.888   3.656   1.630
  178   HD12  LEU  28          2HD1      LEU  28  -2.718   3.219  -0.070
  179   HD13  LEU  28          3HD1      LEU  28  -3.649   2.188   1.015
  180   HD21  LEU  28          3HD2      LEU  28  -4.508   3.627  -1.651
  181   HD22  LEU  28          1HD2      LEU  28  -6.108   4.122  -1.099
  182   HD23  LEU  28          2HD2      LEU  28  -5.531   2.487  -0.775
  183    H    ASN  29           H        ASN  29  -6.575   6.610   2.256
  184    HA   ASN  29           HA       ASN  29  -4.722   8.259   1.108
  185    HB2  ASN  29           1HB      ASN  29  -7.136   8.751   1.205
  186    HB3  ASN  29           2HB      ASN  29  -6.987   9.125   2.919
  187   HD21  ASN  29          1HD2      ASN  29  -6.814  11.185   3.385
  188   HD22  ASN  29          2HD2      ASN  29  -6.192  12.419   2.348
  189    H    GLN  30           H        GLN  30  -5.610   8.255   4.562
  190    HA   GLN  30           HA       GLN  30  -3.671  10.142   5.346
  191    HB2  GLN  30           1HB      GLN  30  -5.549   9.703   6.778
  192    HB3  GLN  30           2HB      GLN  30  -5.120   8.002   6.906
  193    HG2  GLN  30           1HG      GLN  30  -3.033   8.670   8.065
  194    HG3  GLN  30           2HG      GLN  30  -3.599  10.339   8.035
  195   HE21  GLN  30          1HE2      GLN  30  -5.073   7.196   8.784
  196   HE22  GLN  30          2HE2      GLN  30  -5.716   7.672  10.316
  197    H    HIS  31           H        HIS  31  -3.556   6.679   4.903
  198    HA   HIS  31           HA       HIS  31  -1.145   6.195   6.302
  199    HB2  HIS  31           1HB      HIS  31  -2.271   4.229   5.912
  200    HB3  HIS  31           2HB      HIS  31  -2.781   4.715   4.297
  201    HD1  HIS  31           HD1      HIS  31  -0.095   2.935   6.122
  202    HD2  HIS  31           HD2      HIS  31  -0.852   4.260   2.258
  203    HE1  HIS  31           HE1      HIS  31   1.592   1.767   4.668
  204    H    GLN  32           H        GLN  32  -1.810   6.687   2.839
  205    HA   GLN  32           HA       GLN  32   0.666   6.404   1.754
  206    HB2  GLN  32           1HB      GLN  32  -1.512   8.384   1.134
  207    HB3  GLN  32           2HB      GLN  32  -0.029   8.330   0.190
  208    HG2  GLN  32           1HG      GLN  32  -0.480   6.166  -0.597
  209    HG3  GLN  32           2HG      GLN  32  -1.736   5.902   0.611
  210   HE21  GLN  32          1HE2      GLN  32  -2.088   5.494  -2.134
  211   HE22  GLN  32          2HE2      GLN  32  -3.253   6.632  -2.710
  212    H    ARG  33           H        ARG  33  -0.370   8.871   3.938
  213    HA   ARG  33           HA       ARG  33   1.450  10.906   3.404
  214    HB2  ARG  33           1HB      ARG  33   0.244   9.999   6.020
  215    HB3  ARG  33           2HB      ARG  33   1.189  11.472   5.846
  216    HG2  ARG  33           1HG      ARG  33  -0.506  12.088   4.011
  217    HG3  ARG  33           2HG      ARG  33  -1.507  10.823   4.726
  218    HD2  ARG  33           1HD      ARG  33  -2.186  12.808   5.781
  219    HD3  ARG  33           2HD      ARG  33  -1.136  12.005   6.947
  220    HE   ARG  33           HE       ARG  33   0.277  13.860   5.293
  221   HH11  ARG  33          1HH1      ARG  33  -1.739  13.560   8.115
  222   HH12  ARG  33          2HH1      ARG  33  -1.139  15.006   8.858
  223   HH21  ARG  33          1HH2      ARG  33   1.074  15.766   6.260
  224   HH22  ARG  33          2HH2      ARG  33   0.460  16.260   7.801
  225    H    ILE  34           H        ILE  34   1.815   7.995   5.381
  226    HA   ILE  34           HA       ILE  34   4.201   8.441   6.633
  227    HB   ILE  34           HB       ILE  34   4.545   6.098   6.746
  228   HG12  ILE  34          1HG1      ILE  34   2.674   5.820   4.383
  229   HG13  ILE  34          2HG1      ILE  34   4.425   5.655   4.315
  230   HG21  ILE  34          1HG2      ILE  34   1.956   7.240   7.128
  231   HG22  ILE  34          2HG2      ILE  34   1.781   5.555   6.638
  232   HG23  ILE  34          3HG2      ILE  34   2.755   5.966   8.050
  233   HD11  ILE  34          3HD1      ILE  34   2.920   3.549   4.448
  234   HD12  ILE  34          1HD1      ILE  34   4.406   3.627   5.393
  235   HD13  ILE  34          2HD1      ILE  34   2.851   3.932   6.168
  236    H    HIS  35           H        HIS  35   3.656   7.853   3.240
  237    HA   HIS  35           HA       HIS  35   6.530   7.658   2.729
  238    HB2  HIS  35           1HB      HIS  35   4.371   7.520   0.638
  239    HB3  HIS  35           2HB      HIS  35   5.998   6.849   0.581
  240    HD1  HIS  35           HD1      HIS  35   6.380   4.836   2.437
  241    HD2  HIS  35           HD2      HIS  35   2.481   5.699   1.289
  242    HE1  HIS  35           HE1      HIS  35   5.029   2.811   3.068
  243    H    THR  36           H        THR  36   3.792   9.779   2.262
  244    HA   THR  36           HA       THR  36   4.778  11.527   0.349
  245    HB   THR  36           HB       THR  36   3.103  12.284   2.751
  246    HG1  THR  36           HG1      THR  36   2.044  11.723   0.204
  247   HG21  THR  36          3HG2      THR  36   2.366  14.154   1.478
  248   HG22  THR  36          1HG2      THR  36   3.172  13.568   0.024
  249   HG23  THR  36          2HG2      THR  36   4.127  14.148   1.389
  250    H    GLY  37           H        GLY  37   6.851  12.217   0.443
  251    HA2  GLY  37           1HA      GLY  37   8.408  13.851   1.082
  252    HA3  GLY  37           2HA      GLY  37   7.525  14.072   2.586
  253    H    GLU  38           H        GLU  38  10.269  12.771   1.170
  254    HA   GLU  38           HA       GLU  38  10.754  11.041   3.506
  255    HB2  GLU  38           1HB      GLU  38  12.409   9.857   2.081
  256    HB3  GLU  38           2HB      GLU  38  10.762   9.738   1.477
  257    HG2  GLU  38           1HG      GLU  38  11.186  11.311  -0.244
  258    HG3  GLU  38           2HG      GLU  38  12.742  11.753   0.456
  259    H    LYS  39           H        LYS  39  12.806  11.105   4.493
  260    HA   LYS  39           HA       LYS  39  14.426  13.476   3.830
  261    HB2  LYS  39           1HB      LYS  39  13.727  12.414   6.574
  262    HB3  LYS  39           2HB      LYS  39  14.891  13.697   6.268
  263    HG2  LYS  39           1HG      LYS  39  13.233  15.188   5.557
  264    HG3  LYS  39           2HG      LYS  39  12.044  13.901   5.350
  265    HD2  LYS  39           1HD      LYS  39  11.912  13.576   7.735
  266    HD3  LYS  39           2HD      LYS  39  13.218  14.733   8.002
  267    HE2  LYS  39           1HE      LYS  39  11.310  15.979   8.450
  268    HE3  LYS  39           2HE      LYS  39  11.683  16.406   6.781
  269    HZ1  LYS  39           3HZ      LYS  39   9.339  15.238   7.814
  270    HZ2  LYS  39           1HZ      LYS  39  10.037  14.171   6.702
  271    HZ3  LYS  39           2HZ      LYS  39   9.656  15.751   6.234
  272    HA   PRO  40           HA       PRO  40  17.137   9.756   3.614
  273    HB2  PRO  40           1HB      PRO  40  18.580  10.669   1.503
  274    HB3  PRO  40           2HB      PRO  40  17.050   9.804   1.319
  275    HG2  PRO  40           1HG      PRO  40  17.584  12.748   1.229
  276    HG3  PRO  40           2HG      PRO  40  16.546  11.767   0.178
  277    HD2  PRO  40           1HD      PRO  40  15.563  13.268   2.206
  278    HD3  PRO  40           2HD      PRO  40  14.817  11.738   1.702
  279    H    SER  41           H        SER  41  19.614   9.746   3.485
  280    HA   SER  41           HA       SER  41  20.587  11.658   5.424
  281    HB2  SER  41           1HB      SER  41  21.746   9.179   4.164
  282    HB3  SER  41           2HB      SER  41  22.730  10.249   5.162
  283    HG   SER  41           HG       SER  41  20.418   8.795   5.909
  284    H    GLY  42           H        GLY  42  22.855  12.558   5.087
  285    HA2  GLY  42           1HA      GLY  42  22.824  14.305   2.875
  286    HA3  GLY  42           2HA      GLY  42  24.181  14.057   3.963
  287    HA   PRO  43           HA       PRO  43  24.508  11.631  -0.242
  288    HB2  PRO  43           1HB      PRO  43  24.767  13.536  -2.159
  289    HB3  PRO  43           2HB      PRO  43  23.213  12.810  -1.730
  290    HG2  PRO  43           1HG      PRO  43  24.382  15.429  -0.872
  291    HG3  PRO  43           2HG      PRO  43  22.723  15.055  -1.376
  292    HD2  PRO  43           1HD      PRO  43  23.435  15.304   1.225
  293    HD3  PRO  43           2HD      PRO  43  22.157  14.196   0.686
  294    H    SER  44           H        SER  44  26.007  14.415   1.137
  295    HA   SER  44           HA       SER  44  28.173  15.074   1.358
  296    HB2  SER  44           1HB      SER  44  28.769  12.217   0.550
  297    HB3  SER  44           2HB      SER  44  29.901  13.329   1.321
  298    HG   SER  44           HG       SER  44  28.603  13.331   3.151
  299    H    SER  45           H        SER  45  26.982  15.746  -1.039
  300    HA   SER  45           HA       SER  45  28.482  15.037  -3.324
  301    HB2  SER  45           1HB      SER  45  26.737  17.435  -2.736
  302    HB3  SER  45           2HB      SER  45  27.453  17.119  -4.316
  303    HG   SER  45           HG       SER  45  25.191  16.268  -3.631
  304    H    GLY  46           H        GLY  46  28.725  17.744  -1.051
  305    HA2  GLY  46           1HA      GLY  46  30.776  18.752  -0.437
  306    HA3  GLY  46           2HA      GLY  46  31.493  18.138  -1.919
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1  10.047 -19.355  18.074
    2    HA2  GLY   1           1HA      GLY   1   8.291 -17.928  19.310
    3    HA3  GLY   1           2HA      GLY   1   9.471 -16.647  19.075
    4    H    SER   2           H        SER   2   6.733 -18.038  17.844
    5    HA   SER   2           HA       SER   2   6.987 -16.532  15.375
    6    HB2  SER   2           1HB      SER   2   6.396 -18.387  13.923
    7    HB3  SER   2           2HB      SER   2   7.857 -18.799  14.821
    8    HG   SER   2           HG       SER   2   5.279 -19.551  15.707
    9    H    SER   3           H        SER   3   4.974 -16.111  14.350
   10    HA   SER   3           HA       SER   3   2.666 -16.534  16.130
   11    HB2  SER   3           1HB      SER   3   3.439 -14.159  15.766
   12    HB3  SER   3           2HB      SER   3   2.983 -14.341  14.072
   13    HG   SER   3           HG       SER   3   1.425 -13.571  15.967
   14    H    GLY   4           H        GLY   4   0.515 -16.420  14.907
   15    HA2  GLY   4           1HA      GLY   4   0.622 -17.477  12.198
   16    HA3  GLY   4           2HA      GLY   4   0.004 -18.576  13.422
   17    H    SER   5           H        SER   5  -0.944 -16.537  11.086
   18    HA   SER   5           HA       SER   5  -3.621 -16.354  12.142
   19    HB2  SER   5           1HB      SER   5  -2.566 -14.318  13.074
   20    HB3  SER   5           2HB      SER   5  -2.133 -13.811  11.441
   21    HG   SER   5           HG       SER   5  -4.621 -14.221  11.206
   22    H    SER   6           H        SER   6  -5.085 -16.509  10.549
   23    HA   SER   6           HA       SER   6  -4.133 -16.135   7.784
   24    HB2  SER   6           1HB      SER   6  -5.618 -17.935   7.095
   25    HB3  SER   6           2HB      SER   6  -4.560 -18.511   8.383
   26    HG   SER   6           HG       SER   6  -6.442 -19.133   9.158
   27    H    GLY   7           H        GLY   7  -5.585 -15.267   6.263
   28    HA2  GLY   7           1HA      GLY   7  -8.246 -14.507   6.910
   29    HA3  GLY   7           2HA      GLY   7  -7.155 -13.143   7.108
   30    H    SER   8           H        SER   8  -9.302 -14.335   5.054
   31    HA   SER   8           HA       SER   8  -7.765 -13.632   2.643
   32    HB2  SER   8           1HB      SER   8  -8.738 -15.900   2.627
   33    HB3  SER   8           2HB      SER   8 -10.343 -15.208   2.862
   34    HG   SER   8           HG       SER   8 -10.263 -14.327   0.850
   35    H    SER   9           H        SER   9  -8.662 -11.567   4.266
   36    HA   SER   9           HA       SER   9 -11.185 -10.563   3.343
   37    HB2  SER   9           1HB      SER   9 -10.410  -9.947   5.558
   38    HB3  SER   9           2HB      SER   9  -8.943  -9.235   4.885
   39    HG   SER   9           HG       SER   9 -10.169  -7.627   3.955
   40    H    THR  10           H        THR  10 -11.593  -9.407   1.579
   41    HA   THR  10           HA       THR  10  -9.394  -8.686  -0.176
   42    HB   THR  10           HB       THR  10 -12.376  -8.441  -0.621
   43    HG1  THR  10           HG1      THR  10 -10.539 -10.513  -0.952
   44   HG21  THR  10          3HG2      THR  10 -11.055  -8.650  -3.062
   45   HG22  THR  10          1HG2      THR  10 -10.082  -7.515  -2.128
   46   HG23  THR  10          2HG2      THR  10 -11.798  -7.200  -2.386
   47    H    LYS  11           H        LYS  11  -8.924  -6.620  -0.890
   48    HA   LYS  11           HA       LYS  11 -10.172  -4.433   0.643
   49    HB2  LYS  11           1HB      LYS  11  -8.090  -3.307   0.742
   50    HB3  LYS  11           2HB      LYS  11  -7.753  -4.977   1.175
   51    HG2  LYS  11           1HG      LYS  11  -7.465  -4.211  -1.674
   52    HG3  LYS  11           2HG      LYS  11  -6.250  -3.630  -0.533
   53    HD2  LYS  11           1HD      LYS  11  -7.058  -6.516  -0.579
   54    HD3  LYS  11           2HD      LYS  11  -5.867  -5.894  -1.723
   55    HE2  LYS  11           1HE      LYS  11  -4.466  -6.525  -0.040
   56    HE3  LYS  11           2HE      LYS  11  -4.820  -4.880   0.488
   57    HZ1  LYS  11           3HZ      LYS  11  -6.107  -5.606   2.198
   58    HZ2  LYS  11           1HZ      LYS  11  -5.042  -6.917   2.106
   59    HZ3  LYS  11           2HZ      LYS  11  -6.580  -7.027   1.412
   60    H    SER  12           H        SER  12  -9.535  -2.233  -0.544
   61    HA   SER  12           HA       SER  12 -10.012  -2.547  -3.427
   62    HB2  SER  12           1HB      SER  12 -11.765  -0.934  -3.437
   63    HB3  SER  12           2HB      SER  12 -12.148  -2.058  -2.133
   64    HG   SER  12           HG       SER  12 -11.254  -0.536  -0.673
   65    H    HIS  13           H        HIS  13  -9.122  -0.340  -0.800
   66    HA   HIS  13           HA       HIS  13  -7.657   1.332  -2.707
   67    HB2  HIS  13           1HB      HIS  13  -8.091   1.863   0.234
   68    HB3  HIS  13           2HB      HIS  13  -7.588   3.012  -1.003
   69    HD1  HIS  13           HD1      HIS  13  -9.467   3.666  -2.792
   70    HD2  HIS  13           HD2      HIS  13 -10.796   1.650   0.589
   71    HE1  HIS  13           HE1      HIS  13 -11.954   4.031  -2.726
   72    H    GLN  14           H        GLN  14  -5.976  -0.231  -3.047
   73    HA   GLN  14           HA       GLN  14  -4.259  -0.851  -0.778
   74    HB2  GLN  14           1HB      GLN  14  -4.923  -2.466  -2.708
   75    HB3  GLN  14           2HB      GLN  14  -3.674  -1.626  -3.617
   76    HG2  GLN  14           1HG      GLN  14  -2.166  -2.164  -1.593
   77    HG3  GLN  14           2HG      GLN  14  -3.404  -3.354  -1.195
   78   HE21  GLN  14          1HE2      GLN  14  -0.517  -3.072  -2.567
   79   HE22  GLN  14          2HE2      GLN  14  -0.591  -4.332  -3.746
   80    H    CYS  15           H        CYS  15  -2.103  -0.230  -0.611
   81    HA   CYS  15           HA       CYS  15  -1.488   2.303  -1.872
   82    HB2  CYS  15           1HB      CYS  15  -1.086   1.798   0.577
   83    HB3  CYS  15           2HB      CYS  15   0.230   0.746   0.064
   84    H    HIS  16           H        HIS  16   0.589   2.726  -2.884
   85    HA   HIS  16           HA       HIS  16   1.545   0.392  -4.403
   86    HB2  HIS  16           1HB      HIS  16   1.280   3.299  -5.118
   87    HB3  HIS  16           2HB      HIS  16   2.398   2.257  -5.994
   88    HD1  HIS  16           HD1      HIS  16  -1.293   2.606  -5.255
   89    HD2  HIS  16           HD2      HIS  16   1.249   0.681  -7.918
   90    HE1  HIS  16           HE1      HIS  16  -2.791   1.599  -7.005
   91    H    GLU  17           H        GLU  17   2.430   2.858  -2.192
   92    HA   GLU  17           HA       GLU  17   5.229   2.894  -2.750
   93    HB2  GLU  17           1HB      GLU  17   3.921   3.638  -0.137
   94    HB3  GLU  17           2HB      GLU  17   5.450   4.220  -0.780
   95    HG2  GLU  17           1HG      GLU  17   2.730   4.801  -1.929
   96    HG3  GLU  17           2HG      GLU  17   3.692   5.901  -0.944
   97    H    CYS  18           H        CYS  18   3.156   1.123  -0.515
   98    HA   CYS  18           HA       CYS  18   5.457  -0.599   0.136
   99    HB2  CYS  18           1HB      CYS  18   4.436  -0.958   2.370
  100    HB3  CYS  18           2HB      CYS  18   4.912   0.716   2.099
  101    H    GLY  19           H        GLY  19   1.965  -0.369  -0.328
  102    HA2  GLY  19           1HA      GLY  19   0.743  -1.987  -1.571
  103    HA3  GLY  19           2HA      GLY  19   1.969  -3.180  -1.168
  104    H    ARG  20           H        ARG  20  -0.042  -0.981   0.787
  105    HA   ARG  20           HA       ARG  20  -0.653  -3.220   2.563
  106    HB2  ARG  20           1HB      ARG  20  -0.722  -0.248   2.815
  107    HB3  ARG  20           2HB      ARG  20  -1.795  -1.196   3.836
  108    HG2  ARG  20           1HG      ARG  20   0.383  -2.529   4.386
  109    HG3  ARG  20           2HG      ARG  20   1.179  -1.058   3.825
  110    HD2  ARG  20           1HD      ARG  20   0.142   0.254   5.493
  111    HD3  ARG  20           2HD      ARG  20  -1.006  -1.025   5.889
  112    HE   ARG  20           HE       ARG  20   1.774  -1.688   6.331
  113   HH11  ARG  20          1HH1      ARG  20  -1.165  -0.408   7.689
  114   HH12  ARG  20          2HH1      ARG  20  -0.704  -0.735   9.327
  115   HH21  ARG  20          1HH2      ARG  20   2.392  -2.123   8.483
  116   HH22  ARG  20          2HH2      ARG  20   1.319  -1.710   9.777
  117    H    GLY  21           H        GLY  21  -2.980  -2.996   3.567
  118    HA2  GLY  21           1HA      GLY  21  -4.895  -2.580   1.358
  119    HA3  GLY  21           2HA      GLY  21  -4.952  -4.022   2.361
  120    H    PHE  22           H        PHE  22  -6.202  -0.971   1.916
  121    HA   PHE  22           HA       PHE  22  -7.166  -0.870   4.699
  122    HB2  PHE  22           1HB      PHE  22  -6.841   1.464   2.802
  123    HB3  PHE  22           2HB      PHE  22  -7.358   1.546   4.483
  124    HD1  PHE  22           HD1      PHE  22  -5.750   1.067   6.294
  125    HD2  PHE  22           HD2      PHE  22  -4.549   1.309   2.218
  126    HE1  PHE  22           HE1      PHE  22  -3.408   1.324   7.003
  127    HE2  PHE  22           HE2      PHE  22  -2.205   1.565   2.920
  128    HZ   PHE  22           HZ       PHE  22  -1.631   1.573   5.315
  129    H    THR  23           H        THR  23  -9.241  -1.345   4.900
  130    HA   THR  23           HA       THR  23 -10.997  -1.849   2.813
  131    HB   THR  23           HB       THR  23 -11.756  -1.009   5.618
  132    HG1  THR  23           HG1      THR  23 -11.347  -3.039   6.202
  133   HG21  THR  23          3HG2      THR  23 -13.621  -0.988   4.002
  134   HG22  THR  23          1HG2      THR  23 -13.807  -2.250   5.219
  135   HG23  THR  23          2HG2      THR  23 -13.265  -2.666   3.593
  136    H    LEU  24           H        LEU  24 -10.859   1.039   4.898
  137    HA   LEU  24           HA       LEU  24 -12.710   2.429   3.136
  138    HB2  LEU  24           1HB      LEU  24 -11.453   3.073   5.782
  139    HB3  LEU  24           2HB      LEU  24 -12.298   4.304   4.844
  140    HG   LEU  24           HG       LEU  24 -13.657   1.738   5.595
  141   HD11  LEU  24          1HD1      LEU  24 -12.601   3.447   7.487
  142   HD12  LEU  24          2HD1      LEU  24 -13.924   2.307   7.730
  143   HD13  LEU  24          3HD1      LEU  24 -14.272   3.987   7.321
  144   HD21  LEU  24          3HD2      LEU  24 -14.454   4.449   4.638
  145   HD22  LEU  24          1HD2      LEU  24 -15.580   3.510   5.618
  146   HD23  LEU  24          2HD2      LEU  24 -14.986   2.859   4.090
  147    H    LYS  25           H        LYS  25 -12.227   4.365   2.058
  148    HA   LYS  25           HA       LYS  25  -9.704   4.480   0.826
  149    HB2  LYS  25           1HB      LYS  25 -12.069   5.462   0.149
  150    HB3  LYS  25           2HB      LYS  25 -11.438   6.908   0.926
  151    HG2  LYS  25           1HG      LYS  25  -9.932   5.455  -1.226
  152    HG3  LYS  25           2HG      LYS  25 -11.116   6.716  -1.577
  153    HD2  LYS  25           1HD      LYS  25  -9.827   8.376  -0.591
  154    HD3  LYS  25           2HD      LYS  25  -8.905   7.224   0.376
  155    HE2  LYS  25           1HE      LYS  25  -7.385   7.847  -1.258
  156    HE3  LYS  25           2HE      LYS  25  -8.057   6.352  -1.907
  157    HZ1  LYS  25           3HZ      LYS  25  -9.264   8.934  -2.638
  158    HZ2  LYS  25           1HZ      LYS  25  -9.257   7.476  -3.495
  159    HZ3  LYS  25           2HZ      LYS  25  -7.855   8.419  -3.418
  160    H    SER  26           H        SER  26 -11.177   6.740   3.161
  161    HA   SER  26           HA       SER  26  -9.161   8.517   3.532
  162    HB2  SER  26           1HB      SER  26  -9.962   8.811   5.846
  163    HB3  SER  26           2HB      SER  26 -11.306   8.663   4.713
  164    HG   SER  26           HG       SER  26 -10.991   7.275   6.856
  165    H    HIS  27           H        HIS  27  -9.387   5.294   4.977
  166    HA   HIS  27           HA       HIS  27  -7.231   5.373   6.702
  167    HB2  HIS  27           1HB      HIS  27  -8.413   3.142   5.065
  168    HB3  HIS  27           2HB      HIS  27  -7.034   2.863   6.124
  169    HD1  HIS  27           HD1      HIS  27  -9.815   1.529   6.575
  170    HD2  HIS  27           HD2      HIS  27  -8.489   4.981   8.469
  171    HE1  HIS  27           HE1      HIS  27 -11.152   1.686   8.699
  172    H    LEU  28           H        LEU  28  -7.186   4.264   3.311
  173    HA   LEU  28           HA       LEU  28  -4.414   3.896   3.145
  174    HB2  LEU  28           1HB      LEU  28  -5.778   2.909   1.489
  175    HB3  LEU  28           2HB      LEU  28  -6.517   4.454   1.072
  176    HG   LEU  28           HG       LEU  28  -4.246   5.159   0.205
  177   HD11  LEU  28          1HD1      LEU  28  -2.912   3.480   1.364
  178   HD12  LEU  28          2HD1      LEU  28  -2.689   3.374  -0.382
  179   HD13  LEU  28          3HD1      LEU  28  -3.712   2.201   0.449
  180   HD21  LEU  28          3HD2      LEU  28  -4.569   4.072  -1.919
  181   HD22  LEU  28          1HD2      LEU  28  -6.144   4.451  -1.221
  182   HD23  LEU  28          2HD2      LEU  28  -5.530   2.799  -1.165
  183    H    ASN  29           H        ASN  29  -6.424   6.686   2.245
  184    HA   ASN  29           HA       ASN  29  -4.451   8.329   1.205
  185    HB2  ASN  29           1HB      ASN  29  -6.825   8.885   1.073
  186    HB3  ASN  29           2HB      ASN  29  -6.888   9.116   2.818
  187   HD21  ASN  29          1HD2      ASN  29  -6.956  11.163   3.351
  188   HD22  ASN  29          2HD2      ASN  29  -6.141  12.458   2.550
  189    H    GLN  30           H        GLN  30  -5.703   8.422   4.547
  190    HA   GLN  30           HA       GLN  30  -3.770  10.189   5.535
  191    HB2  GLN  30           1HB      GLN  30  -5.719   9.887   6.835
  192    HB3  GLN  30           2HB      GLN  30  -5.526   8.139   6.867
  193    HG2  GLN  30           1HG      GLN  30  -4.985   9.055   9.020
  194    HG3  GLN  30           2HG      GLN  30  -3.527   8.406   8.271
  195   HE21  GLN  30          1HE2      GLN  30  -1.805   9.635   8.428
  196   HE22  GLN  30          2HE2      GLN  30  -1.787  11.353   8.608
  197    H    HIS  31           H        HIS  31  -3.495   6.934   4.624
  198    HA   HIS  31           HA       HIS  31  -1.286   6.315   6.390
  199    HB2  HIS  31           1HB      HIS  31  -2.399   4.358   5.958
  200    HB3  HIS  31           2HB      HIS  31  -2.856   4.851   4.330
  201    HD1  HIS  31           HD1      HIS  31   0.009   3.354   6.254
  202    HD2  HIS  31           HD2      HIS  31  -1.136   4.043   2.320
  203    HE1  HIS  31           HE1      HIS  31   1.653   2.079   4.842
  204    H    GLN  32           H        GLN  32  -1.750   6.868   2.909
  205    HA   GLN  32           HA       GLN  32   0.843   6.523   2.035
  206    HB2  GLN  32           1HB      GLN  32  -1.444   8.199   1.104
  207    HB3  GLN  32           2HB      GLN  32   0.134   8.456   0.372
  208    HG2  GLN  32           1HG      GLN  32   0.182   6.364  -0.590
  209    HG3  GLN  32           2HG      GLN  32  -0.976   5.695   0.560
  210   HE21  GLN  32          1HE2      GLN  32  -1.496   5.058  -1.903
  211   HE22  GLN  32          2HE2      GLN  32  -2.784   5.990  -2.578
  212    H    ARG  33           H        ARG  33  -0.487   9.087   3.935
  213    HA   ARG  33           HA       ARG  33   1.226  11.192   3.439
  214    HB2  ARG  33           1HB      ARG  33   0.366  10.443   6.226
  215    HB3  ARG  33           2HB      ARG  33   0.631  12.050   5.562
  216    HG2  ARG  33           1HG      ARG  33  -1.674  10.194   5.131
  217    HG3  ARG  33           2HG      ARG  33  -1.680  11.869   5.686
  218    HD2  ARG  33           1HD      ARG  33  -0.821  11.038   2.923
  219    HD3  ARG  33           2HD      ARG  33  -2.473  11.502   3.325
  220    HE   ARG  33           HE       ARG  33  -0.232  13.246   2.962
  221   HH11  ARG  33          1HH1      ARG  33  -3.291  12.860   4.579
  222   HH12  ARG  33          2HH1      ARG  33  -3.567  14.562   4.744
  223   HH21  ARG  33          1HH2      ARG  33  -0.584  15.490   3.173
  224   HH22  ARG  33          2HH2      ARG  33  -2.027  16.057   3.943
  225    H    ILE  34           H        ILE  34   1.909   8.158   4.917
  226    HA   ILE  34           HA       ILE  34   4.228   8.928   6.373
  227    HB   ILE  34           HB       ILE  34   4.660   6.623   6.693
  228   HG12  ILE  34          1HG1      ILE  34   2.853   6.142   4.315
  229   HG13  ILE  34          2HG1      ILE  34   4.588   5.855   4.397
  230   HG21  ILE  34          1HG2      ILE  34   2.885   6.862   8.055
  231   HG22  ILE  34          2HG2      ILE  34   1.866   7.533   6.782
  232   HG23  ILE  34          3HG2      ILE  34   2.097   5.789   6.899
  233   HD11  ILE  34          3HD1      ILE  34   2.343   4.272   5.516
  234   HD12  ILE  34          1HD1      ILE  34   3.807   3.739   4.689
  235   HD13  ILE  34          2HD1      ILE  34   3.886   4.266   6.371
  236    H    HIS  35           H        HIS  35   3.642   7.844   3.085
  237    HA   HIS  35           HA       HIS  35   6.467   7.644   2.480
  238    HB2  HIS  35           1HB      HIS  35   4.150   7.554   0.544
  239    HB3  HIS  35           2HB      HIS  35   5.784   6.952   0.284
  240    HD1  HIS  35           HD1      HIS  35   6.436   4.957   2.140
  241    HD2  HIS  35           HD2      HIS  35   2.431   5.594   1.234
  242    HE1  HIS  35           HE1      HIS  35   5.248   2.851   2.829
  243    H    THR  36           H        THR  36   5.173  10.225   3.317
  244    HA   THR  36           HA       THR  36   5.170  11.937   1.029
  245    HB   THR  36           HB       THR  36   3.881  12.499   3.045
  246    HG1  THR  36           HG1      THR  36   5.928  14.433   2.629
  247   HG21  THR  36          3HG2      THR  36   6.582  12.927   4.327
  248   HG22  THR  36          1HG2      THR  36   5.435  11.652   4.734
  249   HG23  THR  36          2HG2      THR  36   5.026  13.339   5.045
  250    H    GLY  37           H        GLY  37   7.552  10.989   3.430
  251    HA2  GLY  37           1HA      GLY  37   9.576  12.476   1.880
  252    HA3  GLY  37           2HA      GLY  37   9.573  12.517   3.637
  253    H    GLU  38           H        GLU  38  10.586  10.934   4.744
  254    HA   GLU  38           HA       GLU  38  12.208   9.090   3.249
  255    HB2  GLU  38           1HB      GLU  38  12.843  10.339   5.408
  256    HB3  GLU  38           2HB      GLU  38  11.900   9.111   6.242
  257    HG2  GLU  38           1HG      GLU  38  14.074   8.315   6.355
  258    HG3  GLU  38           2HG      GLU  38  13.369   7.415   5.013
  259    H    LYS  39           H        LYS  39  12.112   6.856   3.254
  260    HA   LYS  39           HA       LYS  39   9.517   5.736   4.063
  261    HB2  LYS  39           1HB      LYS  39  10.228   5.635   1.637
  262    HB3  LYS  39           2HB      LYS  39  11.502   4.530   2.135
  263    HG2  LYS  39           1HG      LYS  39   9.992   2.851   2.703
  264    HG3  LYS  39           2HG      LYS  39   8.632   3.973   2.781
  265    HD2  LYS  39           1HD      LYS  39   9.175   4.338   0.247
  266    HD3  LYS  39           2HD      LYS  39   9.972   2.770   0.397
  267    HE2  LYS  39           1HE      LYS  39   7.139   3.248   1.290
  268    HE3  LYS  39           2HE      LYS  39   7.546   2.751  -0.352
  269    HZ1  LYS  39           3HZ      LYS  39   7.119   1.087   1.752
  270    HZ2  LYS  39           1HZ      LYS  39   8.807   1.130   1.646
  271    HZ3  LYS  39           2HZ      LYS  39   7.887   0.667   0.305
  272    HA   PRO  40           HA       PRO  40  11.653   3.531   7.263
  273    HB2  PRO  40           1HB      PRO  40   9.578   1.939   7.990
  274    HB3  PRO  40           2HB      PRO  40   9.680   3.646   8.435
  275    HG2  PRO  40           1HG      PRO  40   8.136   2.355   6.219
  276    HG3  PRO  40           2HG      PRO  40   7.631   3.635   7.337
  277    HD2  PRO  40           1HD      PRO  40   8.434   4.149   4.803
  278    HD3  PRO  40           2HD      PRO  40   8.712   5.282   6.141
  279    H    SER  41           H        SER  41  12.650   1.558   7.526
  280    HA   SER  41           HA       SER  41  12.579  -0.208   5.216
  281    HB2  SER  41           1HB      SER  41  14.391  -0.203   7.643
  282    HB3  SER  41           2HB      SER  41  14.575  -1.250   6.236
  283    HG   SER  41           HG       SER  41  14.423   1.511   5.824
  284    H    GLY  42           H        GLY  42  11.486  -2.057   5.163
  285    HA2  GLY  42           1HA      GLY  42  10.846  -3.387   7.715
  286    HA3  GLY  42           2HA      GLY  42   9.590  -3.106   6.519
  287    HA   PRO  43           HA       PRO  43  12.044  -7.154   5.826
  288    HB2  PRO  43           1HB      PRO  43  10.333  -8.914   6.984
  289    HB3  PRO  43           2HB      PRO  43  11.674  -8.162   7.857
  290    HG2  PRO  43           1HG      PRO  43   8.772  -7.424   7.841
  291    HG3  PRO  43           2HG      PRO  43   9.896  -7.516   9.210
  292    HD2  PRO  43           1HD      PRO  43   9.219  -5.172   8.036
  293    HD3  PRO  43           2HD      PRO  43  10.818  -5.453   8.754
  294    H    SER  44           H        SER  44  11.578  -7.082   3.664
  295    HA   SER  44           HA       SER  44   9.073  -8.347   2.846
  296    HB2  SER  44           1HB      SER  44   9.963  -5.593   2.105
  297    HB3  SER  44           2HB      SER  44   9.145  -6.566   0.882
  298    HG   SER  44           HG       SER  44   7.984  -5.157   2.687
  299    H    SER  45           H        SER  45   9.153  -9.331   0.772
  300    HA   SER  45           HA       SER  45  10.279 -10.863  -0.548
  301    HB2  SER  45           1HB      SER  45  11.258  -9.774  -2.425
  302    HB3  SER  45           2HB      SER  45  10.016  -8.675  -1.826
  303    HG   SER  45           HG       SER  45  11.900  -7.760  -0.566
  304    H    GLY  46           H        GLY  46  11.469 -10.948   1.924
  305    HA2  GLY  46           1HA      GLY  46  13.869 -12.203   1.500
  306    HA3  GLY  46           2HA      GLY  46  14.299 -10.520   1.765
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1   5.173  -1.351  11.120
    2    HA2  GLY   1           1HA      GLY   1   4.975  -3.120   9.553
    3    HA3  GLY   1           2HA      GLY   1   5.410  -3.933  11.049
    4    H    SER   2           H        SER   2   4.024  -5.365  11.925
    5    HA   SER   2           HA       SER   2   1.567  -5.893  10.439
    6    HB2  SER   2           1HB      SER   2   3.183  -7.743  10.886
    7    HB3  SER   2           2HB      SER   2   2.867  -7.554  12.611
    8    HG   SER   2           HG       SER   2   1.605  -9.204  11.456
    9    H    SER   3           H        SER   3  -0.455  -6.143  11.446
   10    HA   SER   3           HA       SER   3  -0.727  -4.579  13.912
   11    HB2  SER   3           1HB      SER   3  -3.146  -4.453  13.263
   12    HB3  SER   3           2HB      SER   3  -2.053  -3.735  12.080
   13    HG   SER   3           HG       SER   3  -3.070  -6.380  11.919
   14    H    GLY   4           H        GLY   4  -0.297  -6.087  15.497
   15    HA2  GLY   4           1HA      GLY   4  -0.576  -7.986  16.789
   16    HA3  GLY   4           2HA      GLY   4  -2.267  -7.529  16.655
   17    H    SER   5           H        SER   5  -3.256  -9.462  16.474
   18    HA   SER   5           HA       SER   5  -2.263 -11.341  14.444
   19    HB2  SER   5           1HB      SER   5  -4.144 -11.766  16.777
   20    HB3  SER   5           2HB      SER   5  -3.725 -13.007  15.596
   21    HG   SER   5           HG       SER   5  -2.314 -13.298  17.236
   22    H    SER   6           H        SER   6  -5.293  -9.931  15.665
   23    HA   SER   6           HA       SER   6  -7.111 -10.903  13.889
   24    HB2  SER   6           1HB      SER   6  -7.736  -9.398  15.708
   25    HB3  SER   6           2HB      SER   6  -6.931  -8.054  14.900
   26    HG   SER   6           HG       SER   6  -8.535  -8.923  13.106
   27    H    GLY   7           H        GLY   7  -7.353 -10.888  11.755
   28    HA2  GLY   7           1HA      GLY   7  -6.280  -8.628  10.213
   29    HA3  GLY   7           2HA      GLY   7  -5.780 -10.258   9.786
   30    H    SER   8           H        SER   8  -6.958  -8.757   7.878
   31    HA   SER   8           HA       SER   8  -9.309 -10.306   7.280
   32    HB2  SER   8           1HB      SER   8 -10.360  -8.549   8.582
   33    HB3  SER   8           2HB      SER   8  -9.527  -7.309   7.645
   34    HG   SER   8           HG       SER   8 -11.740  -8.850   6.993
   35    H    SER   9           H        SER   9  -9.418 -10.679   5.154
   36    HA   SER   9           HA       SER   9  -7.427  -9.568   3.424
   37    HB2  SER   9           1HB      SER   9  -8.495 -10.999   1.688
   38    HB3  SER   9           2HB      SER   9  -8.086 -11.890   3.154
   39    HG   SER   9           HG       SER   9 -10.165 -12.108   3.627
   40    H    THR  10           H        THR  10 -10.979  -9.413   3.527
   41    HA   THR  10           HA       THR  10 -11.685  -7.993   1.387
   42    HB   THR  10           HB       THR  10 -12.548  -7.174   4.167
   43    HG1  THR  10           HG1      THR  10 -12.973  -9.333   4.007
   44   HG21  THR  10          3HG2      THR  10 -14.296  -6.057   3.228
   45   HG22  THR  10          1HG2      THR  10 -14.379  -7.134   1.835
   46   HG23  THR  10          2HG2      THR  10 -13.143  -5.877   1.906
   47    H    LYS  11           H        LYS  11 -10.725  -6.376   0.355
   48    HA   LYS  11           HA       LYS  11  -9.980  -3.981   1.863
   49    HB2  LYS  11           1HB      LYS  11  -7.885  -5.124   1.676
   50    HB3  LYS  11           2HB      LYS  11  -8.169  -5.493  -0.020
   51    HG2  LYS  11           1HG      LYS  11  -8.266  -2.853  -0.195
   52    HG3  LYS  11           2HG      LYS  11  -7.263  -2.975   1.252
   53    HD2  LYS  11           1HD      LYS  11  -5.730  -2.925  -0.519
   54    HD3  LYS  11           2HD      LYS  11  -5.849  -4.633  -0.091
   55    HE2  LYS  11           1HE      LYS  11  -5.906  -4.428  -2.484
   56    HE3  LYS  11           2HE      LYS  11  -7.501  -4.923  -1.918
   57    HZ1  LYS  11           3HZ      LYS  11  -7.717  -3.214  -3.574
   58    HZ2  LYS  11           1HZ      LYS  11  -6.689  -2.179  -2.715
   59    HZ3  LYS  11           2HZ      LYS  11  -8.202  -2.589  -2.079
   60    H    SER  12           H        SER  12 -10.164  -2.063   0.726
   61    HA   SER  12           HA       SER  12 -11.514  -2.298  -1.878
   62    HB2  SER  12           1HB      SER  12 -12.647  -1.187   0.181
   63    HB3  SER  12           2HB      SER  12 -11.578   0.173  -0.165
   64    HG   SER  12           HG       SER  12 -12.556   0.460  -2.104
   65    H    HIS  13           H        HIS  13  -9.074  -0.449  -0.102
   66    HA   HIS  13           HA       HIS  13  -7.949   0.393  -2.692
   67    HB2  HIS  13           1HB      HIS  13  -7.662   2.015  -0.172
   68    HB3  HIS  13           2HB      HIS  13  -7.397   2.521  -1.838
   69    HD1  HIS  13           HD1      HIS  13  -9.481   3.162  -3.229
   70    HD2  HIS  13           HD2      HIS  13 -10.318   2.102   0.700
   71    HE1  HIS  13           HE1      HIS  13 -11.854   3.892  -2.827
   72    H    GLN  14           H        GLN  14  -5.739   0.291  -2.932
   73    HA   GLN  14           HA       GLN  14  -4.221  -0.838  -0.676
   74    HB2  GLN  14           1HB      GLN  14  -4.690  -2.635  -2.237
   75    HB3  GLN  14           2HB      GLN  14  -4.088  -1.670  -3.578
   76    HG2  GLN  14           1HG      GLN  14  -1.892  -1.630  -2.145
   77    HG3  GLN  14           2HG      GLN  14  -2.592  -3.083  -1.434
   78   HE21  GLN  14          1HE2      GLN  14  -0.209  -2.721  -3.112
   79   HE22  GLN  14          2HE2      GLN  14  -0.431  -3.765  -4.471
   80    H    CYS  15           H        CYS  15  -2.123  -0.144  -0.426
   81    HA   CYS  15           HA       CYS  15  -1.470   2.352  -1.724
   82    HB2  CYS  15           1HB      CYS  15  -1.110   1.918   0.726
   83    HB3  CYS  15           2HB      CYS  15   0.176   0.801   0.281
   84    H    HIS  16           H        HIS  16   0.444   2.780  -2.889
   85    HA   HIS  16           HA       HIS  16   1.518   0.417  -4.269
   86    HB2  HIS  16           1HB      HIS  16   1.064   3.256  -5.099
   87    HB3  HIS  16           2HB      HIS  16   2.325   2.320  -5.897
   88    HD1  HIS  16           HD1      HIS  16   1.298  -0.183  -6.729
   89    HD2  HIS  16           HD2      HIS  16  -1.284   3.055  -6.401
   90    HE1  HIS  16           HE1      HIS  16  -0.694  -0.766  -8.148
   91    H    GLU  17           H        GLU  17   2.319   2.896  -2.083
   92    HA   GLU  17           HA       GLU  17   5.102   3.108  -2.681
   93    HB2  GLU  17           1HB      GLU  17   3.822   3.703  -0.018
   94    HB3  GLU  17           2HB      GLU  17   5.277   4.413  -0.704
   95    HG2  GLU  17           1HG      GLU  17   2.491   4.800  -1.776
   96    HG3  GLU  17           2HG      GLU  17   3.355   5.939  -0.744
   97    H    CYS  18           H        CYS  18   3.188   1.211  -0.394
   98    HA   CYS  18           HA       CYS  18   5.597  -0.389   0.174
   99    HB2  CYS  18           1HB      CYS  18   4.538  -0.903   2.388
  100    HB3  CYS  18           2HB      CYS  18   5.006   0.782   2.185
  101    H    GLY  19           H        GLY  19   2.105  -0.395  -0.319
  102    HA2  GLY  19           1HA      GLY  19   1.102  -2.101  -1.690
  103    HA3  GLY  19           2HA      GLY  19   2.314  -3.228  -1.099
  104    H    ARG  20           H        ARG  20   0.425  -0.989   0.864
  105    HA   ARG  20           HA       ARG  20  -0.530  -3.247   2.438
  106    HB2  ARG  20           1HB      ARG  20  -0.364  -0.289   2.866
  107    HB3  ARG  20           2HB      ARG  20  -1.493  -1.236   3.826
  108    HG2  ARG  20           1HG      ARG  20   0.642  -2.729   4.234
  109    HG3  ARG  20           2HG      ARG  20   1.475  -1.221   3.848
  110    HD2  ARG  20           1HD      ARG  20   1.234  -1.019   6.124
  111    HD3  ARG  20           2HD      ARG  20  -0.220  -0.199   5.558
  112    HE   ARG  20           HE       ARG  20  -1.067  -2.733   5.889
  113   HH11  ARG  20          1HH1      ARG  20   0.699  -0.549   7.947
  114   HH12  ARG  20          2HH1      ARG  20   0.069  -1.217   9.416
  115   HH21  ARG  20          1HH2      ARG  20  -1.903  -3.621   7.816
  116   HH22  ARG  20          2HH2      ARG  20  -1.410  -2.965   9.341
  117    H    GLY  21           H        GLY  21  -2.849  -2.962   3.327
  118    HA2  GLY  21           1HA      GLY  21  -4.638  -2.089   1.148
  119    HA3  GLY  21           2HA      GLY  21  -4.836  -3.663   1.905
  120    H    PHE  22           H        PHE  22  -6.409  -0.990   1.742
  121    HA   PHE  22           HA       PHE  22  -7.179  -1.013   4.577
  122    HB2  PHE  22           1HB      PHE  22  -6.893   1.457   2.852
  123    HB3  PHE  22           2HB      PHE  22  -7.531   1.428   4.492
  124    HD1  PHE  22           HD1      PHE  22  -6.070   1.105   6.394
  125    HD2  PHE  22           HD2      PHE  22  -4.532   1.199   2.426
  126    HE1  PHE  22           HE1      PHE  22  -3.795   1.395   7.286
  127    HE2  PHE  22           HE2      PHE  22  -2.255   1.488   3.312
  128    HZ   PHE  22           HZ       PHE  22  -1.884   1.585   5.744
  129    H    THR  23           H        THR  23  -9.335  -0.993   4.973
  130    HA   THR  23           HA       THR  23 -11.112  -1.691   2.892
  131    HB   THR  23           HB       THR  23 -12.887  -1.194   4.730
  132    HG1  THR  23           HG1      THR  23 -12.033  -1.015   6.798
  133   HG21  THR  23          3HG2      THR  23 -12.262  -3.442   4.153
  134   HG22  THR  23          1HG2      THR  23 -12.273  -3.308   5.911
  135   HG23  THR  23          2HG2      THR  23 -10.742  -3.296   5.034
  136    H    LEU  24           H        LEU  24 -11.021   1.232   4.939
  137    HA   LEU  24           HA       LEU  24 -12.802   2.603   3.099
  138    HB2  LEU  24           1HB      LEU  24 -11.554   3.399   5.720
  139    HB3  LEU  24           2HB      LEU  24 -12.557   4.482   4.757
  140    HG   LEU  24           HG       LEU  24 -14.314   2.546   4.969
  141   HD11  LEU  24          1HD1      LEU  24 -12.336   1.306   6.302
  142   HD12  LEU  24          2HD1      LEU  24 -14.049   1.008   6.595
  143   HD13  LEU  24          3HD1      LEU  24 -13.153   2.109   7.642
  144   HD21  LEU  24          3HD2      LEU  24 -14.898   3.580   7.297
  145   HD22  LEU  24          1HD2      LEU  24 -14.961   4.574   5.841
  146   HD23  LEU  24          2HD2      LEU  24 -13.569   4.678   6.920
  147    H    LYS  25           H        LYS  25 -12.277   4.406   1.891
  148    HA   LYS  25           HA       LYS  25  -9.706   4.531   0.790
  149    HB2  LYS  25           1HB      LYS  25 -11.697   5.319  -0.396
  150    HB3  LYS  25           2HB      LYS  25 -11.892   6.621   0.770
  151    HG2  LYS  25           1HG      LYS  25 -10.908   7.606  -1.114
  152    HG3  LYS  25           2HG      LYS  25  -9.596   7.418   0.052
  153    HD2  LYS  25           1HD      LYS  25  -8.977   5.292  -1.104
  154    HD3  LYS  25           2HD      LYS  25 -10.183   5.671  -2.336
  155    HE2  LYS  25           1HE      LYS  25  -8.337   6.564  -3.333
  156    HE3  LYS  25           2HE      LYS  25  -8.866   7.964  -2.401
  157    HZ1  LYS  25           3HZ      LYS  25  -6.500   7.592  -2.144
  158    HZ2  LYS  25           1HZ      LYS  25  -6.774   6.021  -1.580
  159    HZ3  LYS  25           2HZ      LYS  25  -7.290   7.349  -0.668
  160    H    SER  26           H        SER  26 -11.267   6.542   3.253
  161    HA   SER  26           HA       SER  26  -9.356   8.512   3.557
  162    HB2  SER  26           1HB      SER  26 -10.265   8.907   5.737
  163    HB3  SER  26           2HB      SER  26 -11.598   8.365   4.719
  164    HG   SER  26           HG       SER  26 -11.873   6.976   6.280
  165    H    HIS  27           H        HIS  27  -9.459   5.294   5.037
  166    HA   HIS  27           HA       HIS  27  -7.296   5.489   6.751
  167    HB2  HIS  27           1HB      HIS  27  -8.325   3.145   5.150
  168    HB3  HIS  27           2HB      HIS  27  -7.041   2.993   6.346
  169    HD1  HIS  27           HD1      HIS  27  -9.839   1.586   6.579
  170    HD2  HIS  27           HD2      HIS  27  -8.755   5.129   8.457
  171    HE1  HIS  27           HE1      HIS  27 -11.365   1.786   8.568
  172    H    LEU  28           H        LEU  28  -7.211   4.162   3.437
  173    HA   LEU  28           HA       LEU  28  -4.442   3.922   3.248
  174    HB2  LEU  28           1HB      LEU  28  -5.750   2.822   1.634
  175    HB3  LEU  28           2HB      LEU  28  -6.590   4.306   1.187
  176    HG   LEU  28           HG       LEU  28  -4.589   5.135   0.085
  177   HD11  LEU  28          1HD1      LEU  28  -2.674   3.517  -0.219
  178   HD12  LEU  28          2HD1      LEU  28  -3.365   2.587   1.110
  179   HD13  LEU  28          3HD1      LEU  28  -2.827   4.245   1.380
  180   HD21  LEU  28          3HD2      LEU  28  -5.883   4.020  -1.455
  181   HD22  LEU  28          1HD2      LEU  28  -5.685   2.460  -0.656
  182   HD23  LEU  28          2HD2      LEU  28  -4.358   3.145  -1.595
  183    H    ASN  29           H        ASN  29  -6.547   6.612   2.269
  184    HA   ASN  29           HA       ASN  29  -4.661   8.279   1.129
  185    HB2  ASN  29           1HB      ASN  29  -7.068   8.747   1.087
  186    HB3  ASN  29           2HB      ASN  29  -7.044   9.073   2.818
  187   HD21  ASN  29          1HD2      ASN  29  -6.064  10.957   3.576
  188   HD22  ASN  29          2HD2      ASN  29  -5.742  12.297   2.534
  189    H    GLN  30           H        GLN  30  -5.734   8.297   4.531
  190    HA   GLN  30           HA       GLN  30  -3.771  10.168   5.364
  191    HB2  GLN  30           1HB      GLN  30  -5.652  10.058   6.748
  192    HB3  GLN  30           2HB      GLN  30  -5.631   8.300   6.798
  193    HG2  GLN  30           1HG      GLN  30  -3.968   8.228   8.387
  194    HG3  GLN  30           2HG      GLN  30  -3.370   9.837   7.986
  195   HE21  GLN  30          1HE2      GLN  30  -3.479   9.860  10.426
  196   HE22  GLN  30          2HE2      GLN  30  -4.944  10.446  11.129
  197    H    HIS  31           H        HIS  31  -3.504   6.966   4.466
  198    HA   HIS  31           HA       HIS  31  -1.344   6.311   6.300
  199    HB2  HIS  31           1HB      HIS  31  -2.515   4.374   5.923
  200    HB3  HIS  31           2HB      HIS  31  -2.943   4.826   4.275
  201    HD1  HIS  31           HD1      HIS  31  -0.302   3.117   6.275
  202    HD2  HIS  31           HD2      HIS  31  -1.059   4.113   2.312
  203    HE1  HIS  31           HE1      HIS  31   1.364   1.806   4.922
  204    H    GLN  32           H        GLN  32  -1.824   7.012   2.869
  205    HA   GLN  32           HA       GLN  32   0.754   6.498   1.951
  206    HB2  GLN  32           1HB      GLN  32  -1.486   8.244   1.042
  207    HB3  GLN  32           2HB      GLN  32   0.095   8.472   0.305
  208    HG2  GLN  32           1HG      GLN  32   0.133   6.241  -0.504
  209    HG3  GLN  32           2HG      GLN  32  -1.292   5.810   0.441
  210   HE21  GLN  32          1HE2      GLN  32  -2.265   5.085  -1.502
  211   HE22  GLN  32          2HE2      GLN  32  -2.956   6.208  -2.618
  212    H    ARG  33           H        ARG  33  -0.282   8.844   4.141
  213    HA   ARG  33           HA       ARG  33   1.469  10.975   3.548
  214    HB2  ARG  33           1HB      ARG  33   0.539  10.248   6.320
  215    HB3  ARG  33           2HB      ARG  33   0.913  11.843   5.681
  216    HG2  ARG  33           1HG      ARG  33  -1.503  10.146   5.211
  217    HG3  ARG  33           2HG      ARG  33  -1.403  11.817   5.769
  218    HD2  ARG  33           1HD      ARG  33  -0.655  10.877   3.004
  219    HD3  ARG  33           2HD      ARG  33  -2.205  11.599   3.433
  220    HE   ARG  33           HE       ARG  33   0.072  13.217   4.124
  221   HH11  ARG  33          1HH1      ARG  33  -2.219  12.395   1.636
  222   HH12  ARG  33          2HH1      ARG  33  -2.041  13.898   0.793
  223   HH21  ARG  33          1HH2      ARG  33   0.316  15.200   3.023
  224   HH22  ARG  33          2HH2      ARG  33  -0.598  15.492   1.582
  225    H    ILE  34           H        ILE  34   2.041   7.866   4.799
  226    HA   ILE  34           HA       ILE  34   4.374   8.501   6.343
  227    HB   ILE  34           HB       ILE  34   4.687   6.159   6.613
  228   HG12  ILE  34          1HG1      ILE  34   2.759   5.829   4.306
  229   HG13  ILE  34          2HG1      ILE  34   4.476   5.441   4.303
  230   HG21  ILE  34          1HG2      ILE  34   2.009   7.301   6.863
  231   HG22  ILE  34          2HG2      ILE  34   2.038   5.538   6.848
  232   HG23  ILE  34          3HG2      ILE  34   2.985   6.425   8.042
  233   HD11  ILE  34          3HD1      ILE  34   2.204   3.990   5.562
  234   HD12  ILE  34          1HD1      ILE  34   3.533   3.374   4.579
  235   HD13  ILE  34          2HD1      ILE  34   3.820   3.844   6.255
  236    H    HIS  35           H        HIS  35   3.733   8.245   3.041
  237    HA   HIS  35           HA       HIS  35   6.579   7.769   2.444
  238    HB2  HIS  35           1HB      HIS  35   4.341   7.488   0.448
  239    HB3  HIS  35           2HB      HIS  35   5.977   6.842   0.355
  240    HD1  HIS  35           HD1      HIS  35   6.491   4.903   2.216
  241    HD2  HIS  35           HD2      HIS  35   2.506   5.718   1.372
  242    HE1  HIS  35           HE1      HIS  35   5.207   2.904   3.042
  243    H    THR  36           H        THR  36   3.828   9.860   1.956
  244    HA   THR  36           HA       THR  36   4.675  11.482  -0.106
  245    HB   THR  36           HB       THR  36   3.340  13.293   0.920
  246    HG1  THR  36           HG1      THR  36   2.296  12.774   2.948
  247   HG21  THR  36          3HG2      THR  36   1.950  11.930  -0.306
  248   HG22  THR  36          1HG2      THR  36   1.218  11.779   1.291
  249   HG23  THR  36          2HG2      THR  36   2.287  10.512   0.687
  250    H    GLY  37           H        GLY  37   6.463  12.634  -0.389
  251    HA2  GLY  37           1HA      GLY  37   7.766  14.560   0.365
  252    HA3  GLY  37           2HA      GLY  37   7.712  13.875   1.982
  253    H    GLU  38           H        GLU  38   9.881  13.691   2.338
  254    HA   GLU  38           HA       GLU  38  11.656  12.556   0.393
  255    HB2  GLU  38           1HB      GLU  38  12.287  14.263   2.156
  256    HB3  GLU  38           2HB      GLU  38  12.202  12.960   3.332
  257    HG2  GLU  38           1HG      GLU  38  14.492  13.492   2.492
  258    HG3  GLU  38           2HG      GLU  38  14.004  11.807   2.322
  259    H    LYS  39           H        LYS  39  12.701  10.561   0.464
  260    HA   LYS  39           HA       LYS  39  11.355   8.532   2.123
  261    HB2  LYS  39           1HB      LYS  39  11.925   6.912   0.362
  262    HB3  LYS  39           2HB      LYS  39  10.929   8.223  -0.256
  263    HG2  LYS  39           1HG      LYS  39  13.126   9.303  -0.991
  264    HG3  LYS  39           2HG      LYS  39  13.849   7.719  -0.703
  265    HD2  LYS  39           1HD      LYS  39  12.589   6.706  -2.386
  266    HD3  LYS  39           2HD      LYS  39  11.401   8.011  -2.411
  267    HE2  LYS  39           1HE      LYS  39  13.145   9.519  -3.315
  268    HE3  LYS  39           2HE      LYS  39  14.256   8.152  -3.376
  269    HZ1  LYS  39           3HZ      LYS  39  13.294   8.463  -5.524
  270    HZ2  LYS  39           1HZ      LYS  39  11.724   8.452  -4.895
  271    HZ3  LYS  39           2HZ      LYS  39  12.654   7.040  -4.870
  272    HA   PRO  40           HA       PRO  40  15.521   8.450   3.895
  273    HB2  PRO  40           1HB      PRO  40  14.757   7.166   6.162
  274    HB3  PRO  40           2HB      PRO  40  14.564   8.908   5.933
  275    HG2  PRO  40           1HG      PRO  40  12.543   6.721   5.623
  276    HG3  PRO  40           2HG      PRO  40  12.362   8.312   6.386
  277    HD2  PRO  40           1HD      PRO  40  11.476   7.788   3.882
  278    HD3  PRO  40           2HD      PRO  40  12.075   9.387   4.368
  279    H    SER  41           H        SER  41  13.458   6.055   2.729
  280    HA   SER  41           HA       SER  41  14.559   3.670   3.617
  281    HB2  SER  41           1HB      SER  41  13.263   4.454   1.015
  282    HB3  SER  41           2HB      SER  41  13.852   2.814   1.282
  283    HG   SER  41           HG       SER  41  12.193   2.446   2.513
  284    H    GLY  42           H        GLY  42  16.118   2.245   2.719
  285    HA2  GLY  42           1HA      GLY  42  18.363   3.679   1.500
  286    HA3  GLY  42           2HA      GLY  42  18.446   2.119   2.306
  287    HA   PRO  43           HA       PRO  43  18.477   0.128  -1.599
  288    HB2  PRO  43           1HB      PRO  43  17.312  -2.242  -0.972
  289    HB3  PRO  43           2HB      PRO  43  18.950  -1.813  -0.465
  290    HG2  PRO  43           1HG      PRO  43  16.393  -1.685   1.086
  291    HG3  PRO  43           2HG      PRO  43  17.989  -2.258   1.605
  292    HD2  PRO  43           1HD      PRO  43  17.045   0.199   2.241
  293    HD3  PRO  43           2HD      PRO  43  18.772  -0.124   1.982
  294    H    SER  44           H        SER  44  17.089  -0.847  -3.257
  295    HA   SER  44           HA       SER  44  14.336   0.180  -3.075
  296    HB2  SER  44           1HB      SER  44  16.135  -0.235  -5.471
  297    HB3  SER  44           2HB      SER  44  14.423   0.171  -5.595
  298    HG   SER  44           HG       SER  44  15.153   1.978  -4.060
  299    H    SER  45           H        SER  45  12.616  -1.103  -3.653
  300    HA   SER  45           HA       SER  45  13.154  -3.848  -4.513
  301    HB2  SER  45           1HB      SER  45  11.829  -4.832  -2.773
  302    HB3  SER  45           2HB      SER  45  13.000  -3.770  -1.992
  303    HG   SER  45           HG       SER  45  10.242  -3.328  -2.428
  304    H    GLY  46           H        GLY  46  10.917  -5.001  -4.832
  305    HA2  GLY  46           1HA      GLY  46   9.612  -4.083  -6.975
  306    HA3  GLY  46           2HA      GLY  46   8.768  -4.983  -5.724
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1   2.082 -16.997   4.624
    2    HA2  GLY   1           1HA      GLY   1   4.699 -17.303   5.954
    3    HA3  GLY   1           2HA      GLY   1   3.325 -16.618   6.809
    4    H    SER   2           H        SER   2   2.055 -17.957   7.920
    5    HA   SER   2           HA       SER   2   2.527 -20.833   7.629
    6    HB2  SER   2           1HB      SER   2   1.269 -19.209   9.849
    7    HB3  SER   2           2HB      SER   2   1.333 -20.972   9.843
    8    HG   SER   2           HG       SER   2   3.140 -19.451  10.807
    9    H    SER   3           H        SER   3  -0.144 -18.506   7.884
   10    HA   SER   3           HA       SER   3  -1.912 -20.532   6.677
   11    HB2  SER   3           1HB      SER   3  -2.374 -18.477   8.791
   12    HB3  SER   3           2HB      SER   3  -3.708 -18.857   7.702
   13    HG   SER   3           HG       SER   3  -4.012 -20.493   8.979
   14    H    GLY   4           H        GLY   4  -1.673 -16.978   6.967
   15    HA2  GLY   4           1HA      GLY   4  -1.240 -15.742   4.860
   16    HA3  GLY   4           2HA      GLY   4  -2.401 -16.824   4.107
   17    H    SER   5           H        SER   5  -4.610 -16.818   5.297
   18    HA   SER   5           HA       SER   5  -5.917 -14.486   4.867
   19    HB2  SER   5           1HB      SER   5  -6.924 -16.734   5.486
   20    HB3  SER   5           2HB      SER   5  -6.652 -16.295   7.172
   21    HG   SER   5           HG       SER   5  -8.669 -15.596   6.769
   22    H    SER   6           H        SER   6  -5.525 -12.509   5.591
   23    HA   SER   6           HA       SER   6  -4.708 -12.169   8.401
   24    HB2  SER   6           1HB      SER   6  -3.705 -10.019   7.673
   25    HB3  SER   6           2HB      SER   6  -2.998 -11.404   6.841
   26    HG   SER   6           HG       SER   6  -4.962 -10.715   5.324
   27    H    GLY   7           H        GLY   7  -7.409 -12.493   7.816
   28    HA2  GLY   7           1HA      GLY   7  -9.266 -11.425   8.804
   29    HA3  GLY   7           2HA      GLY   7  -8.418  -9.890   8.685
   30    H    SER   8           H        SER   8  -8.320  -8.833   6.624
   31    HA   SER   8           HA       SER   8 -10.736  -9.301   5.074
   32    HB2  SER   8           1HB      SER   8  -8.741  -7.048   5.208
   33    HB3  SER   8           2HB      SER   8  -9.943  -7.134   3.919
   34    HG   SER   8           HG       SER   8 -10.456  -7.057   6.711
   35    H    SER   9           H        SER   9 -10.208 -11.168   3.918
   36    HA   SER   9           HA       SER   9  -8.016 -11.936   2.588
   37    HB2  SER   9           1HB      SER   9  -9.520 -12.869   0.796
   38    HB3  SER   9           2HB      SER   9 -10.019 -13.257   2.442
   39    HG   SER   9           HG       SER   9 -11.302 -11.790   0.528
   40    H    THR  10           H        THR  10 -10.406  -9.705   1.166
   41    HA   THR  10           HA       THR  10  -8.283  -8.733  -0.634
   42    HB   THR  10           HB       THR  10 -10.078  -8.070  -2.205
   43    HG1  THR  10           HG1      THR  10 -11.676  -8.249  -0.268
   44   HG21  THR  10          3HG2      THR  10 -10.801 -10.861  -1.979
   45   HG22  THR  10          1HG2      THR  10  -9.072 -10.628  -1.727
   46   HG23  THR  10          2HG2      THR  10  -9.833 -10.049  -3.209
   47    H    LYS  11           H        LYS  11  -8.789  -6.441  -1.446
   48    HA   LYS  11           HA       LYS  11 -10.067  -4.777   0.587
   49    HB2  LYS  11           1HB      LYS  11  -8.183  -3.378   0.932
   50    HB3  LYS  11           2HB      LYS  11  -7.604  -5.027   1.118
   51    HG2  LYS  11           1HG      LYS  11  -7.392  -3.745  -1.555
   52    HG3  LYS  11           2HG      LYS  11  -6.267  -3.256  -0.285
   53    HD2  LYS  11           1HD      LYS  11  -6.726  -6.157  -0.867
   54    HD3  LYS  11           2HD      LYS  11  -5.629  -5.209  -1.874
   55    HE2  LYS  11           1HE      LYS  11  -4.394  -4.555   0.172
   56    HE3  LYS  11           2HE      LYS  11  -5.446  -5.614   1.110
   57    HZ1  LYS  11           3HZ      LYS  11  -4.404  -7.450   0.370
   58    HZ2  LYS  11           1HZ      LYS  11  -3.117  -6.386   0.096
   59    HZ3  LYS  11           2HZ      LYS  11  -4.135  -6.828  -1.180
   60    H    SER  12           H        SER  12 -10.265  -2.490  -0.136
   61    HA   SER  12           HA       SER  12 -10.979  -2.445  -2.957
   62    HB2  SER  12           1HB      SER  12 -12.413  -1.572  -0.943
   63    HB3  SER  12           2HB      SER  12 -11.409  -0.130  -1.098
   64    HG   SER  12           HG       SER  12 -12.204   0.223  -3.102
   65    H    HIS  13           H        HIS  13  -9.167  -0.365  -0.698
   66    HA   HIS  13           HA       HIS  13  -7.694   0.716  -3.005
   67    HB2  HIS  13           1HB      HIS  13  -7.754   1.961  -0.265
   68    HB3  HIS  13           2HB      HIS  13  -7.348   2.716  -1.804
   69    HD1  HIS  13           HD1      HIS  13  -9.429   3.084  -3.470
   70    HD2  HIS  13           HD2      HIS  13 -10.368   2.203   0.480
   71    HE1  HIS  13           HE1      HIS  13 -11.837   3.750  -3.187
   72    H    GLN  14           H        GLN  14  -5.624   0.190  -3.236
   73    HA   GLN  14           HA       GLN  14  -4.168  -0.824  -0.884
   74    HB2  GLN  14           1HB      GLN  14  -4.525  -2.713  -2.259
   75    HB3  GLN  14           2HB      GLN  14  -4.173  -1.812  -3.727
   76    HG2  GLN  14           1HG      GLN  14  -2.019  -2.051  -1.705
   77    HG3  GLN  14           2HG      GLN  14  -2.436  -3.483  -2.644
   78   HE21  GLN  14          1HE2      GLN  14  -0.377  -3.418  -3.610
   79   HE22  GLN  14          2HE2      GLN  14  -0.011  -2.290  -4.866
   80    H    CYS  15           H        CYS  15  -2.172  -0.021  -0.500
   81    HA   CYS  15           HA       CYS  15  -1.395   2.374  -1.837
   82    HB2  CYS  15           1HB      CYS  15  -1.017   1.802   0.615
   83    HB3  CYS  15           2HB      CYS  15   0.305   0.774   0.074
   84    H    HIS  16           H        HIS  16   0.600   2.767  -2.937
   85    HA   HIS  16           HA       HIS  16   1.555   0.408  -4.413
   86    HB2  HIS  16           1HB      HIS  16   0.628   1.911  -5.972
   87    HB3  HIS  16           2HB      HIS  16   1.325   3.313  -5.166
   88    HD1  HIS  16           HD1      HIS  16   2.288   0.433  -7.399
   89    HD2  HIS  16           HD2      HIS  16   3.845   4.030  -6.021
   90    HE1  HIS  16           HE1      HIS  16   4.374   0.824  -8.749
   91    H    GLU  17           H        GLU  17   2.459   2.840  -2.198
   92    HA   GLU  17           HA       GLU  17   5.255   2.898  -2.800
   93    HB2  GLU  17           1HB      GLU  17   3.965   3.639  -0.176
   94    HB3  GLU  17           2HB      GLU  17   5.496   4.214  -0.822
   95    HG2  GLU  17           1HG      GLU  17   2.770   4.818  -1.944
   96    HG3  GLU  17           2HG      GLU  17   3.764   5.912  -0.985
   97    H    CYS  18           H        CYS  18   3.215   1.134  -0.525
   98    HA   CYS  18           HA       CYS  18   5.526  -0.585   0.095
   99    HB2  CYS  18           1HB      CYS  18   4.535  -0.951   2.336
  100    HB3  CYS  18           2HB      CYS  18   4.976   0.732   2.062
  101    H    GLY  19           H        GLY  19   2.026  -0.377  -0.329
  102    HA2  GLY  19           1HA      GLY  19   0.820  -2.005  -1.587
  103    HA3  GLY  19           2HA      GLY  19   2.042  -3.193  -1.162
  104    H    ARG  20           H        ARG  20  -0.006  -0.976   0.736
  105    HA   ARG  20           HA       ARG  20  -0.649  -3.213   2.513
  106    HB2  ARG  20           1HB      ARG  20  -0.644  -0.240   2.801
  107    HB3  ARG  20           2HB      ARG  20  -1.724  -1.182   3.820
  108    HG2  ARG  20           1HG      ARG  20   0.403  -2.561   4.366
  109    HG3  ARG  20           2HG      ARG  20   1.259  -1.142   3.758
  110    HD2  ARG  20           1HD      ARG  20  -0.423   0.105   5.380
  111    HD3  ARG  20           2HD      ARG  20  -0.420  -1.461   6.190
  112    HE   ARG  20           HE       ARG  20   2.192  -0.361   5.604
  113   HH11  ARG  20          1HH1      ARG  20  -0.391  -0.671   7.917
  114   HH12  ARG  20          2HH1      ARG  20   0.614  -0.318   9.283
  115   HH21  ARG  20          1HH2      ARG  20   3.526   0.105   7.394
  116   HH22  ARG  20          2HH2      ARG  20   2.842   0.125   8.984
  117    H    GLY  21           H        GLY  21  -2.951  -3.045   3.484
  118    HA2  GLY  21           1HA      GLY  21  -4.860  -2.498   1.296
  119    HA3  GLY  21           2HA      GLY  21  -4.952  -3.959   2.269
  120    H    PHE  22           H        PHE  22  -6.331  -1.042   1.830
  121    HA   PHE  22           HA       PHE  22  -7.169  -0.869   4.650
  122    HB2  PHE  22           1HB      PHE  22  -6.899   1.402   2.668
  123    HB3  PHE  22           2HB      PHE  22  -7.501   1.551   4.316
  124    HD1  PHE  22           HD1      PHE  22  -5.996   1.381   6.213
  125    HD2  PHE  22           HD2      PHE  22  -4.554   1.118   2.217
  126    HE1  PHE  22           HE1      PHE  22  -3.701   1.744   7.021
  127    HE2  PHE  22           HE2      PHE  22  -2.256   1.479   3.019
  128    HZ   PHE  22           HZ       PHE  22  -1.827   1.792   5.424
  129    H    THR  23           H        THR  23  -9.295  -0.979   5.050
  130    HA   THR  23           HA       THR  23 -11.095  -1.712   2.983
  131    HB   THR  23           HB       THR  23 -11.678  -0.918   5.842
  132    HG1  THR  23           HG1      THR  23 -10.367  -2.785   5.656
  133   HG21  THR  23          3HG2      THR  23 -13.681  -0.722   4.498
  134   HG22  THR  23          1HG2      THR  23 -13.792  -2.169   5.499
  135   HG23  THR  23          2HG2      THR  23 -13.398  -2.310   3.786
  136    H    LEU  24           H        LEU  24 -10.844   1.202   5.012
  137    HA   LEU  24           HA       LEU  24 -12.787   2.557   3.301
  138    HB2  LEU  24           1HB      LEU  24 -11.588   3.133   5.980
  139    HB3  LEU  24           2HB      LEU  24 -12.353   4.423   5.054
  140    HG   LEU  24           HG       LEU  24 -13.758   1.875   5.838
  141   HD11  LEU  24          1HD1      LEU  24 -14.416   4.412   7.188
  142   HD12  LEU  24          2HD1      LEU  24 -12.894   3.653   7.654
  143   HD13  LEU  24          3HD1      LEU  24 -14.408   2.760   7.807
  144   HD21  LEU  24          3HD2      LEU  24 -14.761   4.533   4.824
  145   HD22  LEU  24          1HD2      LEU  24 -15.771   3.177   5.324
  146   HD23  LEU  24          2HD2      LEU  24 -14.717   3.020   3.919
  147    H    LYS  25           H        LYS  25 -12.262   4.081   1.856
  148    HA   LYS  25           HA       LYS  25  -9.768   4.394   0.787
  149    HB2  LYS  25           1HB      LYS  25 -11.678   5.212  -0.397
  150    HB3  LYS  25           2HB      LYS  25 -12.062   6.352   0.886
  151    HG2  LYS  25           1HG      LYS  25 -11.118   7.647  -0.814
  152    HG3  LYS  25           2HG      LYS  25  -9.824   7.445   0.370
  153    HD2  LYS  25           1HD      LYS  25  -8.778   7.049  -1.681
  154    HD3  LYS  25           2HD      LYS  25  -9.108   5.432  -1.056
  155    HE2  LYS  25           1HE      LYS  25  -9.835   5.232  -3.230
  156    HE3  LYS  25           2HE      LYS  25 -11.329   5.678  -2.407
  157    HZ1  LYS  25           3HZ      LYS  25 -10.029   7.016  -4.501
  158    HZ2  LYS  25           1HZ      LYS  25 -10.021   8.031  -3.147
  159    HZ3  LYS  25           2HZ      LYS  25 -11.484   7.421  -3.739
  160    H    SER  26           H        SER  26 -11.292   6.671   3.073
  161    HA   SER  26           HA       SER  26  -9.353   8.513   3.425
  162    HB2  SER  26           1HB      SER  26 -10.083   8.695   5.807
  163    HB3  SER  26           2HB      SER  26 -11.428   8.630   4.669
  164    HG   SER  26           HG       SER  26 -11.152   7.126   6.728
  165    H    HIS  27           H        HIS  27  -9.491   5.471   5.282
  166    HA   HIS  27           HA       HIS  27  -7.263   5.618   6.797
  167    HB2  HIS  27           1HB      HIS  27  -8.229   3.237   5.206
  168    HB3  HIS  27           2HB      HIS  27  -7.001   3.138   6.464
  169    HD1  HIS  27           HD1      HIS  27  -9.672   1.605   6.694
  170    HD2  HIS  27           HD2      HIS  27  -8.962   5.351   8.345
  171    HE1  HIS  27           HE1      HIS  27 -11.320   1.832   8.580
  172    H    LEU  28           H        LEU  28  -7.153   4.115   3.561
  173    HA   LEU  28           HA       LEU  28  -4.433   3.906   3.290
  174    HB2  LEU  28           1HB      LEU  28  -5.713   2.898   1.629
  175    HB3  LEU  28           2HB      LEU  28  -6.621   4.373   1.302
  176    HG   LEU  28           HG       LEU  28  -4.497   5.323   0.323
  177   HD11  LEU  28          1HD1      LEU  28  -2.866   3.584  -0.461
  178   HD12  LEU  28          2HD1      LEU  28  -3.633   2.460   0.661
  179   HD13  LEU  28          3HD1      LEU  28  -2.840   3.912   1.272
  180   HD21  LEU  28          3HD2      LEU  28  -6.423   4.344  -0.970
  181   HD22  LEU  28          1HD2      LEU  28  -5.492   2.850  -1.074
  182   HD23  LEU  28          2HD2      LEU  28  -4.865   4.330  -1.799
  183    H    ASN  29           H        ASN  29  -6.450   6.686   2.367
  184    HA   ASN  29           HA       ASN  29  -4.484   8.323   1.313
  185    HB2  ASN  29           1HB      ASN  29  -7.047   8.677   1.474
  186    HB3  ASN  29           2HB      ASN  29  -6.693   9.437   3.022
  187   HD21  ASN  29          1HD2      ASN  29  -7.613  10.349   0.243
  188   HD22  ASN  29          2HD2      ASN  29  -6.625  11.732  -0.068
  189    H    GLN  30           H        GLN  30  -5.649   8.259   4.683
  190    HA   GLN  30           HA       GLN  30  -3.731  10.098   5.645
  191    HB2  GLN  30           1HB      GLN  30  -5.979   9.161   6.689
  192    HB3  GLN  30           2HB      GLN  30  -4.879   8.020   7.451
  193    HG2  GLN  30           1HG      GLN  30  -4.894   9.625   9.046
  194    HG3  GLN  30           2HG      GLN  30  -3.574  10.237   8.052
  195   HE21  GLN  30          1HE2      GLN  30  -5.813  11.405   9.827
  196   HE22  GLN  30          2HE2      GLN  30  -6.419  12.714   8.877
  197    H    HIS  31           H        HIS  31  -3.340   6.987   4.538
  198    HA   HIS  31           HA       HIS  31  -1.136   6.341   6.346
  199    HB2  HIS  31           1HB      HIS  31  -2.281   4.378   6.025
  200    HB3  HIS  31           2HB      HIS  31  -2.783   4.811   4.394
  201    HD1  HIS  31           HD1      HIS  31   0.063   3.287   6.297
  202    HD2  HIS  31           HD2      HIS  31  -1.055   4.010   2.362
  203    HE1  HIS  31           HE1      HIS  31   1.680   1.975   4.887
  204    H    GLN  32           H        GLN  32  -1.756   6.838   2.885
  205    HA   GLN  32           HA       GLN  32   0.783   6.431   1.886
  206    HB2  GLN  32           1HB      GLN  32  -1.389   8.337   1.036
  207    HB3  GLN  32           2HB      GLN  32   0.110   8.163   0.132
  208    HG2  GLN  32           1HG      GLN  32  -0.456   5.657   0.086
  209    HG3  GLN  32           2HG      GLN  32  -2.080   6.168   0.544
  210   HE21  GLN  32          1HE2      GLN  32  -1.839   4.857  -1.757
  211   HE22  GLN  32          2HE2      GLN  32  -2.017   5.919  -3.108
  212    H    ARG  33           H        ARG  33  -0.477   9.164   3.657
  213    HA   ARG  33           HA       ARG  33   1.407  11.109   3.064
  214    HB2  ARG  33           1HB      ARG  33   0.938  11.905   5.459
  215    HB3  ARG  33           2HB      ARG  33  -0.424  11.806   4.351
  216    HG2  ARG  33           1HG      ARG  33  -1.274   9.888   5.383
  217    HG3  ARG  33           2HG      ARG  33   0.246   9.559   6.217
  218    HD2  ARG  33           1HD      ARG  33  -1.440  11.998   6.738
  219    HD3  ARG  33           2HD      ARG  33  -1.601  10.497   7.647
  220    HE   ARG  33           HE       ARG  33   0.411  12.480   7.975
  221   HH11  ARG  33          1HH1      ARG  33  -0.173   9.053   8.144
  222   HH12  ARG  33          2HH1      ARG  33   1.087   8.763   9.297
  223   HH21  ARG  33          1HH2      ARG  33   2.072  12.112   9.494
  224   HH22  ARG  33          2HH2      ARG  33   2.363  10.504  10.065
  225    H    ILE  34           H        ILE  34   1.761   8.191   4.853
  226    HA   ILE  34           HA       ILE  34   3.980   8.898   6.456
  227    HB   ILE  34           HB       ILE  34   4.238   6.620   6.935
  228   HG12  ILE  34          1HG1      ILE  34   2.774   5.999   4.360
  229   HG13  ILE  34          2HG1      ILE  34   4.509   5.844   4.613
  230   HG21  ILE  34          1HG2      ILE  34   1.585   5.900   6.583
  231   HG22  ILE  34          2HG2      ILE  34   2.273   6.737   7.974
  232   HG23  ILE  34          3HG2      ILE  34   1.552   7.662   6.656
  233   HD11  ILE  34          3HD1      ILE  34   2.284   4.159   5.645
  234   HD12  ILE  34          1HD1      ILE  34   3.798   3.683   4.878
  235   HD13  ILE  34          2HD1      ILE  34   3.796   4.255   6.547
  236    H    HIS  35           H        HIS  35   3.657   8.104   3.109
  237    HA   HIS  35           HA       HIS  35   6.514   7.617   2.792
  238    HB2  HIS  35           1HB      HIS  35   4.372   7.683   0.660
  239    HB3  HIS  35           2HB      HIS  35   6.001   7.031   0.506
  240    HD1  HIS  35           HD1      HIS  35   6.441   4.968   2.354
  241    HD2  HIS  35           HD2      HIS  35   2.544   5.762   1.150
  242    HE1  HIS  35           HE1      HIS  35   5.135   2.886   2.886
  243    H    THR  36           H        THR  36   5.300  10.264   3.544
  244    HA   THR  36           HA       THR  36   7.020  11.907   2.016
  245    HB   THR  36           HB       THR  36   5.411  11.749   0.245
  246    HG1  THR  36           HG1      THR  36   6.027  13.821   0.261
  247   HG21  THR  36          3HG2      THR  36   3.079  12.942   1.277
  248   HG22  THR  36          1HG2      THR  36   3.523  11.662   2.405
  249   HG23  THR  36          2HG2      THR  36   3.279  11.288   0.698
  250    H    GLY  37           H        GLY  37   7.671  13.329   3.485
  251    HA2  GLY  37           1HA      GLY  37   5.747  14.894   4.973
  252    HA3  GLY  37           2HA      GLY  37   6.709  13.807   5.964
  253    H    GLU  38           H        GLU  38   9.081  14.027   5.803
  254    HA   GLU  38           HA       GLU  38   9.785  16.864   5.589
  255    HB2  GLU  38           1HB      GLU  38  11.288  14.593   6.904
  256    HB3  GLU  38           2HB      GLU  38  11.743  16.291   6.950
  257    HG2  GLU  38           1HG      GLU  38   9.094  15.354   7.986
  258    HG3  GLU  38           2HG      GLU  38  10.549  15.304   8.980
  259    H    LYS  39           H        LYS  39  11.172  17.612   4.106
  260    HA   LYS  39           HA       LYS  39  12.460  15.645   2.333
  261    HB2  LYS  39           1HB      LYS  39  12.530  17.578   0.695
  262    HB3  LYS  39           2HB      LYS  39  10.934  16.938   1.062
  263    HG2  LYS  39           1HG      LYS  39  10.553  18.782   2.621
  264    HG3  LYS  39           2HG      LYS  39  12.152  19.427   2.242
  265    HD2  LYS  39           1HD      LYS  39  10.021  18.974   0.162
  266    HD3  LYS  39           2HD      LYS  39  10.217  20.501   1.027
  267    HE2  LYS  39           1HE      LYS  39  12.406  19.168  -0.559
  268    HE3  LYS  39           2HE      LYS  39  11.335  20.407  -1.212
  269    HZ1  LYS  39           3HZ      LYS  39  12.689  21.925  -0.376
  270    HZ2  LYS  39           1HZ      LYS  39  13.665  20.736   0.330
  271    HZ3  LYS  39           2HZ      LYS  39  12.355  21.374   1.189
  272    HA   PRO  40           HA       PRO  40  15.917  17.695   4.625
  273    HB2  PRO  40           1HB      PRO  40  17.374  15.422   4.904
  274    HB3  PRO  40           2HB      PRO  40  16.106  15.896   6.041
  275    HG2  PRO  40           1HG      PRO  40  15.988  13.937   3.780
  276    HG3  PRO  40           2HG      PRO  40  15.329  13.794   5.420
  277    HD2  PRO  40           1HD      PRO  40  13.797  14.452   3.286
  278    HD3  PRO  40           2HD      PRO  40  13.473  15.066   4.921
  279    H    SER  41           H        SER  41  15.791  15.501   1.888
  280    HA   SER  41           HA       SER  41  17.528  17.090   0.325
  281    HB2  SER  41           1HB      SER  41  19.332  16.201   1.627
  282    HB3  SER  41           2HB      SER  41  18.693  14.562   1.504
  283    HG   SER  41           HG       SER  41  19.995  14.443  -0.145
  284    H    GLY  42           H        GLY  42  16.678  16.865  -1.628
  285    HA2  GLY  42           1HA      GLY  42  16.521  14.439  -3.025
  286    HA3  GLY  42           2HA      GLY  42  14.931  14.781  -2.358
  287    HA   PRO  43           HA       PRO  43  15.440  16.890  -6.507
  288    HB2  PRO  43           1HB      PRO  43  13.267  15.747  -7.665
  289    HB3  PRO  43           2HB      PRO  43  14.874  15.012  -7.704
  290    HG2  PRO  43           1HG      PRO  43  12.557  14.406  -5.907
  291    HG3  PRO  43           2HG      PRO  43  13.662  13.286  -6.724
  292    HD2  PRO  43           1HD      PRO  43  13.918  13.936  -4.108
  293    HD3  PRO  43           2HD      PRO  43  15.313  13.560  -5.139
  294    H    SER  44           H        SER  44  14.093  18.527  -7.373
  295    HA   SER  44           HA       SER  44  12.187  19.583  -5.439
  296    HB2  SER  44           1HB      SER  44  13.974  21.041  -6.395
  297    HB3  SER  44           2HB      SER  44  13.224  20.861  -7.980
  298    HG   SER  44           HG       SER  44  11.519  22.035  -7.328
  299    H    SER  45           H        SER  45  10.147  20.540  -6.217
  300    HA   SER  45           HA       SER  45   8.912  18.783  -8.219
  301    HB2  SER  45           1HB      SER  45   7.760  20.369  -5.924
  302    HB3  SER  45           2HB      SER  45   6.749  19.633  -7.168
  303    HG   SER  45           HG       SER  45   6.983  18.238  -5.396
  304    H    GLY  46           H        GLY  46   7.021  19.850  -9.414
  305    HA2  GLY  46           1HA      GLY  46   6.921  22.614  -9.865
  306    HA3  GLY  46           2HA      GLY  46   8.040  21.920 -11.029
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1  -4.985 -26.616 -16.549
    2    HA2  GLY   1           1HA      GLY   1  -2.564 -27.106 -17.514
    3    HA3  GLY   1           2HA      GLY   1  -3.337 -26.452 -18.951
    4    H    SER   2           H        SER   2  -4.792 -24.387 -18.114
    5    HA   SER   2           HA       SER   2  -2.956 -22.331 -17.767
    6    HB2  SER   2           1HB      SER   2  -4.887 -20.881 -17.348
    7    HB3  SER   2           2HB      SER   2  -5.230 -22.001 -18.666
    8    HG   SER   2           HG       SER   2  -5.981 -23.213 -16.468
    9    H    SER   3           H        SER   3  -2.339 -21.061 -16.026
   10    HA   SER   3           HA       SER   3  -3.292 -21.586 -13.366
   11    HB2  SER   3           1HB      SER   3  -1.341 -22.529 -12.416
   12    HB3  SER   3           2HB      SER   3  -1.616 -23.454 -13.893
   13    HG   SER   3           HG       SER   3   0.507 -21.947 -13.200
   14    H    GLY   4           H        GLY   4  -1.907 -20.319 -11.730
   15    HA2  GLY   4           1HA      GLY   4  -0.109 -18.383 -12.134
   16    HA3  GLY   4           2HA      GLY   4  -1.543 -17.658 -12.844
   17    H    SER   5           H        SER   5  -0.569 -16.224 -10.907
   18    HA   SER   5           HA       SER   5  -2.311 -16.795  -8.603
   19    HB2  SER   5           1HB      SER   5  -0.574 -15.752  -7.143
   20    HB3  SER   5           2HB      SER   5  -0.037 -17.252  -7.899
   21    HG   SER   5           HG       SER   5   0.829 -14.649  -8.295
   22    H    SER   6           H        SER   6  -3.106 -15.252 -10.760
   23    HA   SER   6           HA       SER   6  -2.708 -12.462 -10.031
   24    HB2  SER   6           1HB      SER   6  -3.918 -11.939 -12.070
   25    HB3  SER   6           2HB      SER   6  -2.702 -13.167 -12.423
   26    HG   SER   6           HG       SER   6  -5.159 -14.163 -11.680
   27    H    GLY   7           H        GLY   7  -3.963 -13.847  -8.014
   28    HA2  GLY   7           1HA      GLY   7  -6.695 -12.733  -8.149
   29    HA3  GLY   7           2HA      GLY   7  -6.380 -14.308  -7.436
   30    H    SER   8           H        SER   8  -4.787 -11.132  -7.151
   31    HA   SER   8           HA       SER   8  -4.908 -11.445  -4.231
   32    HB2  SER   8           1HB      SER   8  -2.651 -11.185  -5.157
   33    HB3  SER   8           2HB      SER   8  -3.128  -9.668  -5.919
   34    HG   SER   8           HG       SER   8  -2.159  -9.979  -3.514
   35    H    SER   9           H        SER   9  -7.215 -10.609  -5.635
   36    HA   SER   9           HA       SER   9  -7.384  -7.725  -5.233
   37    HB2  SER   9           1HB      SER   9  -9.701  -8.024  -6.181
   38    HB3  SER   9           2HB      SER   9  -8.398  -8.515  -7.264
   39    HG   SER   9           HG       SER   9 -10.199 -10.117  -5.808
   40    H    THR  10           H        THR  10  -6.940  -8.973  -2.864
   41    HA   THR  10           HA       THR  10  -9.533  -9.279  -1.544
   42    HB   THR  10           HB       THR  10  -7.783 -10.975  -1.095
   43    HG1  THR  10           HG1      THR  10  -8.620 -11.130   0.843
   44   HG21  THR  10          3HG2      THR  10  -5.708 -10.017  -1.080
   45   HG22  THR  10          1HG2      THR  10  -6.026 -10.017   0.654
   46   HG23  THR  10          2HG2      THR  10  -6.271  -8.546  -0.288
   47    H    LYS  11           H        LYS  11  -8.939  -6.691  -2.420
   48    HA   LYS  11           HA       LYS  11  -9.363  -5.207  -0.059
   49    HB2  LYS  11           1HB      LYS  11  -6.772  -5.745  -0.171
   50    HB3  LYS  11           2HB      LYS  11  -6.771  -4.394  -1.297
   51    HG2  LYS  11           1HG      LYS  11  -6.387  -3.248   0.614
   52    HG3  LYS  11           2HG      LYS  11  -8.151  -3.259   0.668
   53    HD2  LYS  11           1HD      LYS  11  -6.537  -5.439   1.952
   54    HD3  LYS  11           2HD      LYS  11  -6.860  -3.921   2.794
   55    HE2  LYS  11           1HE      LYS  11  -8.879  -5.900   1.748
   56    HE3  LYS  11           2HE      LYS  11  -8.527  -5.525   3.434
   57    HZ1  LYS  11           3HZ      LYS  11  -9.921  -3.863   1.431
   58    HZ2  LYS  11           1HZ      LYS  11  -9.224  -3.166   2.806
   59    HZ3  LYS  11           2HZ      LYS  11 -10.443  -4.326   2.972
   60    H    SER  12           H        SER  12  -9.972  -3.069  -0.477
   61    HA   SER  12           HA       SER  12 -10.662  -2.567  -3.254
   62    HB2  SER  12           1HB      SER  12 -11.476  -1.362  -0.626
   63    HB3  SER  12           2HB      SER  12 -11.802  -0.505  -2.133
   64    HG   SER  12           HG       SER  12 -12.500  -3.171  -2.140
   65    H    HIS  13           H        HIS  13  -9.126  -0.709  -0.623
   66    HA   HIS  13           HA       HIS  13  -7.732   0.877  -2.674
   67    HB2  HIS  13           1HB      HIS  13  -8.024   1.651   0.223
   68    HB3  HIS  13           2HB      HIS  13  -7.630   2.683  -1.148
   69    HD1  HIS  13           HD1      HIS  13  -9.685   2.979  -2.924
   70    HD2  HIS  13           HD2      HIS  13 -10.654   1.655   0.893
   71    HE1  HIS  13           HE1      HIS  13 -12.153   3.392  -2.675
   72    H    GLN  14           H        GLN  14  -5.808  -0.045  -3.047
   73    HA   GLN  14           HA       GLN  14  -4.195  -0.876  -0.728
   74    HB2  GLN  14           1HB      GLN  14  -4.702  -2.682  -2.323
   75    HB3  GLN  14           2HB      GLN  14  -3.961  -1.745  -3.614
   76    HG2  GLN  14           1HG      GLN  14  -1.813  -1.847  -2.436
   77    HG3  GLN  14           2HG      GLN  14  -2.565  -2.824  -1.176
   78   HE21  GLN  14          1HE2      GLN  14  -1.056  -2.818  -4.208
   79   HE22  GLN  14          2HE2      GLN  14  -1.247  -4.494  -4.578
   80    H    CYS  15           H        CYS  15  -2.117  -0.135  -0.488
   81    HA   CYS  15           HA       CYS  15  -1.505   2.353  -1.793
   82    HB2  CYS  15           1HB      CYS  15  -1.043   1.960   0.615
   83    HB3  CYS  15           2HB      CYS  15   0.159   0.754   0.164
   84    H    HIS  16           H        HIS  16   0.594   2.795  -2.794
   85    HA   HIS  16           HA       HIS  16   1.509   0.493  -4.386
   86    HB2  HIS  16           1HB      HIS  16   1.688   3.433  -5.077
   87    HB3  HIS  16           2HB      HIS  16   2.145   2.087  -6.117
   88    HD1  HIS  16           HD1      HIS  16   0.258   0.814  -7.305
   89    HD2  HIS  16           HD2      HIS  16  -1.080   3.892  -4.857
   90    HE1  HIS  16           HE1      HIS  16  -2.167   1.133  -7.891
   91    H    GLU  17           H        GLU  17   2.466   3.017  -2.222
   92    HA   GLU  17           HA       GLU  17   5.245   3.005  -2.772
   93    HB2  GLU  17           1HB      GLU  17   3.982   3.664  -0.114
   94    HB3  GLU  17           2HB      GLU  17   5.499   4.267  -0.766
   95    HG2  GLU  17           1HG      GLU  17   2.756   4.887  -1.839
   96    HG3  GLU  17           2HG      GLU  17   3.745   5.955  -0.844
   97    H    CYS  18           H        CYS  18   3.217   1.206  -0.505
   98    HA   CYS  18           HA       CYS  18   5.521  -0.550   0.038
   99    HB2  CYS  18           1HB      CYS  18   4.573  -0.966   2.274
  100    HB3  CYS  18           2HB      CYS  18   4.959   0.735   2.037
  101    H    GLY  19           H        GLY  19   2.016  -0.321  -0.348
  102    HA2  GLY  19           1HA      GLY  19   0.895  -1.953  -1.742
  103    HA3  GLY  19           2HA      GLY  19   2.018  -3.162  -1.138
  104    H    ARG  20           H        ARG  20   0.700  -0.903   1.111
  105    HA   ARG  20           HA       ARG  20  -0.480  -2.985   2.656
  106    HB2  ARG  20           1HB      ARG  20  -0.188  -0.036   2.898
  107    HB3  ARG  20           2HB      ARG  20  -1.462  -0.799   3.839
  108    HG2  ARG  20           1HG      ARG  20   0.514  -2.436   4.496
  109    HG3  ARG  20           2HG      ARG  20   1.481  -1.013   4.099
  110    HD2  ARG  20           1HD      ARG  20   0.965  -0.987   6.451
  111    HD3  ARG  20           2HD      ARG  20   0.085   0.315   5.652
  112    HE   ARG  20           HE       ARG  20  -1.708  -1.699   5.665
  113   HH11  ARG  20          1HH1      ARG  20   0.270  -0.268   8.147
  114   HH12  ARG  20          2HH1      ARG  20  -0.861  -0.593   9.418
  115   HH21  ARG  20          1HH2      ARG  20  -3.206  -2.132   7.331
  116   HH22  ARG  20          2HH2      ARG  20  -2.837  -1.654   8.953
  117    H    GLY  21           H        GLY  21  -2.762  -2.892   3.435
  118    HA2  GLY  21           1HA      GLY  21  -4.574  -2.060   1.253
  119    HA3  GLY  21           2HA      GLY  21  -4.755  -3.592   2.095
  120    H    PHE  22           H        PHE  22  -6.468  -1.092   1.786
  121    HA   PHE  22           HA       PHE  22  -7.203  -0.928   4.618
  122    HB2  PHE  22           1HB      PHE  22  -6.951   1.467   2.784
  123    HB3  PHE  22           2HB      PHE  22  -7.577   1.499   4.430
  124    HD1  PHE  22           HD1      PHE  22  -6.090   1.234   6.333
  125    HD2  PHE  22           HD2      PHE  22  -4.597   1.267   2.347
  126    HE1  PHE  22           HE1      PHE  22  -3.813   1.593   7.193
  127    HE2  PHE  22           HE2      PHE  22  -2.317   1.625   3.200
  128    HZ   PHE  22           HZ       PHE  22  -1.922   1.787   5.626
  129    H    THR  23           H        THR  23  -9.370  -0.844   5.008
  130    HA   THR  23           HA       THR  23 -11.116  -1.595   2.870
  131    HB   THR  23           HB       THR  23 -11.828  -0.857   5.716
  132    HG1  THR  23           HG1      THR  23 -10.348  -2.657   5.490
  133   HG21  THR  23          3HG2      THR  23 -13.400  -2.706   3.971
  134   HG22  THR  23          1HG2      THR  23 -13.615  -0.964   3.809
  135   HG23  THR  23          2HG2      THR  23 -13.929  -1.751   5.356
  136    H    LEU  24           H        LEU  24 -10.901   1.253   4.995
  137    HA   LEU  24           HA       LEU  24 -12.827   2.659   3.309
  138    HB2  LEU  24           1HB      LEU  24 -11.575   3.266   5.971
  139    HB3  LEU  24           2HB      LEU  24 -12.511   4.465   5.081
  140    HG   LEU  24           HG       LEU  24 -13.732   1.812   5.717
  141   HD11  LEU  24          1HD1      LEU  24 -14.600   2.815   7.819
  142   HD12  LEU  24          2HD1      LEU  24 -13.450   4.136   7.614
  143   HD13  LEU  24          3HD1      LEU  24 -12.867   2.488   7.846
  144   HD21  LEU  24          3HD2      LEU  24 -14.561   4.229   4.506
  145   HD22  LEU  24          1HD2      LEU  24 -15.424   4.080   6.037
  146   HD23  LEU  24          2HD2      LEU  24 -15.521   2.787   4.842
  147    H    LYS  25           H        LYS  25 -12.165   3.891   1.691
  148    HA   LYS  25           HA       LYS  25  -9.676   4.321   0.770
  149    HB2  LYS  25           1HB      LYS  25 -11.717   5.050  -0.397
  150    HB3  LYS  25           2HB      LYS  25 -11.888   6.384   0.736
  151    HG2  LYS  25           1HG      LYS  25 -10.886   7.471  -0.990
  152    HG3  LYS  25           2HG      LYS  25  -9.452   6.953  -0.100
  153    HD2  LYS  25           1HD      LYS  25  -9.427   4.903  -1.574
  154    HD3  LYS  25           2HD      LYS  25 -10.665   5.693  -2.553
  155    HE2  LYS  25           1HE      LYS  25  -8.123   7.129  -1.912
  156    HE3  LYS  25           2HE      LYS  25  -8.149   5.921  -3.195
  157    HZ1  LYS  25           3HZ      LYS  25 -10.253   7.943  -3.224
  158    HZ2  LYS  25           1HZ      LYS  25  -9.436   7.212  -4.513
  159    HZ3  LYS  25           2HZ      LYS  25  -8.694   8.453  -3.636
  160    H    SER  26           H        SER  26 -11.317   6.429   3.116
  161    HA   SER  26           HA       SER  26  -9.457   8.408   3.435
  162    HB2  SER  26           1HB      SER  26 -10.243   8.524   5.835
  163    HB3  SER  26           2HB      SER  26 -11.530   8.538   4.629
  164    HG   SER  26           HG       SER  26 -11.516   6.997   6.612
  165    H    HIS  27           H        HIS  27  -9.523   5.314   5.199
  166    HA   HIS  27           HA       HIS  27  -7.335   5.579   6.806
  167    HB2  HIS  27           1HB      HIS  27  -8.305   3.164   5.280
  168    HB3  HIS  27           2HB      HIS  27  -7.006   3.079   6.466
  169    HD1  HIS  27           HD1      HIS  27  -9.714   1.571   6.806
  170    HD2  HIS  27           HD2      HIS  27  -8.805   5.256   8.497
  171    HE1  HIS  27           HE1      HIS  27 -11.236   1.792   8.795
  172    H    LEU  28           H        LEU  28  -7.176   4.054   3.582
  173    HA   LEU  28           HA       LEU  28  -4.430   3.896   3.369
  174    HB2  LEU  28           1HB      LEU  28  -5.795   2.788   1.776
  175    HB3  LEU  28           2HB      LEU  28  -6.542   4.301   1.267
  176    HG   LEU  28           HG       LEU  28  -4.340   4.989   0.319
  177   HD11  LEU  28          1HD1      LEU  28  -3.573   2.121   0.836
  178   HD12  LEU  28          2HD1      LEU  28  -2.953   3.510   1.727
  179   HD13  LEU  28          3HD1      LEU  28  -2.609   3.342   0.006
  180   HD21  LEU  28          3HD2      LEU  28  -6.112   4.021  -1.072
  181   HD22  LEU  28          1HD2      LEU  28  -5.472   2.408  -0.757
  182   HD23  LEU  28          2HD2      LEU  28  -4.506   3.580  -1.655
  183    H    ASN  29           H        ASN  29  -6.473   6.470   1.974
  184    HA   ASN  29           HA       ASN  29  -4.644   8.154   0.940
  185    HB2  ASN  29           1HB      ASN  29  -7.155   8.508   1.128
  186    HB3  ASN  29           2HB      ASN  29  -6.850   9.185   2.726
  187   HD21  ASN  29          1HD2      ASN  29  -7.933  11.031   1.620
  188   HD22  ASN  29          2HD2      ASN  29  -6.925  12.154   0.778
  189    H    GLN  30           H        GLN  30  -5.643   8.273   4.364
  190    HA   GLN  30           HA       GLN  30  -3.755  10.184   5.163
  191    HB2  GLN  30           1HB      GLN  30  -5.850   9.123   6.386
  192    HB3  GLN  30           2HB      GLN  30  -4.627   8.063   7.073
  193    HG2  GLN  30           1HG      GLN  30  -3.627   9.748   8.256
  194    HG3  GLN  30           2HG      GLN  30  -4.184  11.003   7.150
  195   HE21  GLN  30          1HE2      GLN  30  -5.655   8.506   9.206
  196   HE22  GLN  30          2HE2      GLN  30  -6.830   9.550   9.923
  197    H    HIS  31           H        HIS  31  -3.593   6.662   5.030
  198    HA   HIS  31           HA       HIS  31  -1.174   6.304   6.388
  199    HB2  HIS  31           1HB      HIS  31  -2.244   4.299   6.040
  200    HB3  HIS  31           2HB      HIS  31  -2.734   4.722   4.402
  201    HD1  HIS  31           HD1      HIS  31   0.140   3.307   6.348
  202    HD2  HIS  31           HD2      HIS  31  -0.935   4.011   2.397
  203    HE1  HIS  31           HE1      HIS  31   1.838   2.077   4.960
  204    H    GLN  32           H        GLN  32  -1.835   6.964   2.977
  205    HA   GLN  32           HA       GLN  32   0.642   6.602   1.859
  206    HB2  GLN  32           1HB      GLN  32  -1.615   8.464   1.294
  207    HB3  GLN  32           2HB      GLN  32  -0.089   8.745   0.467
  208    HG2  GLN  32           1HG      GLN  32  -0.151   6.452  -0.399
  209    HG3  GLN  32           2HG      GLN  32  -1.703   6.207   0.399
  210   HE21  GLN  32          1HE2      GLN  32  -2.361   5.685  -1.820
  211   HE22  GLN  32          2HE2      GLN  32  -2.862   6.975  -2.855
  212    H    ARG  33           H        ARG  33  -0.320   8.990   4.146
  213    HA   ARG  33           HA       ARG  33   1.485  11.043   3.672
  214    HB2  ARG  33           1HB      ARG  33   0.429   9.983   6.298
  215    HB3  ARG  33           2HB      ARG  33   1.313  11.494   6.129
  216    HG2  ARG  33           1HG      ARG  33  -0.422  12.408   4.731
  217    HG3  ARG  33           2HG      ARG  33  -1.283  10.867   4.739
  218    HD2  ARG  33           1HD      ARG  33  -0.873  12.798   7.003
  219    HD3  ARG  33           2HD      ARG  33  -2.389  12.210   6.323
  220    HE   ARG  33           HE       ARG  33  -1.268   9.954   7.254
  221   HH11  ARG  33          1HH1      ARG  33  -1.780  13.081   8.696
  222   HH12  ARG  33          2HH1      ARG  33  -1.938  12.458  10.305
  223   HH21  ARG  33          1HH2      ARG  33  -1.474   9.121   9.368
  224   HH22  ARG  33          2HH2      ARG  33  -1.763  10.205  10.686
  225    H    ILE  34           H        ILE  34   1.938   8.015   5.441
  226    HA   ILE  34           HA       ILE  34   4.479   8.517   6.486
  227    HB   ILE  34           HB       ILE  34   4.662   6.232   6.928
  228   HG12  ILE  34          1HG1      ILE  34   2.750   5.709   4.641
  229   HG13  ILE  34          2HG1      ILE  34   4.492   5.463   4.592
  230   HG21  ILE  34          1HG2      ILE  34   2.201   7.517   7.327
  231   HG22  ILE  34          2HG2      ILE  34   1.819   5.863   6.851
  232   HG23  ILE  34          3HG2      ILE  34   2.869   6.161   8.236
  233   HD11  ILE  34          3HD1      ILE  34   2.439   3.940   6.158
  234   HD12  ILE  34          1HD1      ILE  34   3.557   3.343   4.932
  235   HD13  ILE  34          2HD1      ILE  34   4.164   3.841   6.511
  236    H    HIS  35           H        HIS  35   3.537   8.237   3.272
  237    HA   HIS  35           HA       HIS  35   6.264   7.518   2.424
  238    HB2  HIS  35           1HB      HIS  35   3.706   7.412   0.811
  239    HB3  HIS  35           2HB      HIS  35   5.298   6.895   0.266
  240    HD1  HIS  35           HD1      HIS  35   6.335   4.982   2.127
  241    HD2  HIS  35           HD2      HIS  35   2.232   5.285   1.547
  242    HE1  HIS  35           HE1      HIS  35   5.381   2.791   2.911
  243    H    THR  36           H        THR  36   3.779   9.937   2.315
  244    HA   THR  36           HA       THR  36   4.688  11.488   0.165
  245    HB   THR  36           HB       THR  36   3.510  13.385   1.267
  246    HG1  THR  36           HG1      THR  36   3.931  11.942   3.448
  247   HG21  THR  36          3HG2      THR  36   1.580  12.592   0.457
  248   HG22  THR  36          1HG2      THR  36   1.516  11.304   1.659
  249   HG23  THR  36          2HG2      THR  36   2.440  11.078   0.174
  250    H    GLY  37           H        GLY  37   5.938  13.407   0.111
  251    HA2  GLY  37           1HA      GLY  37   7.292  15.029   1.380
  252    HA3  GLY  37           2HA      GLY  37   7.818  13.680   2.375
  253    H    GLU  38           H        GLU  38   7.897  14.934  -0.941
  254    HA   GLU  38           HA       GLU  38  10.576  13.751  -1.217
  255    HB2  GLU  38           1HB      GLU  38   8.407  13.813  -3.322
  256    HB3  GLU  38           2HB      GLU  38  10.072  13.329  -3.614
  257    HG2  GLU  38           1HG      GLU  38   8.952  11.318  -3.364
  258    HG3  GLU  38           2HG      GLU  38   9.683  11.583  -1.782
  259    H    LYS  39           H        LYS  39  11.855  14.793  -2.982
  260    HA   LYS  39           HA       LYS  39  11.073  17.465  -3.759
  261    HB2  LYS  39           1HB      LYS  39  12.054  17.603  -1.400
  262    HB3  LYS  39           2HB      LYS  39  13.593  17.170  -2.133
  263    HG2  LYS  39           1HG      LYS  39  13.651  19.491  -2.005
  264    HG3  LYS  39           2HG      LYS  39  13.211  19.165  -3.683
  265    HD2  LYS  39           1HD      LYS  39  10.897  19.628  -3.225
  266    HD3  LYS  39           2HD      LYS  39  11.223  19.768  -1.495
  267    HE2  LYS  39           1HE      LYS  39  12.449  21.559  -3.586
  268    HE3  LYS  39           2HE      LYS  39  10.969  21.948  -2.709
  269    HZ1  LYS  39           3HZ      LYS  39  13.485  22.562  -1.907
  270    HZ2  LYS  39           1HZ      LYS  39  13.135  21.186  -0.987
  271    HZ3  LYS  39           2HZ      LYS  39  12.118  22.535  -0.910
  272    HA   PRO  40           HA       PRO  40  13.511  16.175  -7.214
  273    HB2  PRO  40           1HB      PRO  40  13.544  18.550  -8.529
  274    HB3  PRO  40           2HB      PRO  40  12.124  17.499  -8.480
  275    HG2  PRO  40           1HG      PRO  40  12.738  19.931  -6.846
  276    HG3  PRO  40           2HG      PRO  40  11.211  19.454  -7.613
  277    HD2  PRO  40           1HD      PRO  40  11.694  19.086  -4.974
  278    HD3  PRO  40           2HD      PRO  40  10.677  17.982  -5.921
  279    H    SER  41           H        SER  41  14.287  19.391  -5.868
  280    HA   SER  41           HA       SER  41  17.071  18.618  -5.589
  281    HB2  SER  41           1HB      SER  41  17.136  19.435  -7.845
  282    HB3  SER  41           2HB      SER  41  16.182  20.855  -7.419
  283    HG   SER  41           HG       SER  41  17.911  21.629  -6.229
  284    H    GLY  42           H        GLY  42  17.625  19.239  -3.615
  285    HA2  GLY  42           1HA      GLY  42  17.676  21.806  -2.638
  286    HA3  GLY  42           2HA      GLY  42  16.110  21.175  -2.150
  287    HA   PRO  43           HA       PRO  43  19.624  18.619   0.049
  288    HB2  PRO  43           1HB      PRO  43  21.967  19.966   0.314
  289    HB3  PRO  43           2HB      PRO  43  21.625  18.892  -1.048
  290    HG2  PRO  43           1HG      PRO  43  21.449  21.877  -0.898
  291    HG3  PRO  43           2HG      PRO  43  22.106  20.858  -2.193
  292    HD2  PRO  43           1HD      PRO  43  19.638  21.964  -2.320
  293    HD3  PRO  43           2HD      PRO  43  20.021  20.396  -3.059
  294    H    SER  44           H        SER  44  18.738  21.891   0.339
  295    HA   SER  44           HA       SER  44  18.303  23.256   2.106
  296    HB2  SER  44           1HB      SER  44  16.990  21.265   2.839
  297    HB3  SER  44           2HB      SER  44  18.400  20.709   3.740
  298    HG   SER  44           HG       SER  44  16.684  22.853   4.252
  299    H    SER  45           H        SER  45  20.954  23.136   1.353
  300    HA   SER  45           HA       SER  45  22.249  24.187   3.638
  301    HB2  SER  45           1HB      SER  45  22.361  21.660   4.044
  302    HB3  SER  45           2HB      SER  45  23.479  21.603   2.681
  303    HG   SER  45           HG       SER  45  23.982  23.482   4.675
  304    H    GLY  46           H        GLY  46  24.499  24.845   3.171
  305    HA2  GLY  46           1HA      GLY  46  25.822  26.133   1.775
  306    HA3  GLY  46           2HA      GLY  46  25.939  24.616   0.895
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1  14.317 -11.782  -7.989
    2    HA2  GLY   1           1HA      GLY   1  14.966 -13.277  -6.354
    3    HA3  GLY   1           2HA      GLY   1  15.521 -11.816  -5.551
    4    H    SER   2           H        SER   2  14.978 -12.018  -3.476
    5    HA   SER   2           HA       SER   2  12.235 -12.889  -2.843
    6    HB2  SER   2           1HB      SER   2  13.090 -13.625  -0.668
    7    HB3  SER   2           2HB      SER   2  13.986 -14.399  -1.975
    8    HG   SER   2           HG       SER   2  15.209 -12.121  -1.379
    9    H    SER   3           H        SER   3  12.678 -10.252  -3.576
   10    HA   SER   3           HA       SER   3  12.030  -8.891  -1.067
   11    HB2  SER   3           1HB      SER   3  13.489  -7.033  -1.515
   12    HB3  SER   3           2HB      SER   3  14.458  -8.503  -1.611
   13    HG   SER   3           HG       SER   3  14.513  -6.753  -3.380
   14    H    GLY   4           H        GLY   4  10.217  -7.752  -1.260
   15    HA2  GLY   4           1HA      GLY   4   8.614  -6.367  -2.199
   16    HA3  GLY   4           2HA      GLY   4   9.591  -6.283  -3.658
   17    H    SER   5           H        SER   5   8.078  -9.012  -1.943
   18    HA   SER   5           HA       SER   5   6.535  -9.575  -4.385
   19    HB2  SER   5           1HB      SER   5   8.115 -11.526  -2.703
   20    HB3  SER   5           2HB      SER   5   6.886 -12.030  -3.863
   21    HG   SER   5           HG       SER   5   9.252 -10.562  -4.414
   22    H    SER   6           H        SER   6   4.780  -8.517  -3.302
   23    HA   SER   6           HA       SER   6   3.506 -10.236  -1.278
   24    HB2  SER   6           1HB      SER   6   4.287  -8.194  -0.189
   25    HB3  SER   6           2HB      SER   6   3.456  -7.210  -1.394
   26    HG   SER   6           HG       SER   6   2.071  -7.306   0.289
   27    H    GLY   7           H        GLY   7   2.352 -11.282  -2.960
   28    HA2  GLY   7           1HA      GLY   7   0.126  -9.647  -3.999
   29    HA3  GLY   7           2HA      GLY   7   0.983 -10.767  -5.048
   30    H    SER   8           H        SER   8  -0.659 -10.755  -1.883
   31    HA   SER   8           HA       SER   8  -2.044 -13.213  -2.699
   32    HB2  SER   8           1HB      SER   8  -0.701 -12.744  -0.026
   33    HB3  SER   8           2HB      SER   8  -1.761 -14.105  -0.392
   34    HG   SER   8           HG       SER   8   0.744 -14.156  -0.693
   35    H    SER   9           H        SER   9  -1.902 -10.534  -0.380
   36    HA   SER   9           HA       SER   9  -4.784 -10.800   0.086
   37    HB2  SER   9           1HB      SER   9  -3.333 -10.645   2.074
   38    HB3  SER   9           2HB      SER   9  -2.740  -9.081   1.515
   39    HG   SER   9           HG       SER   9  -5.048  -8.453   1.563
   40    H    THR  10           H        THR  10  -6.198  -9.461  -0.821
   41    HA   THR  10           HA       THR  10  -5.172  -7.019  -2.114
   42    HB   THR  10           HB       THR  10  -7.165  -7.188  -3.616
   43    HG1  THR  10           HG1      THR  10  -7.453  -9.887  -2.958
   44   HG21  THR  10          3HG2      THR  10  -4.836  -8.111  -4.127
   45   HG22  THR  10          1HG2      THR  10  -6.174  -8.727  -5.097
   46   HG23  THR  10          2HG2      THR  10  -5.518  -9.700  -3.780
   47    H    LYS  11           H        LYS  11  -6.557  -5.157  -2.134
   48    HA   LYS  11           HA       LYS  11  -8.811  -5.132  -0.296
   49    HB2  LYS  11           1HB      LYS  11  -6.477  -4.587   0.846
   50    HB3  LYS  11           2HB      LYS  11  -6.767  -3.002   0.141
   51    HG2  LYS  11           1HG      LYS  11  -7.778  -2.653   2.125
   52    HG3  LYS  11           2HG      LYS  11  -9.146  -3.390   1.287
   53    HD2  LYS  11           1HD      LYS  11  -7.272  -5.247   2.617
   54    HD3  LYS  11           2HD      LYS  11  -8.244  -4.226   3.679
   55    HE2  LYS  11           1HE      LYS  11 -10.206  -5.209   3.054
   56    HE3  LYS  11           2HE      LYS  11  -9.624  -5.593   1.435
   57    HZ1  LYS  11           3HZ      LYS  11  -8.773  -7.553   2.107
   58    HZ2  LYS  11           1HZ      LYS  11  -9.929  -7.412   3.335
   59    HZ3  LYS  11           2HZ      LYS  11  -8.321  -6.981   3.633
   60    H    SER  12           H        SER  12 -10.269  -3.486  -0.684
   61    HA   SER  12           HA       SER  12 -10.727  -2.550  -3.155
   62    HB2  SER  12           1HB      SER  12 -12.372  -2.165  -1.470
   63    HB3  SER  12           2HB      SER  12 -11.272  -1.157  -0.530
   64    HG   SER  12           HG       SER  12 -12.647   0.188  -1.648
   65    H    HIS  13           H        HIS  13  -8.778  -0.836  -0.728
   66    HA   HIS  13           HA       HIS  13  -7.579   0.718  -2.925
   67    HB2  HIS  13           1HB      HIS  13  -7.790   1.804  -0.133
   68    HB3  HIS  13           2HB      HIS  13  -7.560   2.677  -1.645
   69    HD1  HIS  13           HD1      HIS  13  -9.804   2.346  -3.324
   70    HD2  HIS  13           HD2      HIS  13 -10.308   2.056   0.790
   71    HE1  HIS  13           HE1      HIS  13 -12.255   2.734  -2.918
   72    H    GLN  14           H        GLN  14  -5.713  -0.403  -3.195
   73    HA   GLN  14           HA       GLN  14  -4.083  -0.998  -0.832
   74    HB2  GLN  14           1HB      GLN  14  -4.417  -2.889  -2.285
   75    HB3  GLN  14           2HB      GLN  14  -3.908  -1.961  -3.689
   76    HG2  GLN  14           1HG      GLN  14  -1.654  -1.858  -2.878
   77    HG3  GLN  14           2HG      GLN  14  -2.125  -2.618  -1.358
   78   HE21  GLN  14          1HE2      GLN  14  -0.629  -3.176  -4.178
   79   HE22  GLN  14          2HE2      GLN  14  -0.907  -4.873  -4.348
   80    H    CYS  15           H        CYS  15  -2.096  -0.119  -0.500
   81    HA   CYS  15           HA       CYS  15  -1.502   2.348  -1.795
   82    HB2  CYS  15           1HB      CYS  15  -0.989   1.817   0.605
   83    HB3  CYS  15           2HB      CYS  15   0.291   0.748   0.040
   84    H    HIS  16           H        HIS  16   0.613   2.852  -2.778
   85    HA   HIS  16           HA       HIS  16   1.503   0.636  -4.500
   86    HB2  HIS  16           1HB      HIS  16   0.409   2.800  -5.461
   87    HB3  HIS  16           2HB      HIS  16   1.981   3.528  -5.144
   88    HD1  HIS  16           HD1      HIS  16   3.250   3.622  -7.253
   89    HD2  HIS  16           HD2      HIS  16   1.051   0.111  -6.943
   90    HE1  HIS  16           HE1      HIS  16   3.799   2.300  -9.321
   91    H    GLU  17           H        GLU  17   2.488   3.003  -2.187
   92    HA   GLU  17           HA       GLU  17   5.276   2.961  -2.775
   93    HB2  GLU  17           1HB      GLU  17   4.051   3.632  -0.105
   94    HB3  GLU  17           2HB      GLU  17   5.566   4.216  -0.778
   95    HG2  GLU  17           1HG      GLU  17   2.810   4.889  -1.783
   96    HG3  GLU  17           2HG      GLU  17   3.853   5.937  -0.824
   97    H    CYS  18           H        CYS  18   3.207   1.232  -0.485
   98    HA   CYS  18           HA       CYS  18   5.457  -0.600   0.038
   99    HB2  CYS  18           1HB      CYS  18   4.472  -1.008   2.267
  100    HB3  CYS  18           2HB      CYS  18   4.936   0.675   2.047
  101    H    GLY  19           H        GLY  19   1.950  -0.286  -0.312
  102    HA2  GLY  19           1HA      GLY  19   0.751  -1.855  -1.696
  103    HA3  GLY  19           2HA      GLY  19   1.887  -3.097  -1.193
  104    H    ARG  20           H        ARG  20   0.487  -0.836   1.070
  105    HA   ARG  20           HA       ARG  20  -0.551  -2.982   2.659
  106    HB2  ARG  20           1HB      ARG  20  -0.350  -0.024   2.913
  107    HB3  ARG  20           2HB      ARG  20  -1.569  -0.840   3.883
  108    HG2  ARG  20           1HG      ARG  20   0.432  -2.404   4.526
  109    HG3  ARG  20           2HG      ARG  20   1.397  -1.013   4.025
  110    HD2  ARG  20           1HD      ARG  20   1.000  -0.866   6.389
  111    HD3  ARG  20           2HD      ARG  20   0.075   0.398   5.579
  112    HE   ARG  20           HE       ARG  20  -1.752  -1.525   5.768
  113   HH11  ARG  20          1HH1      ARG  20   0.511  -0.313   8.120
  114   HH12  ARG  20          2HH1      ARG  20  -0.511  -0.659   9.475
  115   HH21  ARG  20          1HH2      ARG  20  -3.108  -1.985   7.544
  116   HH22  ARG  20          2HH2      ARG  20  -2.569  -1.611   9.146
  117    H    GLY  21           H        GLY  21  -2.831  -2.877   3.525
  118    HA2  GLY  21           1HA      GLY  21  -4.702  -2.148   1.356
  119    HA3  GLY  21           2HA      GLY  21  -4.839  -3.656   2.247
  120    H    PHE  22           H        PHE  22  -6.367  -0.905   1.906
  121    HA   PHE  22           HA       PHE  22  -7.166  -0.795   4.733
  122    HB2  PHE  22           1HB      PHE  22  -6.891   1.600   2.905
  123    HB3  PHE  22           2HB      PHE  22  -7.430   1.629   4.580
  124    HD1  PHE  22           HD2      PHE  22  -4.551   1.165   2.356
  125    HD2  PHE  22           HD1      PHE  22  -5.873   1.477   6.389
  126    HE1  PHE  22           HE2      PHE  22  -2.221   1.451   3.094
  127    HE2  PHE  22           HE1      PHE  22  -3.546   1.764   7.134
  128    HZ   PHE  22           HZ       PHE  22  -1.716   1.750   5.486
  129    H    THR  23           H        THR  23  -9.230  -1.306   4.954
  130    HA   THR  23           HA       THR  23 -11.002  -1.771   2.862
  131    HB   THR  23           HB       THR  23 -11.725  -1.094   5.720
  132    HG1  THR  23           HG1      THR  23 -10.229  -2.988   5.090
  133   HG21  THR  23          3HG2      THR  23 -13.276  -2.812   3.798
  134   HG22  THR  23          1HG2      THR  23 -13.558  -1.077   3.940
  135   HG23  THR  23          2HG2      THR  23 -13.807  -2.129   5.334
  136    H    LEU  24           H        LEU  24 -10.715   1.070   4.972
  137    HA   LEU  24           HA       LEU  24 -12.741   2.477   3.423
  138    HB2  LEU  24           1HB      LEU  24 -11.228   3.100   5.938
  139    HB3  LEU  24           2HB      LEU  24 -12.175   4.330   5.104
  140    HG   LEU  24           HG       LEU  24 -13.388   1.738   6.025
  141   HD11  LEU  24          1HD1      LEU  24 -12.752   2.484   8.084
  142   HD12  LEU  24          2HD1      LEU  24 -14.259   3.379   7.895
  143   HD13  LEU  24          3HD1      LEU  24 -12.717   4.176   7.586
  144   HD21  LEU  24          3HD2      LEU  24 -14.305   4.134   4.677
  145   HD22  LEU  24          1HD2      LEU  24 -15.225   3.806   6.146
  146   HD23  LEU  24          2HD2      LEU  24 -15.108   2.577   4.886
  147    H    LYS  25           H        LYS  25 -12.351   4.107   2.023
  148    HA   LYS  25           HA       LYS  25  -9.866   4.338   0.770
  149    HB2  LYS  25           1HB      LYS  25 -12.067   4.961  -0.231
  150    HB3  LYS  25           2HB      LYS  25 -12.079   6.398   0.783
  151    HG2  LYS  25           1HG      LYS  25 -11.314   7.149  -1.284
  152    HG3  LYS  25           2HG      LYS  25  -9.849   6.978  -0.315
  153    HD2  LYS  25           1HD      LYS  25  -9.371   4.843  -1.358
  154    HD3  LYS  25           2HD      LYS  25 -10.884   4.920  -2.265
  155    HE2  LYS  25           1HE      LYS  25  -8.959   7.171  -2.534
  156    HE3  LYS  25           2HE      LYS  25  -8.576   5.648  -3.335
  157    HZ1  LYS  25           3HZ      LYS  25  -9.773   6.716  -4.945
  158    HZ2  LYS  25           1HZ      LYS  25 -10.784   7.513  -3.848
  159    HZ3  LYS  25           2HZ      LYS  25 -11.017   5.869  -4.173
  160    H    SER  26           H        SER  26 -11.420   6.468   3.151
  161    HA   SER  26           HA       SER  26  -9.529   8.487   3.246
  162    HB2  SER  26           1HB      SER  26 -10.318   8.853   5.599
  163    HB3  SER  26           2HB      SER  26 -11.624   8.717   4.422
  164    HG   SER  26           HG       SER  26 -12.335   7.084   5.515
  165    H    HIS  27           H        HIS  27  -9.638   5.490   5.156
  166    HA   HIS  27           HA       HIS  27  -7.482   5.813   6.797
  167    HB2  HIS  27           1HB      HIS  27  -8.548   3.388   5.381
  168    HB3  HIS  27           2HB      HIS  27  -7.129   3.267   6.417
  169    HD1  HIS  27           HD1      HIS  27  -9.773   1.806   7.093
  170    HD2  HIS  27           HD2      HIS  27  -8.683   5.525   8.591
  171    HE1  HIS  27           HE1      HIS  27 -11.074   2.078   9.228
  172    H    LEU  28           H        LEU  28  -7.284   4.240   3.598
  173    HA   LEU  28           HA       LEU  28  -4.540   4.020   3.434
  174    HB2  LEU  28           1HB      LEU  28  -5.887   2.942   1.812
  175    HB3  LEU  28           2HB      LEU  28  -6.610   4.465   1.301
  176    HG   LEU  28           HG       LEU  28  -4.356   5.126   0.412
  177   HD11  LEU  28          1HD1      LEU  28  -2.637   3.538   0.163
  178   HD12  LEU  28          2HD1      LEU  28  -3.677   2.211   0.677
  179   HD13  LEU  28          3HD1      LEU  28  -3.149   3.421   1.846
  180   HD21  LEU  28          3HD2      LEU  28  -4.707   4.073  -1.633
  181   HD22  LEU  28          1HD2      LEU  28  -6.302   4.040  -0.879
  182   HD23  LEU  28          2HD2      LEU  28  -5.296   2.590  -0.880
  183    H    ASN  29           H        ASN  29  -6.563   6.722   2.306
  184    HA   ASN  29           HA       ASN  29  -4.690   8.359   1.184
  185    HB2  ASN  29           1HB      ASN  29  -7.255   8.700   1.621
  186    HB3  ASN  29           2HB      ASN  29  -6.700   9.570   3.049
  187   HD21  ASN  29          1HD2      ASN  29  -7.993  11.178   1.636
  188   HD22  ASN  29          2HD2      ASN  29  -7.034  12.171   0.597
  189    H    GLN  30           H        GLN  30  -5.587   8.360   4.636
  190    HA   GLN  30           HA       GLN  30  -3.605  10.200   5.427
  191    HB2  GLN  30           1HB      GLN  30  -5.569   9.725   6.802
  192    HB3  GLN  30           2HB      GLN  30  -5.018   8.073   7.045
  193    HG2  GLN  30           1HG      GLN  30  -2.916   9.145   8.061
  194    HG3  GLN  30           2HG      GLN  30  -3.889  10.613   8.150
  195   HE21  GLN  30          1HE2      GLN  30  -5.799  10.583   9.430
  196   HE22  GLN  30          2HE2      GLN  30  -5.954   9.479  10.750
  197    H    HIS  31           H        HIS  31  -3.549   6.767   4.890
  198    HA   HIS  31           HA       HIS  31  -1.171   6.201   6.338
  199    HB2  HIS  31           1HB      HIS  31  -2.316   4.257   5.928
  200    HB3  HIS  31           2HB      HIS  31  -2.846   4.779   4.331
  201    HD1  HIS  31           HD1      HIS  31   0.081   3.216   6.096
  202    HD2  HIS  31           HD2      HIS  31  -1.207   4.023   2.229
  203    HE1  HIS  31           HE1      HIS  31   1.658   1.966   4.587
  204    H    GLN  32           H        GLN  32  -1.772   6.604   2.846
  205    HA   GLN  32           HA       GLN  32   0.725   6.324   1.826
  206    HB2  GLN  32           1HB      GLN  32  -1.454   8.267   1.105
  207    HB3  GLN  32           2HB      GLN  32   0.052   8.208   0.199
  208    HG2  GLN  32           1HG      GLN  32  -0.359   6.036  -0.565
  209    HG3  GLN  32           2HG      GLN  32  -1.616   5.759   0.639
  210   HE21  GLN  32          1HE2      GLN  32  -1.406   5.811  -2.433
  211   HE22  GLN  32          2HE2      GLN  32  -2.801   6.713  -2.906
  212    H    ARG  33           H        ARG  33  -0.358   8.822   3.940
  213    HA   ARG  33           HA       ARG  33   1.409  10.887   3.399
  214    HB2  ARG  33           1HB      ARG  33   0.342   9.947   6.067
  215    HB3  ARG  33           2HB      ARG  33   1.161  11.483   5.809
  216    HG2  ARG  33           1HG      ARG  33  -0.674  11.870   4.018
  217    HG3  ARG  33           2HG      ARG  33  -1.538  10.601   4.889
  218    HD2  ARG  33           1HD      ARG  33  -2.181  12.799   5.708
  219    HD3  ARG  33           2HD      ARG  33  -1.335  11.890   6.960
  220    HE   ARG  33           HE       ARG  33   0.647  13.323   5.838
  221   HH11  ARG  33          1HH1      ARG  33  -2.502  14.196   7.037
  222   HH12  ARG  33          2HH1      ARG  33  -2.025  15.795   7.502
  223   HH21  ARG  33          1HH2      ARG  33   1.287  15.426   6.446
  224   HH22  ARG  33          2HH2      ARG  33   0.130  16.494   7.165
  225    H    ILE  34           H        ILE  34   1.897   7.981   5.357
  226    HA   ILE  34           HA       ILE  34   4.318   8.514   6.533
  227    HB   ILE  34           HB       ILE  34   4.723   6.161   6.652
  228   HG12  ILE  34          1HG1      ILE  34   2.649   5.848   4.470
  229   HG13  ILE  34          2HG1      ILE  34   4.386   5.646   4.264
  230   HG21  ILE  34          1HG2      ILE  34   3.076   6.250   8.154
  231   HG22  ILE  34          2HG2      ILE  34   2.072   7.258   7.114
  232   HG23  ILE  34          3HG2      ILE  34   2.061   5.505   6.919
  233   HD11  ILE  34          3HD1      ILE  34   3.824   3.478   4.528
  234   HD12  ILE  34          1HD1      ILE  34   3.999   3.896   6.232
  235   HD13  ILE  34          2HD1      ILE  34   2.397   3.848   5.496
  236    H    HIS  35           H        HIS  35   3.653   7.829   3.183
  237    HA   HIS  35           HA       HIS  35   6.498   7.607   2.559
  238    HB2  HIS  35           1HB      HIS  35   4.187   7.469   0.621
  239    HB3  HIS  35           2HB      HIS  35   5.834   6.892   0.377
  240    HD1  HIS  35           HD1      HIS  35   6.501   4.883   2.189
  241    HD2  HIS  35           HD2      HIS  35   2.484   5.499   1.327
  242    HE1  HIS  35           HE1      HIS  35   5.334   2.761   2.867
  243    H    THR  36           H        THR  36   3.776   9.772   2.161
  244    HA   THR  36           HA       THR  36   4.817  11.507   0.237
  245    HB   THR  36           HB       THR  36   2.985  12.165   2.551
  246    HG1  THR  36           HG1      THR  36   1.360  11.649   1.159
  247   HG21  THR  36          3HG2      THR  36   2.469  14.187   1.530
  248   HG22  THR  36          1HG2      THR  36   3.110  13.678  -0.032
  249   HG23  THR  36          2HG2      THR  36   4.212  14.074   1.287
  250    H    GLY  37           H        GLY  37   6.533  12.796   0.263
  251    HA2  GLY  37           1HA      GLY  37   8.184  14.207   1.014
  252    HA3  GLY  37           2HA      GLY  37   7.193  14.489   2.437
  253    H    GLU  38           H        GLU  38   9.883  12.792   1.117
  254    HA   GLU  38           HA       GLU  38  10.225  11.130   3.479
  255    HB2  GLU  38           1HB      GLU  38  12.172  10.219   2.309
  256    HB3  GLU  38           2HB      GLU  38  10.742  10.174   1.288
  257    HG2  GLU  38           1HG      GLU  38  11.691  12.495   0.464
  258    HG3  GLU  38           2HG      GLU  38  13.208  11.801   1.033
  259    H    LYS  39           H        LYS  39  10.474  12.869   4.996
  260    HA   LYS  39           HA       LYS  39  13.194  13.993   4.967
  261    HB2  LYS  39           1HB      LYS  39  11.633  15.784   4.440
  262    HB3  LYS  39           2HB      LYS  39  10.656  15.382   5.845
  263    HG2  LYS  39           1HG      LYS  39  12.490  16.020   7.317
  264    HG3  LYS  39           2HG      LYS  39  13.490  16.400   5.913
  265    HD2  LYS  39           1HD      LYS  39  11.578  17.998   5.256
  266    HD3  LYS  39           2HD      LYS  39  11.049  17.817   6.931
  267    HE2  LYS  39           1HE      LYS  39  12.904  18.888   7.772
  268    HE3  LYS  39           2HE      LYS  39  13.900  18.489   6.374
  269    HZ1  LYS  39           3HZ      LYS  39  12.995  20.199   5.136
  270    HZ2  LYS  39           1HZ      LYS  39  13.095  20.893   6.675
  271    HZ3  LYS  39           2HZ      LYS  39  11.610  20.324   6.100
  272    HA   PRO  40           HA       PRO  40  12.485  11.528   8.826
  273    HB2  PRO  40           1HB      PRO  40  14.915  10.318   8.770
  274    HB3  PRO  40           2HB      PRO  40  13.507   9.687   7.907
  275    HG2  PRO  40           1HG      PRO  40  15.794  11.313   6.866
  276    HG3  PRO  40           2HG      PRO  40  15.003   9.903   6.140
  277    HD2  PRO  40           1HD      PRO  40  14.466  12.438   5.356
  278    HD3  PRO  40           2HD      PRO  40  13.244  11.151   5.326
  279    H    SER  41           H        SER  41  13.031  12.266  10.795
  280    HA   SER  41           HA       SER  41  15.209  14.235  10.958
  281    HB2  SER  41           1HB      SER  41  12.775  14.840  11.574
  282    HB3  SER  41           2HB      SER  41  13.049  13.881  13.028
  283    HG   SER  41           HG       SER  41  15.109  15.383  12.961
  284    H    GLY  42           H        GLY  42  17.033  13.270  11.603
  285    HA2  GLY  42           1HA      GLY  42  18.504  12.259  13.063
  286    HA3  GLY  42           2HA      GLY  42  17.185  12.123  14.216
  287    HA   PRO  43           HA       PRO  43  18.182   8.054  11.808
  288    HB2  PRO  43           1HB      PRO  43  20.262   7.042  13.229
  289    HB3  PRO  43           2HB      PRO  43  20.479   8.044  11.790
  290    HG2  PRO  43           1HG      PRO  43  20.636   8.818  14.677
  291    HG3  PRO  43           2HG      PRO  43  21.697   9.284  13.335
  292    HD2  PRO  43           1HD      PRO  43  19.754  10.911  14.290
  293    HD3  PRO  43           2HD      PRO  43  20.241  10.906  12.583
  294    H    SER  44           H        SER  44  17.690   5.949  12.617
  295    HA   SER  44           HA       SER  44  17.261   5.532  15.430
  296    HB2  SER  44           1HB      SER  44  15.242   6.762  15.040
  297    HB3  SER  44           2HB      SER  44  14.907   5.860  13.562
  298    HG   SER  44           HG       SER  44  13.729   4.720  14.903
  299    H    SER  45           H        SER  45  17.071   3.382  15.955
  300    HA   SER  45           HA       SER  45  17.773   1.518  13.862
  301    HB2  SER  45           1HB      SER  45  17.540   1.331  16.856
  302    HB3  SER  45           2HB      SER  45  17.732  -0.119  15.870
  303    HG   SER  45           HG       SER  45  19.732   0.450  15.387
  304    H    GLY  46           H        GLY  46  16.562  -0.183  13.111
  305    HA2  GLY  46           1HA      GLY  46  14.274  -1.294  14.140
  306    HA3  GLY  46           2HA      GLY  46  13.716   0.117  13.254
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1  14.492  -4.025   1.193
    2    HA2  GLY   1           1HA      GLY   1  15.058  -6.489  -0.254
    3    HA3  GLY   1           2HA      GLY   1  14.632  -6.674   1.441
    4    H    SER   2           H        SER   2  13.489  -5.929  -1.742
    5    HA   SER   2           HA       SER   2  10.752  -5.598  -0.729
    6    HB2  SER   2           1HB      SER   2  11.842  -3.927  -2.374
    7    HB3  SER   2           2HB      SER   2  11.591  -5.179  -3.590
    8    HG   SER   2           HG       SER   2   9.430  -4.507  -1.961
    9    H    SER   3           H        SER   3  11.813  -8.158  -0.597
   10    HA   SER   3           HA       SER   3  10.015  -9.559  -2.416
   11    HB2  SER   3           1HB      SER   3  12.980 -10.102  -2.215
   12    HB3  SER   3           2HB      SER   3  11.834 -11.281  -2.853
   13    HG   SER   3           HG       SER   3  11.318  -9.855  -4.495
   14    H    GLY   4           H        GLY   4   9.589 -11.781  -1.747
   15    HA2  GLY   4           1HA      GLY   4  10.402 -13.277   0.281
   16    HA3  GLY   4           2HA      GLY   4   9.613 -11.979   1.166
   17    H    SER   5           H        SER   5   7.324 -11.591   0.707
   18    HA   SER   5           HA       SER   5   5.856 -13.707  -0.615
   19    HB2  SER   5           1HB      SER   5   5.469 -13.218   2.348
   20    HB3  SER   5           2HB      SER   5   4.545 -14.338   1.347
   21    HG   SER   5           HG       SER   5   6.503 -15.483   0.984
   22    H    SER   6           H        SER   6   4.654 -12.441  -1.887
   23    HA   SER   6           HA       SER   6   3.134 -10.259  -0.614
   24    HB2  SER   6           1HB      SER   6   4.996  -9.727  -2.397
   25    HB3  SER   6           2HB      SER   6   3.752 -10.223  -3.545
   26    HG   SER   6           HG       SER   6   3.898  -7.896  -2.842
   27    H    GLY   7           H        GLY   7   1.412 -11.724  -0.184
   28    HA2  GLY   7           1HA      GLY   7   0.156 -13.241  -2.244
   29    HA3  GLY   7           2HA      GLY   7  -0.513 -12.895  -0.656
   30    H    SER   8           H        SER   8  -2.373 -12.905  -2.425
   31    HA   SER   8           HA       SER   8  -2.758 -10.122  -3.312
   32    HB2  SER   8           1HB      SER   8  -4.387 -11.049  -4.946
   33    HB3  SER   8           2HB      SER   8  -2.758 -11.679  -5.183
   34    HG   SER   8           HG       SER   8  -4.868 -12.991  -3.807
   35    H    SER   9           H        SER   9  -4.332  -8.969  -2.405
   36    HA   SER   9           HA       SER   9  -6.359 -10.399  -0.811
   37    HB2  SER   9           1HB      SER   9  -5.211  -7.648  -0.283
   38    HB3  SER   9           2HB      SER   9  -6.403  -8.486   0.710
   39    HG   SER   9           HG       SER   9  -4.834 -10.062   1.159
   40    H    THR  10           H        THR  10  -8.473  -9.543  -0.769
   41    HA   THR  10           HA       THR  10  -9.230  -8.245  -3.243
   42    HB   THR  10           HB       THR  10 -11.541  -8.663  -2.544
   43    HG1  THR  10           HG1      THR  10 -10.971 -10.171  -0.346
   44   HG21  THR  10          3HG2      THR  10 -10.704 -10.508  -3.677
   45   HG22  THR  10          1HG2      THR  10 -11.268 -11.222  -2.167
   46   HG23  THR  10          2HG2      THR  10  -9.551 -10.896  -2.401
   47    H    LYS  11           H        LYS  11  -7.748  -6.500  -1.735
   48    HA   LYS  11           HA       LYS  11  -9.691  -4.681  -0.498
   49    HB2  LYS  11           1HB      LYS  11  -7.432  -5.435   0.591
   50    HB3  LYS  11           2HB      LYS  11  -6.729  -4.224  -0.473
   51    HG2  LYS  11           1HG      LYS  11  -7.082  -3.147   1.583
   52    HG3  LYS  11           2HG      LYS  11  -8.373  -2.582   0.521
   53    HD2  LYS  11           1HD      LYS  11  -9.469  -3.058   2.526
   54    HD3  LYS  11           2HD      LYS  11  -9.766  -4.489   1.535
   55    HE2  LYS  11           1HE      LYS  11  -8.022  -5.697   2.674
   56    HE3  LYS  11           2HE      LYS  11  -7.552  -4.253   3.570
   57    HZ1  LYS  11           3HZ      LYS  11  -9.694  -4.273   4.673
   58    HZ2  LYS  11           1HZ      LYS  11  -8.902  -5.749   4.910
   59    HZ3  LYS  11           2HZ      LYS  11 -10.169  -5.639   3.796
   60    H    SER  12           H        SER  12 -10.121  -2.693  -1.313
   61    HA   SER  12           HA       SER  12  -9.317  -2.180  -4.036
   62    HB2  SER  12           1HB      SER  12 -11.642  -1.757  -2.981
   63    HB3  SER  12           2HB      SER  12 -10.919  -0.286  -2.330
   64    HG   SER  12           HG       SER  12 -11.016   0.581  -4.240
   65    H    HIS  13           H        HIS  13  -9.280  -0.135  -1.110
   66    HA   HIS  13           HA       HIS  13  -7.407   1.700  -2.190
   67    HB2  HIS  13           1HB      HIS  13  -7.740   1.395   0.763
   68    HB3  HIS  13           2HB      HIS  13  -7.614   2.862  -0.203
   69    HD1  HIS  13           HD1      HIS  13  -9.837   3.374  -1.709
   70    HD2  HIS  13           HD2      HIS  13 -10.276   0.764   1.494
   71    HE1  HIS  13           HE1      HIS  13 -12.308   3.283  -1.249
   72    H    GLN  14           H        GLN  14  -5.721   0.290  -2.932
   73    HA   GLN  14           HA       GLN  14  -4.039  -0.829  -0.796
   74    HB2  GLN  14           1HB      GLN  14  -4.916  -2.220  -2.829
   75    HB3  GLN  14           2HB      GLN  14  -3.623  -1.412  -3.705
   76    HG2  GLN  14           1HG      GLN  14  -2.110  -2.241  -1.793
   77    HG3  GLN  14           2HG      GLN  14  -3.436  -3.344  -1.433
   78   HE21  GLN  14          1HE2      GLN  14  -1.914  -5.031  -1.916
   79   HE22  GLN  14          2HE2      GLN  14  -1.624  -5.484  -3.558
   80    H    CYS  15           H        CYS  15  -2.085   0.002  -0.390
   81    HA   CYS  15           HA       CYS  15  -1.291   2.426  -1.695
   82    HB2  CYS  15           1HB      CYS  15  -0.967   1.968   0.747
   83    HB3  CYS  15           2HB      CYS  15   0.267   0.789   0.314
   84    H    HIS  16           H        HIS  16   0.630   2.808  -2.854
   85    HA   HIS  16           HA       HIS  16   1.647   0.429  -4.249
   86    HB2  HIS  16           1HB      HIS  16   0.544   2.299  -5.563
   87    HB3  HIS  16           2HB      HIS  16   1.927   3.302  -5.135
   88    HD1  HIS  16           HD1      HIS  16   4.336   2.060  -5.854
   89    HD2  HIS  16           HD2      HIS  16   0.881   1.050  -7.928
   90    HE1  HIS  16           HE1      HIS  16   5.123   1.051  -8.019
   91    H    GLU  17           H        GLU  17   2.505   2.828  -2.006
   92    HA   GLU  17           HA       GLU  17   5.305   2.943  -2.584
   93    HB2  GLU  17           1HB      GLU  17   3.995   3.611   0.048
   94    HB3  GLU  17           2HB      GLU  17   5.509   4.235  -0.592
   95    HG2  GLU  17           1HG      GLU  17   2.916   4.732  -2.000
   96    HG3  GLU  17           2HG      GLU  17   3.433   5.738  -0.648
   97    H    CYS  18           H        CYS  18   3.276   1.122  -0.341
   98    HA   CYS  18           HA       CYS  18   5.610  -0.570   0.275
   99    HB2  CYS  18           1HB      CYS  18   4.629  -0.990   2.488
  100    HB3  CYS  18           2HB      CYS  18   4.945   0.724   2.244
  101    H    GLY  19           H        GLY  19   2.128  -0.429  -0.267
  102    HA2  GLY  19           1HA      GLY  19   1.087  -2.103  -1.660
  103    HA3  GLY  19           2HA      GLY  19   2.225  -3.278  -1.015
  104    H    ARG  20           H        ARG  20   0.561  -0.957   1.004
  105    HA   ARG  20           HA       ARG  20  -0.559  -3.102   2.574
  106    HB2  ARG  20           1HB      ARG  20  -0.297  -0.151   2.848
  107    HB3  ARG  20           2HB      ARG  20  -1.597  -0.933   3.738
  108    HG2  ARG  20           1HG      ARG  20   0.217  -2.526   4.601
  109    HG3  ARG  20           2HG      ARG  20   1.359  -1.319   4.007
  110    HD2  ARG  20           1HD      ARG  20   0.488   0.345   5.456
  111    HD3  ARG  20           2HD      ARG  20  -0.908  -0.650   5.868
  112    HE   ARG  20           HE       ARG  20   1.217  -2.134   6.688
  113   HH11  ARG  20          1HH1      ARG  20   0.148   1.124   7.292
  114   HH12  ARG  20          2HH1      ARG  20   0.827   1.191   8.885
  115   HH21  ARG  20          1HH2      ARG  20   2.115  -2.058   8.783
  116   HH22  ARG  20          2HH2      ARG  20   1.946  -0.620   9.732
  117    H    GLY  21           H        GLY  21  -2.879  -2.966   3.294
  118    HA2  GLY  21           1HA      GLY  21  -4.630  -2.047   1.105
  119    HA3  GLY  21           2HA      GLY  21  -4.780  -3.676   1.748
  120    H    PHE  22           H        PHE  22  -6.382  -0.964   1.735
  121    HA   PHE  22           HA       PHE  22  -7.237  -1.217   4.541
  122    HB2  PHE  22           1HB      PHE  22  -7.146   1.332   2.913
  123    HB3  PHE  22           2HB      PHE  22  -7.738   1.186   4.564
  124    HD1  PHE  22           HD2      PHE  22  -4.755   1.109   2.424
  125    HD2  PHE  22           HD1      PHE  22  -6.237   1.059   6.414
  126    HE1  PHE  22           HE2      PHE  22  -2.483   1.532   3.270
  127    HE2  PHE  22           HE1      PHE  22  -3.969   1.483   7.266
  128    HZ   PHE  22           HZ       PHE  22  -2.088   1.719   5.694
  129    H    THR  23           H        THR  23  -9.475  -0.785   4.950
  130    HA   THR  23           HA       THR  23 -11.171  -1.700   2.792
  131    HB   THR  23           HB       THR  23 -11.849  -1.011   5.657
  132    HG1  THR  23           HG1      THR  23 -11.803  -3.249   5.942
  133   HG21  THR  23          3HG2      THR  23 -13.769  -0.806   4.095
  134   HG22  THR  23          1HG2      THR  23 -13.968  -2.105   5.271
  135   HG23  THR  23          2HG2      THR  23 -13.511  -2.482   3.610
  136    H    LEU  24           H        LEU  24 -10.778   1.217   4.752
  137    HA   LEU  24           HA       LEU  24 -12.732   2.588   3.035
  138    HB2  LEU  24           1HB      LEU  24 -11.753   3.087   5.822
  139    HB3  LEU  24           2HB      LEU  24 -12.508   4.376   4.887
  140    HG   LEU  24           HG       LEU  24 -13.867   1.747   5.442
  141   HD11  LEU  24          1HD1      LEU  24 -13.160   3.487   7.407
  142   HD12  LEU  24          2HD1      LEU  24 -14.569   2.428   7.457
  143   HD13  LEU  24          3HD1      LEU  24 -14.745   4.106   6.942
  144   HD21  LEU  24          3HD2      LEU  24 -14.551   4.251   4.061
  145   HD22  LEU  24          1HD2      LEU  24 -15.789   3.632   5.155
  146   HD23  LEU  24          2HD2      LEU  24 -15.186   2.619   3.842
  147    H    LYS  25           H        LYS  25 -12.237   4.656   2.186
  148    HA   LYS  25           HA       LYS  25  -9.686   4.916   1.078
  149    HB2  LYS  25           1HB      LYS  25 -12.104   6.627   1.262
  150    HB3  LYS  25           2HB      LYS  25 -10.596   7.437   0.862
  151    HG2  LYS  25           1HG      LYS  25 -11.705   5.070  -0.630
  152    HG3  LYS  25           2HG      LYS  25 -11.918   6.754  -1.113
  153    HD2  LYS  25           1HD      LYS  25  -9.150   5.817  -0.594
  154    HD3  LYS  25           2HD      LYS  25  -9.945   5.235  -2.059
  155    HE2  LYS  25           1HE      LYS  25 -10.341   7.494  -2.796
  156    HE3  LYS  25           2HE      LYS  25  -9.716   8.139  -1.279
  157    HZ1  LYS  25           3HZ      LYS  25  -7.869   8.334  -2.550
  158    HZ2  LYS  25           1HZ      LYS  25  -8.274   7.046  -3.569
  159    HZ3  LYS  25           2HZ      LYS  25  -7.625   6.740  -2.037
  160    H    SER  26           H        SER  26 -11.159   7.126   3.464
  161    HA   SER  26           HA       SER  26  -9.147   8.722   4.157
  162    HB2  SER  26           1HB      SER  26 -10.993   7.264   6.055
  163    HB3  SER  26           2HB      SER  26  -9.943   8.589   6.555
  164    HG   SER  26           HG       SER  26 -12.111   8.647   4.743
  165    H    HIS  27           H        HIS  27  -9.404   5.347   5.187
  166    HA   HIS  27           HA       HIS  27  -7.214   5.253   6.908
  167    HB2  HIS  27           1HB      HIS  27  -8.306   3.091   5.095
  168    HB3  HIS  27           2HB      HIS  27  -7.172   2.817   6.414
  169    HD1  HIS  27           HD1      HIS  27  -9.899   1.427   6.422
  170    HD2  HIS  27           HD2      HIS  27  -9.149   5.067   8.279
  171    HE1  HIS  27           HE1      HIS  27 -11.662   1.649   8.202
  172    H    LEU  28           H        LEU  28  -7.285   4.203   3.495
  173    HA   LEU  28           HA       LEU  28  -4.475   3.953   3.291
  174    HB2  LEU  28           1HB      LEU  28  -5.731   2.715   1.756
  175    HB3  LEU  28           2HB      LEU  28  -6.705   4.109   1.295
  176    HG   LEU  28           HG       LEU  28  -4.349   4.974   0.414
  177   HD11  LEU  28          1HD1      LEU  28  -4.126   1.991   0.069
  178   HD12  LEU  28          2HD1      LEU  28  -3.205   2.922   1.250
  179   HD13  LEU  28          3HD1      LEU  28  -2.989   3.225  -0.474
  180   HD21  LEU  28          3HD2      LEU  28  -5.878   2.943  -1.187
  181   HD22  LEU  28          1HD2      LEU  28  -5.051   4.394  -1.752
  182   HD23  LEU  28          2HD2      LEU  28  -6.535   4.536  -0.810
  183    H    ASN  29           H        ASN  29  -6.709   6.453   2.087
  184    HA   ASN  29           HA       ASN  29  -4.919   8.151   0.881
  185    HB2  ASN  29           1HB      ASN  29  -7.388   8.447   0.897
  186    HB3  ASN  29           2HB      ASN  29  -7.285   9.006   2.564
  187   HD21  ASN  29          1HD2      ASN  29  -7.941  11.063   2.308
  188   HD22  ASN  29          2HD2      ASN  29  -7.116  12.238   1.348
  189    H    GLN  30           H        GLN  30  -5.663   7.855   4.317
  190    HA   GLN  30           HA       GLN  30  -3.935  10.045   5.049
  191    HB2  GLN  30           1HB      GLN  30  -6.004   9.408   6.322
  192    HB3  GLN  30           2HB      GLN  30  -5.167   7.953   6.848
  193    HG2  GLN  30           1HG      GLN  30  -3.505   9.277   7.993
  194    HG3  GLN  30           2HG      GLN  30  -4.239  10.763   7.394
  195   HE21  GLN  30          1HE2      GLN  30  -3.777   9.946  10.130
  196   HE22  GLN  30          2HE2      GLN  30  -5.321   9.920  10.903
  197    H    HIS  31           H        HIS  31  -3.626   6.661   4.536
  198    HA   HIS  31           HA       HIS  31  -1.299   6.282   6.169
  199    HB2  HIS  31           1HB      HIS  31  -2.375   4.271   5.853
  200    HB3  HIS  31           2HB      HIS  31  -2.816   4.645   4.190
  201    HD1  HIS  31           HD1      HIS  31  -0.046   3.228   6.261
  202    HD2  HIS  31           HD2      HIS  31  -0.918   3.933   2.261
  203    HE1  HIS  31           HE1      HIS  31   1.701   1.971   4.960
  204    H    GLN  32           H        GLN  32  -1.899   6.766   2.709
  205    HA   GLN  32           HA       GLN  32   0.627   6.421   1.689
  206    HB2  GLN  32           1HB      GLN  32  -1.629   8.241   0.936
  207    HB3  GLN  32           2HB      GLN  32  -0.096   8.358   0.084
  208    HG2  GLN  32           1HG      GLN  32  -0.261   5.986  -0.514
  209    HG3  GLN  32           2HG      GLN  32  -1.817   5.899   0.310
  210   HE21  GLN  32          1HE2      GLN  32  -2.930   5.335  -1.538
  211   HE22  GLN  32          2HE2      GLN  32  -3.222   6.447  -2.828
  212    H    ARG  33           H        ARG  33  -0.429   8.815   3.880
  213    HA   ARG  33           HA       ARG  33   1.316  10.928   3.288
  214    HB2  ARG  33           1HB      ARG  33   0.187  10.051   5.952
  215    HB3  ARG  33           2HB      ARG  33   0.985  11.590   5.661
  216    HG2  ARG  33           1HG      ARG  33  -0.819  11.878   3.814
  217    HG3  ARG  33           2HG      ARG  33  -1.681  10.636   4.724
  218    HD2  ARG  33           1HD      ARG  33  -2.492  12.522   5.737
  219    HD3  ARG  33           2HD      ARG  33  -1.098  12.187   6.764
  220    HE   ARG  33           HE       ARG  33  -0.595  13.968   4.541
  221   HH11  ARG  33          1HH1      ARG  33  -1.474  13.669   7.896
  222   HH12  ARG  33          2HH1      ARG  33  -0.990  15.282   8.302
  223   HH21  ARG  33          1HH2      ARG  33   0.046  16.094   5.062
  224   HH22  ARG  33          2HH2      ARG  33  -0.126  16.661   6.689
  225    H    ILE  34           H        ILE  34   1.785   7.948   5.077
  226    HA   ILE  34           HA       ILE  34   4.224   8.596   6.321
  227    HB   ILE  34           HB       ILE  34   4.487   6.304   6.789
  228   HG12  ILE  34          1HG1      ILE  34   2.569   5.696   4.529
  229   HG13  ILE  34          2HG1      ILE  34   4.318   5.516   4.444
  230   HG21  ILE  34          1HG2      ILE  34   2.723   6.477   8.129
  231   HG22  ILE  34          2HG2      ILE  34   1.875   7.498   6.970
  232   HG23  ILE  34          3HG2      ILE  34   1.753   5.743   6.852
  233   HD11  ILE  34          3HD1      ILE  34   3.967   3.970   6.512
  234   HD12  ILE  34          1HD1      ILE  34   2.311   3.881   5.912
  235   HD13  ILE  34          2HD1      ILE  34   3.651   3.371   4.883
  236    H    HIS  35           H        HIS  35   3.508   8.261   3.070
  237    HA   HIS  35           HA       HIS  35   6.311   7.628   2.415
  238    HB2  HIS  35           1HB      HIS  35   3.914   7.326   0.598
  239    HB3  HIS  35           2HB      HIS  35   5.560   6.786   0.280
  240    HD1  HIS  35           HD1      HIS  35   6.420   4.926   2.169
  241    HD2  HIS  35           HD2      HIS  35   2.334   5.357   1.550
  242    HE1  HIS  35           HE1      HIS  35   5.378   2.820   3.065
  243    H    THR  36           H        THR  36   4.880  10.234   3.064
  244    HA   THR  36           HA       THR  36   5.753  11.686   0.652
  245    HB   THR  36           HB       THR  36   4.029  13.375   1.064
  246    HG1  THR  36           HG1      THR  36   2.314  12.530   2.633
  247   HG21  THR  36          3HG2      THR  36   2.106  11.313   1.027
  248   HG22  THR  36          1HG2      THR  36   3.548  10.672   0.240
  249   HG23  THR  36          2HG2      THR  36   2.809  12.161  -0.350
  250    H    GLY  37           H        GLY  37   5.276  11.825   4.163
  251    HA2  GLY  37           1HA      GLY  37   7.433  13.843   4.267
  252    HA3  GLY  37           2HA      GLY  37   6.038  13.900   5.334
  253    H    GLU  38           H        GLU  38   5.892  11.116   5.902
  254    HA   GLU  38           HA       GLU  38   7.713  10.971   8.058
  255    HB2  GLU  38           1HB      GLU  38   5.384   9.832   7.705
  256    HB3  GLU  38           2HB      GLU  38   6.330   8.545   6.971
  257    HG2  GLU  38           1HG      GLU  38   6.880   9.602   9.727
  258    HG3  GLU  38           2HG      GLU  38   5.768   8.271   9.410
  259    H    LYS  39           H        LYS  39   9.804  10.538   7.952
  260    HA   LYS  39           HA       LYS  39  10.766   8.725   5.837
  261    HB2  LYS  39           1HB      LYS  39  11.637  10.962   5.525
  262    HB3  LYS  39           2HB      LYS  39  12.174  11.027   7.198
  263    HG2  LYS  39           1HG      LYS  39  13.778   9.236   6.752
  264    HG3  LYS  39           2HG      LYS  39  13.242   9.181   5.071
  265    HD2  LYS  39           1HD      LYS  39  14.324  11.678   6.358
  266    HD3  LYS  39           2HD      LYS  39  15.353  10.504   5.534
  267    HE2  LYS  39           1HE      LYS  39  14.928  11.953   3.813
  268    HE3  LYS  39           2HE      LYS  39  13.597  10.817   3.601
  269    HZ1  LYS  39           3HZ      LYS  39  12.288  12.594   3.697
  270    HZ2  LYS  39           1HZ      LYS  39  13.524  13.596   4.273
  271    HZ3  LYS  39           2HZ      LYS  39  12.622  12.659   5.354
  272    HA   PRO  40           HA       PRO  40  11.487   6.498   9.799
  273    HB2  PRO  40           1HB      PRO  40  11.016   4.040   8.746
  274    HB3  PRO  40           2HB      PRO  40   9.727   5.093   9.340
  275    HG2  PRO  40           1HG      PRO  40  10.656   4.635   6.531
  276    HG3  PRO  40           2HG      PRO  40   9.001   4.755   7.157
  277    HD2  PRO  40           1HD      PRO  40  10.239   6.814   5.908
  278    HD3  PRO  40           2HD      PRO  40   9.052   7.059   7.205
  279    H    SER  41           H        SER  41  12.468   5.369   6.559
  280    HA   SER  41           HA       SER  41  14.368   4.278   5.870
  281    HB2  SER  41           1HB      SER  41  15.276   6.728   7.343
  282    HB3  SER  41           2HB      SER  41  16.472   5.624   6.664
  283    HG   SER  41           HG       SER  41  14.855   7.422   5.408
  284    H    GLY  42           H        GLY  42  13.323   2.878   7.963
  285    HA2  GLY  42           1HA      GLY  42  15.743   2.090   9.464
  286    HA3  GLY  42           2HA      GLY  42  14.149   2.113  10.205
  287    HA   PRO  43           HA       PRO  43  13.423  -2.039   9.024
  288    HB2  PRO  43           1HB      PRO  43  10.810  -2.022   8.287
  289    HB3  PRO  43           2HB      PRO  43  11.336  -1.859   9.967
  290    HG2  PRO  43           1HG      PRO  43  10.500   0.264   8.029
  291    HG3  PRO  43           2HG      PRO  43  10.082   0.087   9.743
  292    HD2  PRO  43           1HD      PRO  43  11.994   1.799   8.879
  293    HD3  PRO  43           2HD      PRO  43  12.084   0.983  10.453
  294    H    SER  44           H        SER  44  13.526   0.372   6.750
  295    HA   SER  44           HA       SER  44  13.307   0.453   4.446
  296    HB2  SER  44           1HB      SER  44  15.087  -1.901   5.065
  297    HB3  SER  44           2HB      SER  44  14.836  -1.332   3.415
  298    HG   SER  44           HG       SER  44  16.400  -0.009   3.896
  299    H    SER  45           H        SER  45  10.990  -0.670   5.453
  300    HA   SER  45           HA       SER  45  10.449  -3.081   3.910
  301    HB2  SER  45           1HB      SER  45   8.355  -3.183   5.092
  302    HB3  SER  45           2HB      SER  45   9.615  -2.803   6.266
  303    HG   SER  45           HG       SER  45   8.977  -0.534   5.870
  304    H    GLY  46           H        GLY  46   8.137  -3.056   2.864
  305    HA2  GLY  46           1HA      GLY  46   6.828  -0.925   1.839
  306    HA3  GLY  46           2HA      GLY  46   8.248  -1.027   0.807
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1   9.065 -26.786   4.358
    2    HA2  GLY   1           1HA      GLY   1   6.660 -28.133   5.189
    3    HA3  GLY   1           2HA      GLY   1   7.458 -26.809   6.025
    4    H    SER   2           H        SER   2   6.206 -25.090   6.217
    5    HA   SER   2           HA       SER   2   4.451 -24.376   3.962
    6    HB2  SER   2           1HB      SER   2   2.968 -25.221   5.618
    7    HB3  SER   2           2HB      SER   2   3.818 -24.379   6.914
    8    HG   SER   2           HG       SER   2   2.318 -23.178   4.823
    9    H    SER   3           H        SER   3   5.903 -22.848   3.181
   10    HA   SER   3           HA       SER   3   6.880 -20.753   4.923
   11    HB2  SER   3           1HB      SER   3   7.995 -19.898   2.899
   12    HB3  SER   3           2HB      SER   3   8.323 -21.614   3.132
   13    HG   SER   3           HG       SER   3   6.130 -21.418   1.671
   14    H    GLY   4           H        GLY   4   4.104 -20.814   4.893
   15    HA2  GLY   4           1HA      GLY   4   2.362 -19.315   4.794
   16    HA3  GLY   4           2HA      GLY   4   3.513 -18.115   4.227
   17    H    SER   5           H        SER   5   0.724 -19.507   3.431
   18    HA   SER   5           HA       SER   5   1.301 -19.768   0.569
   19    HB2  SER   5           1HB      SER   5   0.042 -21.616   1.425
   20    HB3  SER   5           2HB      SER   5  -1.099 -20.544   2.236
   21    HG   SER   5           HG       SER   5  -1.795 -19.847   0.179
   22    H    SER   6           H        SER   6  -1.302 -18.353   2.561
   23    HA   SER   6           HA       SER   6  -1.412 -16.118   0.641
   24    HB2  SER   6           1HB      SER   6  -3.684 -17.436   2.144
   25    HB3  SER   6           2HB      SER   6  -3.843 -15.945   1.215
   26    HG   SER   6           HG       SER   6  -4.397 -17.956   0.094
   27    H    GLY   7           H        GLY   7   0.001 -14.843   1.875
   28    HA2  GLY   7           1HA      GLY   7  -0.951 -14.099   4.562
   29    HA3  GLY   7           2HA      GLY   7   0.689 -13.877   3.972
   30    H    SER   8           H        SER   8   0.741 -12.438   1.898
   31    HA   SER   8           HA       SER   8  -0.026  -9.861   2.650
   32    HB2  SER   8           1HB      SER   8   0.654 -10.891  -0.116
   33    HB3  SER   8           2HB      SER   8   0.618  -9.194   0.360
   34    HG   SER   8           HG       SER   8   2.477  -9.423   1.340
   35    H    SER   9           H        SER   9  -2.022  -9.103   2.820
   36    HA   SER   9           HA       SER   9  -4.099 -10.099   1.005
   37    HB2  SER   9           1HB      SER   9  -4.109  -8.934   3.751
   38    HB3  SER   9           2HB      SER   9  -5.529  -8.672   2.739
   39    HG   SER   9           HG       SER   9  -4.938 -11.197   2.466
   40    H    THR  10           H        THR  10  -5.414  -8.710  -0.179
   41    HA   THR  10           HA       THR  10  -4.413  -5.948  -0.436
   42    HB   THR  10           HB       THR  10  -3.817  -7.226  -2.418
   43    HG1  THR  10           HG1      THR  10  -4.523  -5.701  -3.781
   44   HG21  THR  10          3HG2      THR  10  -6.773  -7.799  -2.654
   45   HG22  THR  10          1HG2      THR  10  -5.511  -8.975  -2.288
   46   HG23  THR  10          2HG2      THR  10  -5.556  -8.191  -3.868
   47    H    LYS  11           H        LYS  11  -5.901  -4.304  -0.695
   48    HA   LYS  11           HA       LYS  11  -8.737  -5.055  -0.429
   49    HB2  LYS  11           1HB      LYS  11  -7.468  -4.082   1.654
   50    HB3  LYS  11           2HB      LYS  11  -7.680  -2.547   0.821
   51    HG2  LYS  11           1HG      LYS  11  -9.483  -2.755   2.327
   52    HG3  LYS  11           2HG      LYS  11 -10.139  -3.067   0.718
   53    HD2  LYS  11           1HD      LYS  11  -9.548  -5.568   1.371
   54    HD3  LYS  11           2HD      LYS  11  -9.729  -4.925   3.004
   55    HE2  LYS  11           1HE      LYS  11 -11.967  -4.239   2.567
   56    HE3  LYS  11           2HE      LYS  11 -11.795  -4.562   0.843
   57    HZ1  LYS  11           3HZ      LYS  11 -12.525  -6.339   2.941
   58    HZ2  LYS  11           1HZ      LYS  11 -11.196  -6.936   2.081
   59    HZ3  LYS  11           2HZ      LYS  11 -12.629  -6.558   1.267
   60    H    SER  12           H        SER  12 -10.254  -3.392  -1.160
   61    HA   SER  12           HA       SER  12 -10.046  -2.614  -3.709
   62    HB2  SER  12           1HB      SER  12 -11.318  -0.931  -1.536
   63    HB3  SER  12           2HB      SER  12 -11.667  -0.812  -3.261
   64    HG   SER  12           HG       SER  12 -12.733  -2.466  -1.466
   65    H    HIS  13           H        HIS  13  -9.084  -0.512  -0.997
   66    HA   HIS  13           HA       HIS  13  -7.600   1.170  -2.887
   67    HB2  HIS  13           1HB      HIS  13  -8.000   1.806   0.023
   68    HB3  HIS  13           2HB      HIS  13  -7.711   2.910  -1.317
   69    HD1  HIS  13           HD1      HIS  13  -9.818   2.927  -3.128
   70    HD2  HIS  13           HD2      HIS  13 -10.595   1.698   0.764
   71    HE1  HIS  13           HE1      HIS  13 -12.306   3.144  -2.839
   72    H    GLN  14           H        GLN  14  -5.890  -0.379  -3.146
   73    HA   GLN  14           HA       GLN  14  -4.241  -0.937  -0.811
   74    HB2  GLN  14           1HB      GLN  14  -4.643  -2.770  -2.356
   75    HB3  GLN  14           2HB      GLN  14  -3.995  -1.824  -3.690
   76    HG2  GLN  14           1HG      GLN  14  -1.815  -1.760  -2.438
   77    HG3  GLN  14           2HG      GLN  14  -2.509  -2.946  -1.334
   78   HE21  GLN  14          1HE2      GLN  14  -0.210  -3.328  -2.939
   79   HE22  GLN  14          2HE2      GLN  14  -0.549  -4.606  -4.051
   80    H    CYS  15           H        CYS  15  -2.155  -0.211  -0.525
   81    HA   CYS  15           HA       CYS  15  -1.525   2.309  -1.730
   82    HB2  CYS  15           1HB      CYS  15  -1.030   1.600   0.671
   83    HB3  CYS  15           2HB      CYS  15   0.306   0.663   0.012
   84    H    HIS  16           H        HIS  16   0.562   2.791  -2.742
   85    HA   HIS  16           HA       HIS  16   1.441   0.569  -4.464
   86    HB2  HIS  16           1HB      HIS  16   0.313   2.544  -5.567
   87    HB3  HIS  16           2HB      HIS  16   1.692   3.519  -5.067
   88    HD1  HIS  16           HD1      HIS  16   3.808   3.344  -6.446
   89    HD2  HIS  16           HD2      HIS  16   0.908   0.584  -7.557
   90    HE1  HIS  16           HE1      HIS  16   4.635   2.327  -8.592
   91    H    GLU  17           H        GLU  17   2.412   2.885  -2.126
   92    HA   GLU  17           HA       GLU  17   5.202   2.898  -2.770
   93    HB2  GLU  17           1HB      GLU  17   3.990   3.593  -0.099
   94    HB3  GLU  17           2HB      GLU  17   5.501   4.173  -0.785
   95    HG2  GLU  17           1HG      GLU  17   2.756   4.812  -1.839
   96    HG3  GLU  17           2HG      GLU  17   3.735   5.870  -0.825
   97    H    CYS  18           H        CYS  18   3.168   1.179  -0.442
   98    HA   CYS  18           HA       CYS  18   5.443  -0.615   0.101
   99    HB2  CYS  18           1HB      CYS  18   4.468  -1.021   2.325
  100    HB3  CYS  18           2HB      CYS  18   4.859   0.680   2.090
  101    H    GLY  19           H        GLY  19   1.942  -0.365  -0.320
  102    HA2  GLY  19           1HA      GLY  19   0.763  -1.958  -1.673
  103    HA3  GLY  19           2HA      GLY  19   1.941  -3.174  -1.200
  104    H    ARG  20           H        ARG  20   0.370  -0.945   1.017
  105    HA   ARG  20           HA       ARG  20  -0.562  -3.165   2.608
  106    HB2  ARG  20           1HB      ARG  20  -0.399  -0.210   2.937
  107    HB3  ARG  20           2HB      ARG  20  -1.587  -1.074   3.904
  108    HG2  ARG  20           1HG      ARG  20   0.374  -2.603   4.562
  109    HG3  ARG  20           2HG      ARG  20   1.395  -1.305   3.939
  110    HD2  ARG  20           1HD      ARG  20   0.568   0.237   5.526
  111    HD3  ARG  20           2HD      ARG  20  -0.769  -0.823   5.968
  112    HE   ARG  20           HE       ARG  20   0.632  -1.948   7.392
  113   HH11  ARG  20          1HH1      ARG  20   2.518   0.056   5.259
  114   HH12  ARG  20          2HH1      ARG  20   4.002  -0.206   6.114
  115   HH21  ARG  20          1HH2      ARG  20   2.580  -2.300   8.525
  116   HH22  ARG  20          2HH2      ARG  20   4.037  -1.547   7.971
  117    H    GLY  21           H        GLY  21  -2.831  -3.129   3.485
  118    HA2  GLY  21           1HA      GLY  21  -4.724  -2.386   1.338
  119    HA3  GLY  21           2HA      GLY  21  -4.851  -3.887   2.243
  120    H    PHE  22           H        PHE  22  -6.306  -1.055   1.900
  121    HA   PHE  22           HA       PHE  22  -7.091  -0.932   4.736
  122    HB2  PHE  22           1HB      PHE  22  -6.909   1.416   2.837
  123    HB3  PHE  22           2HB      PHE  22  -7.392   1.480   4.528
  124    HD1  PHE  22           HD2      PHE  22  -4.594   1.109   2.208
  125    HD2  PHE  22           HD1      PHE  22  -5.761   1.296   6.297
  126    HE1  PHE  22           HE2      PHE  22  -2.246   1.451   2.859
  127    HE2  PHE  22           HE1      PHE  22  -3.414   1.639   6.955
  128    HZ   PHE  22           HZ       PHE  22  -1.653   1.716   5.235
  129    H    THR  23           H        THR  23  -9.230  -0.950   5.161
  130    HA   THR  23           HA       THR  23 -11.046  -1.761   3.159
  131    HB   THR  23           HB       THR  23 -12.800  -1.276   4.960
  132    HG1  THR  23           HG1      THR  23 -12.126  -0.512   6.854
  133   HG21  THR  23          3HG2      THR  23 -11.975  -3.507   4.648
  134   HG22  THR  23          1HG2      THR  23 -12.005  -3.178   6.380
  135   HG23  THR  23          2HG2      THR  23 -10.478  -3.127   5.498
  136    H    LEU  24           H        LEU  24 -10.964   1.262   5.058
  137    HA   LEU  24           HA       LEU  24 -12.810   2.523   3.220
  138    HB2  LEU  24           1HB      LEU  24 -11.402   3.478   5.701
  139    HB3  LEU  24           2HB      LEU  24 -12.440   4.515   4.725
  140    HG   LEU  24           HG       LEU  24 -14.215   2.637   5.161
  141   HD11  LEU  24          1HD1      LEU  24 -13.262   2.241   7.819
  142   HD12  LEU  24          2HD1      LEU  24 -12.038   1.684   6.679
  143   HD13  LEU  24          3HD1      LEU  24 -13.677   1.039   6.597
  144   HD21  LEU  24          3HD2      LEU  24 -14.614   4.840   5.901
  145   HD22  LEU  24          1HD2      LEU  24 -13.321   4.756   7.098
  146   HD23  LEU  24          2HD2      LEU  24 -14.797   3.818   7.328
  147    H    LYS  25           H        LYS  25 -12.363   4.385   1.988
  148    HA   LYS  25           HA       LYS  25  -9.814   4.385   0.730
  149    HB2  LYS  25           1HB      LYS  25 -11.892   4.960  -0.462
  150    HB3  LYS  25           2HB      LYS  25 -12.059   6.402   0.531
  151    HG2  LYS  25           1HG      LYS  25 -11.151   7.204  -1.443
  152    HG3  LYS  25           2HG      LYS  25  -9.747   7.049  -0.385
  153    HD2  LYS  25           1HD      LYS  25  -9.173   4.927  -1.420
  154    HD3  LYS  25           2HD      LYS  25 -10.615   5.009  -2.434
  155    HE2  LYS  25           1HE      LYS  25  -9.761   6.742  -3.723
  156    HE3  LYS  25           2HE      LYS  25  -8.597   7.218  -2.489
  157    HZ1  LYS  25           3HZ      LYS  25  -7.817   4.712  -3.056
  158    HZ2  LYS  25           1HZ      LYS  25  -7.159   6.101  -3.764
  159    HZ3  LYS  25           2HZ      LYS  25  -8.365   5.231  -4.570
  160    H    SER  26           H        SER  26 -11.286   6.291   3.260
  161    HA   SER  26           HA       SER  26  -9.391   8.414   3.225
  162    HB2  SER  26           1HB      SER  26 -10.311   8.871   5.545
  163    HB3  SER  26           2HB      SER  26 -11.506   8.846   4.248
  164    HG   SER  26           HG       SER  26 -11.014   6.429   5.517
  165    H    HIS  27           H        HIS  27  -9.409   5.226   4.546
  166    HA   HIS  27           HA       HIS  27  -7.466   5.602   6.578
  167    HB2  HIS  27           1HB      HIS  27  -8.496   3.194   5.099
  168    HB3  HIS  27           2HB      HIS  27  -7.164   3.054   6.242
  169    HD1  HIS  27           HD1      HIS  27  -9.995   1.729   6.628
  170    HD2  HIS  27           HD2      HIS  27  -8.720   5.280   8.368
  171    HE1  HIS  27           HE1      HIS  27 -11.422   2.023   8.677
  172    H    LEU  28           H        LEU  28  -7.186   4.168   3.323
  173    HA   LEU  28           HA       LEU  28  -4.436   3.808   3.304
  174    HB2  LEU  28           1HB      LEU  28  -5.739   2.820   1.592
  175    HB3  LEU  28           2HB      LEU  28  -6.384   4.380   1.087
  176    HG   LEU  28           HG       LEU  28  -4.009   4.961   0.381
  177   HD11  LEU  28          1HD1      LEU  28  -2.423   3.262   0.092
  178   HD12  LEU  28          2HD1      LEU  28  -3.604   1.987   0.388
  179   HD13  LEU  28          3HD1      LEU  28  -3.059   3.009   1.718
  180   HD21  LEU  28          3HD2      LEU  28  -4.222   3.486  -1.700
  181   HD22  LEU  28          1HD2      LEU  28  -5.555   4.581  -1.332
  182   HD23  LEU  28          2HD2      LEU  28  -5.694   2.864  -0.951
  183    H    ASN  29           H        ASN  29  -6.328   6.640   2.313
  184    HA   ASN  29           HA       ASN  29  -4.274   8.216   1.313
  185    HB2  ASN  29           1HB      ASN  29  -6.687   8.773   1.159
  186    HB3  ASN  29           2HB      ASN  29  -6.684   9.167   2.876
  187   HD21  ASN  29          1HD2      ASN  29  -7.326  11.282   2.431
  188   HD22  ASN  29          2HD2      ASN  29  -6.227  12.452   1.792
  189    H    GLN  30           H        GLN  30  -5.626   8.341   4.614
  190    HA   GLN  30           HA       GLN  30  -3.743  10.098   5.678
  191    HB2  GLN  30           1HB      GLN  30  -5.739   9.669   6.908
  192    HB3  GLN  30           2HB      GLN  30  -5.410   7.943   6.970
  193    HG2  GLN  30           1HG      GLN  30  -4.951   8.820   9.116
  194    HG3  GLN  30           2HG      GLN  30  -3.399   8.464   8.360
  195   HE21  GLN  30          1HE2      GLN  30  -2.306  10.302   7.308
  196   HE22  GLN  30          2HE2      GLN  30  -2.440  11.860   8.044
  197    H    HIS  31           H        HIS  31  -3.407   6.828   4.765
  198    HA   HIS  31           HA       HIS  31  -1.147   6.304   6.505
  199    HB2  HIS  31           1HB      HIS  31  -2.269   4.324   6.174
  200    HB3  HIS  31           2HB      HIS  31  -2.726   4.733   4.523
  201    HD1  HIS  31           HD1      HIS  31   0.225   3.470   6.512
  202    HD2  HIS  31           HD2      HIS  31  -1.066   3.743   2.573
  203    HE1  HIS  31           HE1      HIS  31   1.869   2.121   5.171
  204    H    GLN  32           H        GLN  32  -1.753   6.922   3.075
  205    HA   GLN  32           HA       GLN  32   0.843   6.530   2.122
  206    HB2  GLN  32           1HB      GLN  32  -1.530   8.074   1.186
  207    HB3  GLN  32           2HB      GLN  32   0.018   8.383   0.411
  208    HG2  GLN  32           1HG      GLN  32   0.136   5.829   0.120
  209    HG3  GLN  32           2HG      GLN  32  -1.594   5.866   0.458
  210   HE21  GLN  32          1HE2      GLN  32  -1.687   4.956  -1.729
  211   HE22  GLN  32          2HE2      GLN  32  -1.714   6.042  -3.073
  212    H    ARG  33           H        ARG  33  -0.378   8.945   4.173
  213    HA   ARG  33           HA       ARG  33   1.238  11.138   3.476
  214    HB2  ARG  33           1HB      ARG  33   0.397  10.521   6.298
  215    HB3  ARG  33           2HB      ARG  33   0.604  12.092   5.536
  216    HG2  ARG  33           1HG      ARG  33  -1.634  10.130   5.207
  217    HG3  ARG  33           2HG      ARG  33  -1.704  11.819   5.713
  218    HD2  ARG  33           1HD      ARG  33  -0.854  10.918   2.967
  219    HD3  ARG  33           2HD      ARG  33  -2.503  11.383   3.380
  220    HE   ARG  33           HE       ARG  33  -1.123  13.535   4.162
  221   HH11  ARG  33          1HH1      ARG  33  -1.023  11.678   1.219
  222   HH12  ARG  33          2HH1      ARG  33  -0.565  13.025   0.231
  223   HH21  ARG  33          1HH2      ARG  33  -0.521  15.317   2.871
  224   HH22  ARG  33          2HH2      ARG  33  -0.280  15.094   1.172
  225    H    ILE  34           H        ILE  34   2.070   8.135   4.760
  226    HA   ILE  34           HA       ILE  34   4.372   9.037   6.261
  227    HB   ILE  34           HB       ILE  34   4.776   6.785   6.805
  228   HG12  ILE  34          1HG1      ILE  34   2.975   6.041   4.490
  229   HG13  ILE  34          2HG1      ILE  34   4.723   5.845   4.553
  230   HG21  ILE  34          1HG2      ILE  34   2.152   5.987   6.963
  231   HG22  ILE  34          2HG2      ILE  34   2.993   7.006   8.130
  232   HG23  ILE  34          3HG2      ILE  34   2.027   7.743   6.852
  233   HD11  ILE  34          3HD1      ILE  34   3.940   3.722   4.995
  234   HD12  ILE  34          1HD1      ILE  34   4.248   4.364   6.608
  235   HD13  ILE  34          2HD1      ILE  34   2.600   4.309   5.980
  236    H    HIS  35           H        HIS  35   3.648   7.952   3.045
  237    HA   HIS  35           HA       HIS  35   6.436   7.499   2.374
  238    HB2  HIS  35           1HB      HIS  35   4.025   7.513   0.549
  239    HB3  HIS  35           2HB      HIS  35   5.622   6.870   0.179
  240    HD1  HIS  35           HD1      HIS  35   6.327   4.907   2.116
  241    HD2  HIS  35           HD2      HIS  35   2.322   5.535   1.208
  242    HE1  HIS  35           HE1      HIS  35   5.137   2.814   2.841
  243    H    THR  36           H        THR  36   5.006  10.196   3.056
  244    HA   THR  36           HA       THR  36   6.611  11.764   1.245
  245    HB   THR  36           HB       THR  36   4.523  11.442  -0.061
  246    HG1  THR  36           HG1      THR  36   5.033  13.365  -0.758
  247   HG21  THR  36          3HG2      THR  36   2.960  13.269   1.616
  248   HG22  THR  36          1HG2      THR  36   3.232  11.683   2.337
  249   HG23  THR  36          2HG2      THR  36   2.460  11.813   0.756
  250    H    GLY  37           H        GLY  37   7.286  13.611   2.191
  251    HA2  GLY  37           1HA      GLY  37   5.815  14.571   4.557
  252    HA3  GLY  37           2HA      GLY  37   7.545  14.278   4.654
  253    H    GLU  38           H        GLU  38   8.227  16.338   5.031
  254    HA   GLU  38           HA       GLU  38   7.684  18.291   2.891
  255    HB2  GLU  38           1HB      GLU  38   8.217  18.931   5.796
  256    HB3  GLU  38           2HB      GLU  38   7.818  20.076   4.523
  257    HG2  GLU  38           1HG      GLU  38   5.906  17.874   5.069
  258    HG3  GLU  38           2HG      GLU  38   6.012  19.197   6.229
  259    H    LYS  39           H        LYS  39   9.923  16.262   3.712
  260    HA   LYS  39           HA       LYS  39  12.140  18.161   3.307
  261    HB2  LYS  39           1HB      LYS  39  11.901  16.837   5.579
  262    HB3  LYS  39           2HB      LYS  39  12.602  15.526   4.640
  263    HG2  LYS  39           1HG      LYS  39  13.904  18.214   4.672
  264    HG3  LYS  39           2HG      LYS  39  14.147  17.084   6.005
  265    HD2  LYS  39           1HD      LYS  39  14.527  16.157   3.190
  266    HD3  LYS  39           2HD      LYS  39  15.796  17.097   3.979
  267    HE2  LYS  39           1HE      LYS  39  15.469  15.379   5.915
  268    HE3  LYS  39           2HE      LYS  39  14.739  14.384   4.656
  269    HZ1  LYS  39           3HZ      LYS  39  17.112  15.393   3.624
  270    HZ2  LYS  39           1HZ      LYS  39  16.768  13.792   4.048
  271    HZ3  LYS  39           2HZ      LYS  39  17.469  14.834   5.181
  272    HA   PRO  40           HA       PRO  40  12.815  15.866  -0.416
  273    HB2  PRO  40           1HB      PRO  40  15.245  16.911  -1.026
  274    HB3  PRO  40           2HB      PRO  40  13.734  17.801  -1.248
  275    HG2  PRO  40           1HG      PRO  40  15.722  17.972   0.983
  276    HG3  PRO  40           2HG      PRO  40  14.875  19.280   0.137
  277    HD2  PRO  40           1HD      PRO  40  14.095  18.371   2.565
  278    HD3  PRO  40           2HD      PRO  40  12.945  18.994   1.365
  279    H    SER  41           H        SER  41  13.680  13.923  -0.858
  280    HA   SER  41           HA       SER  41  15.680  12.864   1.006
  281    HB2  SER  41           1HB      SER  41  13.601  11.577   0.811
  282    HB3  SER  41           2HB      SER  41  13.852  11.416  -0.927
  283    HG   SER  41           HG       SER  41  14.743   9.829   0.962
  284    H    GLY  42           H        GLY  42  14.992  13.201  -2.450
  285    HA2  GLY  42           1HA      GLY  42  17.393  13.816  -3.437
  286    HA3  GLY  42           2HA      GLY  42  17.590  12.093  -3.155
  287    HA   PRO  43           HA       PRO  43  15.897  11.288  -7.118
  288    HB2  PRO  43           1HB      PRO  43  14.826   8.826  -6.714
  289    HB3  PRO  43           2HB      PRO  43  16.567   9.111  -6.821
  290    HG2  PRO  43           1HG      PRO  43  14.848   8.775  -4.393
  291    HG3  PRO  43           2HG      PRO  43  16.450   8.094  -4.733
  292    HD2  PRO  43           1HD      PRO  43  16.094  10.266  -3.154
  293    HD3  PRO  43           2HD      PRO  43  17.538  10.045  -4.163
  294    H    SER  44           H        SER  44  13.811  10.474  -8.177
  295    HA   SER  44           HA       SER  44  11.648  11.054  -8.651
  296    HB2  SER  44           1HB      SER  44  10.013  10.157  -7.066
  297    HB3  SER  44           2HB      SER  44  11.358   9.033  -7.259
  298    HG   SER  44           HG       SER  44  11.368  10.947  -5.191
  299    H    SER  45           H        SER  45  13.086  13.286  -7.921
  300    HA   SER  45           HA       SER  45  12.907  15.425  -7.157
  301    HB2  SER  45           1HB      SER  45  10.779  15.021  -8.640
  302    HB3  SER  45           2HB      SER  45   9.924  15.123  -7.101
  303    HG   SER  45           HG       SER  45  11.319  17.155  -6.899
  304    H    GLY  46           H        GLY  46  13.248  13.485  -5.136
  305    HA2  GLY  46           1HA      GLY  46  12.964  13.122  -2.874
  306    HA3  GLY  46           2HA      GLY  46  12.951  14.879  -2.819
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1  14.583  -9.654  -2.468
    2    HA2  GLY   1           1HA      GLY   1  13.398 -11.787  -2.642
    3    HA3  GLY   1           2HA      GLY   1  12.461 -10.687  -1.641
    4    H    SER   2           H        SER   2  12.200 -12.843  -4.063
    5    HA   SER   2           HA       SER   2  10.584 -11.627  -5.990
    6    HB2  SER   2           1HB      SER   2   9.899 -13.853  -6.617
    7    HB3  SER   2           2HB      SER   2  11.599 -13.918  -6.151
    8    HG   SER   2           HG       SER   2  10.731 -15.569  -5.057
    9    H    SER   3           H        SER   3   9.716 -13.228  -2.949
   10    HA   SER   3           HA       SER   3   6.933 -13.072  -3.223
   11    HB2  SER   3           1HB      SER   3   8.498 -12.939  -0.636
   12    HB3  SER   3           2HB      SER   3   6.827 -13.465  -0.836
   13    HG   SER   3           HG       SER   3   7.943 -15.323  -0.819
   14    H    GLY   4           H        GLY   4   5.486 -11.702  -1.836
   15    HA2  GLY   4           1HA      GLY   4   6.423  -9.118  -1.016
   16    HA3  GLY   4           2HA      GLY   4   5.555  -9.058  -2.543
   17    H    SER   5           H        SER   5   3.472  -8.607  -2.378
   18    HA   SER   5           HA       SER   5   2.149  -8.921   0.202
   19    HB2  SER   5           1HB      SER   5   0.457  -7.441  -0.651
   20    HB3  SER   5           2HB      SER   5   2.025  -6.765  -1.095
   21    HG   SER   5           HG       SER   5   0.050  -7.902  -2.700
   22    H    SER   6           H        SER   6  -0.316  -9.457  -0.058
   23    HA   SER   6           HA       SER   6  -0.418 -12.130  -1.145
   24    HB2  SER   6           1HB      SER   6  -1.455 -11.245   1.085
   25    HB3  SER   6           2HB      SER   6  -2.787 -10.728   0.052
   26    HG   SER   6           HG       SER   6  -2.705 -13.008  -0.735
   27    H    GLY   7           H        GLY   7  -0.325 -11.793  -3.388
   28    HA2  GLY   7           1HA      GLY   7  -1.249 -11.573  -5.479
   29    HA3  GLY   7           2HA      GLY   7  -2.816 -11.565  -4.684
   30    H    SER   8           H        SER   8  -3.625 -10.003  -6.111
   31    HA   SER   8           HA       SER   8  -2.464  -7.314  -5.790
   32    HB2  SER   8           1HB      SER   8  -2.527  -8.371  -8.128
   33    HB3  SER   8           2HB      SER   8  -4.274  -8.145  -8.055
   34    HG   SER   8           HG       SER   8  -3.473  -6.329  -8.997
   35    H    SER   9           H        SER   9  -4.113  -5.531  -6.034
   36    HA   SER   9           HA       SER   9  -5.786  -4.460  -4.867
   37    HB2  SER   9           1HB      SER   9  -8.037  -5.166  -5.655
   38    HB3  SER   9           2HB      SER   9  -6.874  -5.013  -6.971
   39    HG   SER   9           HG       SER   9  -7.344  -7.000  -7.424
   40    H    THR  10           H        THR  10  -4.506  -6.259  -3.177
   41    HA   THR  10           HA       THR  10  -5.787  -8.201  -1.843
   42    HB   THR  10           HB       THR  10  -4.460  -5.880  -0.430
   43    HG1  THR  10           HG1      THR  10  -2.561  -6.872  -0.867
   44   HG21  THR  10          3HG2      THR  10  -4.073  -7.363   1.374
   45   HG22  THR  10          1HG2      THR  10  -4.582  -8.764   0.432
   46   HG23  THR  10          2HG2      THR  10  -5.771  -7.566   0.945
   47    H    LYS  11           H        LYS  11  -6.356  -4.736  -1.236
   48    HA   LYS  11           HA       LYS  11  -9.017  -5.451  -0.202
   49    HB2  LYS  11           1HB      LYS  11  -7.169  -4.696   1.507
   50    HB3  LYS  11           2HB      LYS  11  -7.542  -3.089   0.897
   51    HG2  LYS  11           1HG      LYS  11  -9.802  -3.252   1.618
   52    HG3  LYS  11           2HG      LYS  11  -9.619  -4.966   1.996
   53    HD2  LYS  11           1HD      LYS  11  -7.882  -2.936   3.344
   54    HD3  LYS  11           2HD      LYS  11  -9.531  -3.206   3.911
   55    HE2  LYS  11           1HE      LYS  11  -9.032  -5.589   4.199
   56    HE3  LYS  11           2HE      LYS  11  -7.383  -5.308   3.643
   57    HZ1  LYS  11           3HZ      LYS  11  -8.196  -3.603   5.819
   58    HZ2  LYS  11           1HZ      LYS  11  -6.777  -4.502   5.620
   59    HZ3  LYS  11           2HZ      LYS  11  -8.173  -5.247   6.216
   60    H    SER  12           H        SER  12 -10.531  -3.555  -0.208
   61    HA   SER  12           HA       SER  12 -11.150  -2.615  -2.624
   62    HB2  SER  12           1HB      SER  12 -11.880  -0.413  -1.294
   63    HB3  SER  12           2HB      SER  12 -12.721  -1.949  -1.094
   64    HG   SER  12           HG       SER  12 -10.840  -0.720   0.606
   65    H    HIS  13           H        HIS  13  -8.928  -0.924  -0.421
   66    HA   HIS  13           HA       HIS  13  -7.763   0.414  -2.767
   67    HB2  HIS  13           1HB      HIS  13  -8.017   1.769  -0.087
   68    HB3  HIS  13           2HB      HIS  13  -7.615   2.493  -1.641
   69    HD1  HIS  13           HD1      HIS  13  -9.659   2.538  -3.418
   70    HD2  HIS  13           HD2      HIS  13 -10.660   1.868   0.558
   71    HE1  HIS  13           HE1      HIS  13 -12.124   3.011  -3.256
   72    H    GLN  14           H        GLN  14  -5.748  -0.278  -2.989
   73    HA   GLN  14           HA       GLN  14  -4.196  -0.907  -0.568
   74    HB2  GLN  14           1HB      GLN  14  -4.527  -2.822  -2.053
   75    HB3  GLN  14           2HB      GLN  14  -3.843  -1.916  -3.396
   76    HG2  GLN  14           1HG      GLN  14  -1.797  -1.714  -1.726
   77    HG3  GLN  14           2HG      GLN  14  -2.502  -3.198  -1.087
   78   HE21  GLN  14          1HE2      GLN  14  -0.159  -3.660  -1.953
   79   HE22  GLN  14          2HE2      GLN  14  -0.114  -4.352  -3.536
   80    H    CYS  15           H        CYS  15  -2.091  -0.150  -0.354
   81    HA   CYS  15           HA       CYS  15  -1.574   2.377  -1.585
   82    HB2  CYS  15           1HB      CYS  15  -0.954   1.772   0.774
   83    HB3  CYS  15           2HB      CYS  15   0.305   0.731   0.118
   84    H    HIS  16           H        HIS  16   0.503   2.908  -2.640
   85    HA   HIS  16           HA       HIS  16   1.327   0.734  -4.449
   86    HB2  HIS  16           1HB      HIS  16   1.233   3.723  -4.891
   87    HB3  HIS  16           2HB      HIS  16   1.985   2.592  -6.013
   88    HD1  HIS  16           HD1      HIS  16   0.276   3.247  -7.854
   89    HD2  HIS  16           HD2      HIS  16  -1.424   1.569  -4.454
   90    HE1  HIS  16           HE1      HIS  16  -2.087   2.674  -8.496
   91    H    GLU  17           H        GLU  17   2.373   3.004  -2.094
   92    HA   GLU  17           HA       GLU  17   5.140   3.028  -2.836
   93    HB2  GLU  17           1HB      GLU  17   4.037   3.688  -0.111
   94    HB3  GLU  17           2HB      GLU  17   5.507   4.292  -0.862
   95    HG2  GLU  17           1HG      GLU  17   2.716   4.907  -1.802
   96    HG3  GLU  17           2HG      GLU  17   3.699   5.959  -0.786
   97    H    CYS  18           H        CYS  18   3.209   1.332  -0.395
   98    HA   CYS  18           HA       CYS  18   5.502  -0.462   0.062
   99    HB2  CYS  18           1HB      CYS  18   4.555  -0.921   2.279
  100    HB3  CYS  18           2HB      CYS  18   4.875   0.797   2.069
  101    H    GLY  19           H        GLY  19   2.012  -0.269  -0.414
  102    HA2  GLY  19           1HA      GLY  19   0.902  -1.883  -1.810
  103    HA3  GLY  19           2HA      GLY  19   2.067  -3.085  -1.274
  104    H    ARG  20           H        ARG  20   0.625  -0.915   1.021
  105    HA   ARG  20           HA       ARG  20  -0.476  -3.124   2.488
  106    HB2  ARG  20           1HB      ARG  20  -0.157  -0.200   2.924
  107    HB3  ARG  20           2HB      ARG  20  -1.424  -1.015   3.832
  108    HG2  ARG  20           1HG      ARG  20   0.470  -2.700   4.428
  109    HG3  ARG  20           2HG      ARG  20   1.532  -1.367   3.972
  110    HD2  ARG  20           1HD      ARG  20   0.653   0.039   5.649
  111    HD3  ARG  20           2HD      ARG  20  -0.727  -1.024   5.924
  112    HE   ARG  20           HE       ARG  20   1.712  -2.365   6.471
  113   HH11  ARG  20          1HH1      ARG  20  -0.486   0.005   7.763
  114   HH12  ARG  20          2HH1      ARG  20  -0.062  -0.310   9.413
  115   HH21  ARG  20          1HH2      ARG  20   2.278  -2.790   8.639
  116   HH22  ARG  20          2HH2      ARG  20   1.511  -1.900   9.910
  117    H    GLY  21           H        GLY  21  -2.777  -2.771   3.450
  118    HA2  GLY  21           1HA      GLY  21  -4.600  -1.931   1.285
  119    HA3  GLY  21           2HA      GLY  21  -4.812  -3.470   2.106
  120    H    PHE  22           H        PHE  22  -6.560  -1.062   1.882
  121    HA   PHE  22           HA       PHE  22  -7.199  -0.880   4.723
  122    HB2  PHE  22           1HB      PHE  22  -6.919   1.560   2.956
  123    HB3  PHE  22           2HB      PHE  22  -7.482   1.555   4.624
  124    HD1  PHE  22           HD2      PHE  22  -4.568   1.080   2.436
  125    HD2  PHE  22           HD1      PHE  22  -5.955   1.410   6.446
  126    HE1  PHE  22           HE2      PHE  22  -2.249   1.342   3.213
  127    HE2  PHE  22           HE1      PHE  22  -3.638   1.674   7.230
  128    HZ   PHE  22           HZ       PHE  22  -1.781   1.639   5.612
  129    H    THR  23           H        THR  23  -9.289  -1.253   5.018
  130    HA   THR  23           HA       THR  23 -11.095  -1.792   2.986
  131    HB   THR  23           HB       THR  23 -12.881  -1.483   4.756
  132    HG1  THR  23           HG1      THR  23 -10.649  -0.452   6.075
  133   HG21  THR  23          3HG2      THR  23 -12.281  -3.462   5.931
  134   HG22  THR  23          1HG2      THR  23 -10.561  -3.174   5.675
  135   HG23  THR  23          2HG2      THR  23 -11.593  -3.613   4.314
  136    H    LEU  24           H        LEU  24 -10.932   1.141   5.008
  137    HA   LEU  24           HA       LEU  24 -12.811   2.502   3.269
  138    HB2  LEU  24           1HB      LEU  24 -11.340   3.362   5.751
  139    HB3  LEU  24           2HB      LEU  24 -12.438   4.408   4.853
  140    HG   LEU  24           HG       LEU  24 -14.183   2.544   5.284
  141   HD11  LEU  24          1HD1      LEU  24 -13.135   0.753   6.209
  142   HD12  LEU  24          2HD1      LEU  24 -13.551   1.619   7.688
  143   HD13  LEU  24          3HD1      LEU  24 -11.921   1.740   7.025
  144   HD21  LEU  24          3HD2      LEU  24 -14.504   3.510   7.662
  145   HD22  LEU  24          1HD2      LEU  24 -14.600   4.597   6.276
  146   HD23  LEU  24          2HD2      LEU  24 -13.132   4.539   7.252
  147    H    LYS  25           H        LYS  25 -12.352   4.141   1.872
  148    HA   LYS  25           HA       LYS  25  -9.781   4.259   0.725
  149    HB2  LYS  25           1HB      LYS  25 -11.831   4.760  -0.531
  150    HB3  LYS  25           2HB      LYS  25 -12.088   6.196   0.451
  151    HG2  LYS  25           1HG      LYS  25 -11.161   7.006  -1.523
  152    HG3  LYS  25           2HG      LYS  25  -9.804   6.965  -0.396
  153    HD2  LYS  25           1HD      LYS  25  -9.058   4.850  -1.350
  154    HD3  LYS  25           2HD      LYS  25 -10.439   4.844  -2.449
  155    HE2  LYS  25           1HE      LYS  25  -8.507   7.135  -2.409
  156    HE3  LYS  25           2HE      LYS  25  -8.152   5.669  -3.321
  157    HZ1  LYS  25           3HZ      LYS  25  -9.602   6.228  -4.898
  158    HZ2  LYS  25           1HZ      LYS  25  -9.589   7.781  -4.226
  159    HZ3  LYS  25           2HZ      LYS  25 -10.797   6.680  -3.789
  160    H    SER  26           H        SER  26 -11.397   6.233   3.132
  161    HA   SER  26           HA       SER  26  -9.609   8.409   3.128
  162    HB2  SER  26           1HB      SER  26 -10.544   8.941   5.335
  163    HB3  SER  26           2HB      SER  26 -11.823   8.497   4.205
  164    HG   SER  26           HG       SER  26 -10.653   6.812   6.169
  165    H    HIS  27           H        HIS  27  -9.601   5.338   4.859
  166    HA   HIS  27           HA       HIS  27  -7.564   5.810   6.681
  167    HB2  HIS  27           1HB      HIS  27  -8.527   3.340   5.277
  168    HB3  HIS  27           2HB      HIS  27  -7.112   3.264   6.323
  169    HD1  HIS  27           HD1      HIS  27  -9.985   1.914   6.817
  170    HD2  HIS  27           HD2      HIS  27  -8.473   5.323   8.647
  171    HE1  HIS  27           HE1      HIS  27 -11.239   2.124   8.986
  172    H    LEU  28           H        LEU  28  -7.175   4.141   3.549
  173    HA   LEU  28           HA       LEU  28  -4.440   4.006   3.467
  174    HB2  LEU  28           1HB      LEU  28  -5.668   2.908   1.784
  175    HB3  LEU  28           2HB      LEU  28  -6.454   4.401   1.275
  176    HG   LEU  28           HG       LEU  28  -4.205   5.182   0.458
  177   HD11  LEU  28          1HD1      LEU  28  -2.491   3.988   1.282
  178   HD12  LEU  28          2HD1      LEU  28  -2.837   2.908  -0.068
  179   HD13  LEU  28          3HD1      LEU  28  -3.477   2.548   1.535
  180   HD21  LEU  28          3HD2      LEU  28  -4.966   4.540  -1.525
  181   HD22  LEU  28          1HD2      LEU  28  -6.097   3.461  -0.709
  182   HD23  LEU  28          2HD2      LEU  28  -4.511   2.867  -1.200
  183    H    ASN  29           H        ASN  29  -6.367   6.596   1.941
  184    HA   ASN  29           HA       ASN  29  -4.518   8.279   1.003
  185    HB2  ASN  29           1HB      ASN  29  -6.989   8.715   1.121
  186    HB3  ASN  29           2HB      ASN  29  -6.760   9.256   2.781
  187   HD21  ASN  29          1HD2      ASN  29  -7.868  10.950   1.010
  188   HD22  ASN  29          2HD2      ASN  29  -6.766  12.219   0.611
  189    H    GLN  30           H        GLN  30  -5.537   8.358   4.422
  190    HA   GLN  30           HA       GLN  30  -3.597  10.209   5.256
  191    HB2  GLN  30           1HB      GLN  30  -5.588   9.705   6.581
  192    HB3  GLN  30           2HB      GLN  30  -5.011   8.066   6.852
  193    HG2  GLN  30           1HG      GLN  30  -3.347   8.751   8.305
  194    HG3  GLN  30           2HG      GLN  30  -3.356  10.404   7.695
  195   HE21  GLN  30          1HE2      GLN  30  -3.389  10.134  10.328
  196   HE22  GLN  30          2HE2      GLN  30  -4.949  10.484  10.984
  197    H    HIS  31           H        HIS  31  -3.552   6.695   5.041
  198    HA   HIS  31           HA       HIS  31  -1.164   6.241   6.450
  199    HB2  HIS  31           1HB      HIS  31  -2.317   4.281   6.095
  200    HB3  HIS  31           2HB      HIS  31  -2.765   4.716   4.449
  201    HD1  HIS  31           HD1      HIS  31  -0.060   3.095   6.440
  202    HD2  HIS  31           HD2      HIS  31  -0.887   4.028   2.477
  203    HE1  HIS  31           HE1      HIS  31   1.628   1.818   5.083
  204    H    GLN  32           H        GLN  32  -1.764   6.775   2.992
  205    HA   GLN  32           HA       GLN  32   0.751   6.381   1.967
  206    HB2  GLN  32           1HB      GLN  32  -1.398   8.352   1.227
  207    HB3  GLN  32           2HB      GLN  32   0.107   8.255   0.323
  208    HG2  GLN  32           1HG      GLN  32  -0.368   5.839  -0.066
  209    HG3  GLN  32           2HG      GLN  32  -1.947   6.088   0.677
  210   HE21  GLN  32          1HE2      GLN  32  -2.353   5.182  -1.611
  211   HE22  GLN  32          2HE2      GLN  32  -2.672   6.367  -2.827
  212    H    ARG  33           H        ARG  33  -0.251   8.796   4.167
  213    HA   ARG  33           HA       ARG  33   1.516  10.882   3.598
  214    HB2  ARG  33           1HB      ARG  33   0.446   9.950   6.268
  215    HB3  ARG  33           2HB      ARG  33   1.260  11.485   5.998
  216    HG2  ARG  33           1HG      ARG  33  -0.501  12.213   4.524
  217    HG3  ARG  33           2HG      ARG  33  -1.290  10.639   4.641
  218    HD2  ARG  33           1HD      ARG  33  -2.506  11.824   6.178
  219    HD3  ARG  33           2HD      ARG  33  -1.239  11.167   7.214
  220    HE   ARG  33           HE       ARG  33  -0.403  13.291   7.501
  221   HH11  ARG  33          1HH1      ARG  33  -2.768  13.289   4.945
  222   HH12  ARG  33          2HH1      ARG  33  -2.842  15.017   4.836
  223   HH21  ARG  33          1HH2      ARG  33  -0.493  15.567   7.366
  224   HH22  ARG  33          2HH2      ARG  33  -1.547  16.311   6.213
  225    H    ILE  34           H        ILE  34   2.013   7.837   5.249
  226    HA   ILE  34           HA       ILE  34   4.470   8.413   6.486
  227    HB   ILE  34           HB       ILE  34   4.769   6.074   6.760
  228   HG12  ILE  34          1HG1      ILE  34   2.697   5.674   4.591
  229   HG13  ILE  34          2HG1      ILE  34   4.430   5.436   4.397
  230   HG21  ILE  34          1HG2      ILE  34   2.054   7.178   7.029
  231   HG22  ILE  34          2HG2      ILE  34   2.181   5.423   7.145
  232   HG23  ILE  34          3HG2      ILE  34   3.110   6.448   8.239
  233   HD11  ILE  34          3HD1      ILE  34   2.484   3.817   5.993
  234   HD12  ILE  34          1HD1      ILE  34   3.567   3.297   4.702
  235   HD13  ILE  34          2HD1      ILE  34   4.222   3.730   6.281
  236    H    HIS  35           H        HIS  35   3.706   8.256   3.229
  237    HA   HIS  35           HA       HIS  35   6.492   7.642   2.492
  238    HB2  HIS  35           1HB      HIS  35   4.065   7.550   0.691
  239    HB3  HIS  35           2HB      HIS  35   5.692   6.998   0.306
  240    HD1  HIS  35           HD1      HIS  35   6.515   5.012   2.136
  241    HD2  HIS  35           HD2      HIS  35   2.458   5.505   1.390
  242    HE1  HIS  35           HE1      HIS  35   5.434   2.855   2.844
  243    H    THR  36           H        THR  36   3.901   9.958   2.281
  244    HA   THR  36           HA       THR  36   4.828  11.619   0.251
  245    HB   THR  36           HB       THR  36   3.577  13.441   1.369
  246    HG1  THR  36           HG1      THR  36   4.133  12.248   3.552
  247   HG21  THR  36          3HG2      THR  36   2.313  10.733   1.079
  248   HG22  THR  36          1HG2      THR  36   2.228  12.116  -0.012
  249   HG23  THR  36          2HG2      THR  36   1.358  12.148   1.522
  250    H    GLY  37           H        GLY  37   6.563  12.876   0.048
  251    HA2  GLY  37           1HA      GLY  37   7.641  14.618   1.868
  252    HA3  GLY  37           2HA      GLY  37   8.463  13.098   2.184
  253    H    GLU  38           H        GLU  38  10.387  14.343   1.578
  254    HA   GLU  38           HA       GLU  38  11.112  13.814  -1.131
  255    HB2  GLU  38           1HB      GLU  38   9.918  15.895  -1.526
  256    HB3  GLU  38           2HB      GLU  38  10.847  16.698  -0.267
  257    HG2  GLU  38           1HG      GLU  38  11.865  17.412  -2.214
  258    HG3  GLU  38           2HG      GLU  38  12.902  16.089  -1.683
  259    H    LYS  39           H        LYS  39  13.124  13.106  -0.978
  260    HA   LYS  39           HA       LYS  39  14.743  13.155   1.224
  261    HB2  LYS  39           1HB      LYS  39  15.190  11.716  -0.683
  262    HB3  LYS  39           2HB      LYS  39  15.581  13.111  -1.681
  263    HG2  LYS  39           1HG      LYS  39  17.442  13.584  -0.013
  264    HG3  LYS  39           2HG      LYS  39  17.144  11.958   0.605
  265    HD2  LYS  39           1HD      LYS  39  17.416  11.179  -1.813
  266    HD3  LYS  39           2HD      LYS  39  18.088  12.780  -2.128
  267    HE2  LYS  39           1HE      LYS  39  19.977  11.518  -1.677
  268    HE3  LYS  39           2HE      LYS  39  19.631  12.261  -0.116
  269    HZ1  LYS  39           3HZ      LYS  39  18.350  10.138   0.369
  270    HZ2  LYS  39           1HZ      LYS  39  20.039  10.029   0.357
  271    HZ3  LYS  39           2HZ      LYS  39  19.146   9.472  -0.967
  272    HA   PRO  40           HA       PRO  40  16.097  17.344   1.611
  273    HB2  PRO  40           1HB      PRO  40  18.126  16.905   3.361
  274    HB3  PRO  40           2HB      PRO  40  16.423  16.863   3.834
  275    HG2  PRO  40           1HG      PRO  40  18.272  14.593   3.207
  276    HG3  PRO  40           2HG      PRO  40  17.086  14.741   4.517
  277    HD2  PRO  40           1HD      PRO  40  16.594  13.328   2.261
  278    HD3  PRO  40           2HD      PRO  40  15.317  14.182   3.150
  279    H    SER  41           H        SER  41  17.344  18.505   0.295
  280    HA   SER  41           HA       SER  41  19.316  17.322  -1.362
  281    HB2  SER  41           1HB      SER  41  19.735  19.632  -2.143
  282    HB3  SER  41           2HB      SER  41  18.013  19.251  -2.110
  283    HG   SER  41           HG       SER  41  18.859  21.339  -1.134
  284    H    GLY  42           H        GLY  42  19.664  19.884   1.105
  285    HA2  GLY  42           1HA      GLY  42  22.350  20.163   1.235
  286    HA3  GLY  42           2HA      GLY  42  21.339  20.192   2.672
  287    HA   PRO  43           HA       PRO  43  23.946  16.120   2.128
  288    HB2  PRO  43           1HB      PRO  43  26.537  16.879   2.417
  289    HB3  PRO  43           2HB      PRO  43  25.752  16.721   0.841
  290    HG2  PRO  43           1HG      PRO  43  26.258  19.183   2.467
  291    HG3  PRO  43           2HG      PRO  43  26.457  18.934   0.723
  292    HD2  PRO  43           1HD      PRO  43  24.302  20.188   1.779
  293    HD3  PRO  43           2HD      PRO  43  24.209  19.211   0.299
  294    H    SER  44           H        SER  44  25.827  15.421   3.798
  295    HA   SER  44           HA       SER  44  25.866  16.820   6.283
  296    HB2  SER  44           1HB      SER  44  23.526  15.616   6.057
  297    HB3  SER  44           2HB      SER  44  24.456  14.192   6.523
  298    HG   SER  44           HG       SER  44  23.446  15.666   8.217
  299    H    SER  45           H        SER  45  27.744  16.340   7.198
  300    HA   SER  45           HA       SER  45  29.480  14.376   6.186
  301    HB2  SER  45           1HB      SER  45  30.876  14.909   8.202
  302    HB3  SER  45           2HB      SER  45  30.381  16.329   7.282
  303    HG   SER  45           HG       SER  45  28.934  16.847   8.837
  304    H    GLY  46           H        GLY  46  27.719  14.489   9.287
  305    HA2  GLY  46           1HA      GLY  46  27.126  12.820  10.749
  306    HA3  GLY  46           2HA      GLY  46  26.920  11.833   9.310
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1   9.188 -10.434   3.425
    2    HA2  GLY   1           1HA      GLY   1  11.041 -12.070   2.185
    3    HA3  GLY   1           2HA      GLY   1  10.450 -12.984   3.565
    4    H    SER   2           H        SER   2   9.399 -14.551   2.384
    5    HA   SER   2           HA       SER   2   7.615 -13.963   0.249
    6    HB2  SER   2           1HB      SER   2   6.904 -16.362   0.551
    7    HB3  SER   2           2HB      SER   2   8.637 -16.136   0.316
    8    HG   SER   2           HG       SER   2   8.386 -17.518   2.027
    9    H    SER   3           H        SER   3   6.239 -12.352   1.143
   10    HA   SER   3           HA       SER   3   3.823 -13.386   2.222
   11    HB2  SER   3           1HB      SER   3   5.517 -13.098   4.225
   12    HB3  SER   3           2HB      SER   3   5.067 -11.398   4.083
   13    HG   SER   3           HG       SER   3   3.641 -12.321   5.496
   14    H    GLY   4           H        GLY   4   2.173 -12.116   1.611
   15    HA2  GLY   4           1HA      GLY   4   2.848  -9.537   0.391
   16    HA3  GLY   4           2HA      GLY   4   1.374 -10.455   0.118
   17    H    SER   5           H        SER   5  -0.196  -9.059   0.665
   18    HA   SER   5           HA       SER   5   0.046  -7.559   3.168
   19    HB2  SER   5           1HB      SER   5  -0.713  -6.609   0.819
   20    HB3  SER   5           2HB      SER   5  -2.283  -7.238   1.319
   21    HG   SER   5           HG       SER   5  -2.399  -5.774   2.867
   22    H    SER   6           H        SER   6  -1.951  -7.363   4.509
   23    HA   SER   6           HA       SER   6  -3.752  -9.646   4.406
   24    HB2  SER   6           1HB      SER   6  -1.831 -10.445   5.742
   25    HB3  SER   6           2HB      SER   6  -2.044  -9.085   6.843
   26    HG   SER   6           HG       SER   6  -3.590 -10.137   7.790
   27    H    GLY   7           H        GLY   7  -5.665  -9.365   5.609
   28    HA2  GLY   7           1HA      GLY   7  -6.014  -6.732   6.878
   29    HA3  GLY   7           2HA      GLY   7  -7.123  -7.237   5.612
   30    H    SER   8           H        SER   8  -8.910  -7.157   6.989
   31    HA   SER   8           HA       SER   8  -8.959  -9.236   9.077
   32    HB2  SER   8           1HB      SER   8 -10.276  -6.536   8.933
   33    HB3  SER   8           2HB      SER   8 -10.940  -7.808   9.959
   34    HG   SER   8           HG       SER   8  -8.664  -6.292  10.272
   35    H    SER   9           H        SER   9 -10.880  -7.608   6.582
   36    HA   SER   9           HA       SER   9 -12.438 -10.085   6.284
   37    HB2  SER   9           1HB      SER   9 -13.525  -7.260   6.277
   38    HB3  SER   9           2HB      SER   9 -14.449  -8.686   5.805
   39    HG   SER   9           HG       SER   9 -13.813  -9.480   7.998
   40    H    THR  10           H        THR  10 -12.354  -6.917   4.659
   41    HA   THR  10           HA       THR  10 -11.344  -8.193   2.232
   42    HB   THR  10           HB       THR  10 -13.088  -6.958   0.874
   43    HG1  THR  10           HG1      THR  10 -15.100  -6.776   2.355
   44   HG21  THR  10          3HG2      THR  10 -13.125  -9.418   1.358
   45   HG22  THR  10          1HG2      THR  10 -14.710  -8.711   1.053
   46   HG23  THR  10          2HG2      THR  10 -14.211  -9.078   2.704
   47    H    LYS  11           H        LYS  11 -10.905  -6.501   0.507
   48    HA   LYS  11           HA       LYS  11 -10.265  -3.877   1.644
   49    HB2  LYS  11           1HB      LYS  11  -8.206  -5.081   1.888
   50    HB3  LYS  11           2HB      LYS  11  -8.319  -5.720   0.253
   51    HG2  LYS  11           1HG      LYS  11  -8.300  -3.145  -0.359
   52    HG3  LYS  11           2HG      LYS  11  -7.468  -3.041   1.194
   53    HD2  LYS  11           1HD      LYS  11  -5.750  -3.311  -0.378
   54    HD3  LYS  11           2HD      LYS  11  -5.972  -4.921   0.312
   55    HE2  LYS  11           1HE      LYS  11  -5.763  -5.131  -2.068
   56    HE3  LYS  11           2HE      LYS  11  -7.432  -5.482  -1.619
   57    HZ1  LYS  11           3HZ      LYS  11  -6.773  -2.729  -2.352
   58    HZ2  LYS  11           1HZ      LYS  11  -8.194  -3.608  -2.617
   59    HZ3  LYS  11           2HZ      LYS  11  -6.841  -3.873  -3.597
   60    H    SER  12           H        SER  12 -10.322  -2.187   0.199
   61    HA   SER  12           HA       SER  12 -11.157  -2.870  -2.545
   62    HB2  SER  12           1HB      SER  12 -12.009  -0.443  -0.949
   63    HB3  SER  12           2HB      SER  12 -12.586  -0.909  -2.549
   64    HG   SER  12           HG       SER  12 -14.054  -1.983  -1.510
   65    H    HIS  13           H        HIS  13  -9.311  -0.700  -0.494
   66    HA   HIS  13           HA       HIS  13  -7.978   0.356  -2.901
   67    HB2  HIS  13           1HB      HIS  13  -7.969   1.786  -0.260
   68    HB3  HIS  13           2HB      HIS  13  -7.695   2.441  -1.871
   69    HD1  HIS  13           HD1      HIS  13  -9.759   3.092  -3.253
   70    HD2  HIS  13           HD2      HIS  13 -10.671   1.498   0.474
   71    HE1  HIS  13           HE1      HIS  13 -12.204   3.564  -2.900
   72    H    GLN  14           H        GLN  14  -5.821   0.130  -3.066
   73    HA   GLN  14           HA       GLN  14  -4.361  -0.870  -0.712
   74    HB2  GLN  14           1HB      GLN  14  -4.693  -2.737  -2.197
   75    HB3  GLN  14           2HB      GLN  14  -4.142  -1.798  -3.577
   76    HG2  GLN  14           1HG      GLN  14  -1.920  -1.606  -2.356
   77    HG3  GLN  14           2HG      GLN  14  -2.529  -2.872  -1.291
   78   HE21  GLN  14          1HE2      GLN  14  -0.286  -3.392  -2.631
   79   HE22  GLN  14          2HE2      GLN  14  -0.569  -4.513  -3.915
   80    H    CYS  15           H        CYS  15  -2.149  -0.306  -0.572
   81    HA   CYS  15           HA       CYS  15  -1.561   2.274  -1.729
   82    HB2  CYS  15           1HB      CYS  15  -1.063   1.656   0.664
   83    HB3  CYS  15           2HB      CYS  15   0.205   0.595   0.059
   84    H    HIS  16           H        HIS  16   0.588   2.721  -2.686
   85    HA   HIS  16           HA       HIS  16   1.452   0.484  -4.399
   86    HB2  HIS  16           1HB      HIS  16   0.286   2.608  -5.400
   87    HB3  HIS  16           2HB      HIS  16   1.867   3.350  -5.170
   88    HD1  HIS  16           HD1      HIS  16   2.262   3.563  -7.705
   89    HD2  HIS  16           HD2      HIS  16   1.682  -0.342  -6.412
   90    HE1  HIS  16           HE1      HIS  16   2.942   2.106  -9.639
   91    H    GLU  17           H        GLU  17   2.388   2.802  -2.073
   92    HA   GLU  17           HA       GLU  17   5.179   2.865  -2.742
   93    HB2  GLU  17           1HB      GLU  17   3.965   3.600  -0.083
   94    HB3  GLU  17           2HB      GLU  17   5.466   4.187  -0.786
   95    HG2  GLU  17           1HG      GLU  17   2.701   4.771  -1.823
   96    HG3  GLU  17           2HG      GLU  17   3.696   5.865  -0.864
   97    H    CYS  18           H        CYS  18   3.157   1.135  -0.421
   98    HA   CYS  18           HA       CYS  18   5.461  -0.605   0.173
   99    HB2  CYS  18           1HB      CYS  18   4.519  -0.975   2.405
  100    HB3  CYS  18           2HB      CYS  18   4.833   0.736   2.132
  101    H    GLY  19           H        GLY  19   2.013  -0.383  -0.447
  102    HA2  GLY  19           1HA      GLY  19   0.890  -2.043  -1.749
  103    HA3  GLY  19           2HA      GLY  19   2.035  -3.236  -1.153
  104    H    ARG  20           H        ARG  20   0.665  -1.003   1.098
  105    HA   ARG  20           HA       ARG  20  -0.486  -3.124   2.625
  106    HB2  ARG  20           1HB      ARG  20  -0.201  -0.177   2.917
  107    HB3  ARG  20           2HB      ARG  20  -1.466  -0.963   3.852
  108    HG2  ARG  20           1HG      ARG  20   0.314  -2.545   4.694
  109    HG3  ARG  20           2HG      ARG  20   1.493  -1.454   3.963
  110    HD2  ARG  20           1HD      ARG  20   0.887   0.320   5.387
  111    HD3  ARG  20           2HD      ARG  20  -0.595  -0.489   5.895
  112    HE   ARG  20           HE       ARG  20   2.011  -0.823   7.011
  113   HH11  ARG  20          1HH1      ARG  20  -1.007  -2.441   6.388
  114   HH12  ARG  20          2HH1      ARG  20  -0.821  -3.569   7.689
  115   HH21  ARG  20          1HH2      ARG  20   2.268  -2.302   8.728
  116   HH22  ARG  20          2HH2      ARG  20   1.041  -3.488   9.020
  117    H    GLY  21           H        GLY  21  -2.766  -3.041   3.418
  118    HA2  GLY  21           1HA      GLY  21  -4.580  -2.220   1.233
  119    HA3  GLY  21           2HA      GLY  21  -4.777  -3.723   2.122
  120    H    PHE  22           H        PHE  22  -6.280  -0.995   1.744
  121    HA   PHE  22           HA       PHE  22  -7.110  -0.842   4.557
  122    HB2  PHE  22           1HB      PHE  22  -6.745   1.552   2.743
  123    HB3  PHE  22           2HB      PHE  22  -7.303   1.586   4.412
  124    HD1  PHE  22           HD1      PHE  22  -5.744   1.061   6.248
  125    HD2  PHE  22           HD2      PHE  22  -4.437   1.387   2.211
  126    HE1  PHE  22           HE1      PHE  22  -3.419   1.285   7.022
  127    HE2  PHE  22           HE2      PHE  22  -2.111   1.611   2.978
  128    HZ   PHE  22           HZ       PHE  22  -1.599   1.559   5.386
  129    H    THR  23           H        THR  23  -9.212  -1.190   4.777
  130    HA   THR  23           HA       THR  23 -10.944  -1.609   2.606
  131    HB   THR  23           HB       THR  23 -11.719  -1.024   5.471
  132    HG1  THR  23           HG1      THR  23 -10.285  -2.806   5.306
  133   HG21  THR  23          3HG2      THR  23 -13.460  -1.006   3.530
  134   HG22  THR  23          1HG2      THR  23 -13.813  -1.901   5.008
  135   HG23  THR  23          2HG2      THR  23 -13.251  -2.757   3.572
  136    H    LEU  24           H        LEU  24 -10.762   1.099   4.913
  137    HA   LEU  24           HA       LEU  24 -12.709   2.617   3.401
  138    HB2  LEU  24           1HB      LEU  24 -11.086   3.251   5.856
  139    HB3  LEU  24           2HB      LEU  24 -12.218   4.380   5.117
  140    HG   LEU  24           HG       LEU  24 -13.964   2.505   5.486
  141   HD11  LEU  24          1HD1      LEU  24 -13.102   0.620   6.310
  142   HD12  LEU  24          2HD1      LEU  24 -13.014   1.479   7.847
  143   HD13  LEU  24          3HD1      LEU  24 -11.602   1.412   6.793
  144   HD21  LEU  24          3HD2      LEU  24 -14.401   4.369   6.724
  145   HD22  LEU  24          1HD2      LEU  24 -12.792   4.405   7.445
  146   HD23  LEU  24          2HD2      LEU  24 -13.992   3.251   8.027
  147    H    LYS  25           H        LYS  25 -12.304   4.224   1.995
  148    HA   LYS  25           HA       LYS  25  -9.825   4.469   0.744
  149    HB2  LYS  25           1HB      LYS  25 -11.897   5.108  -0.358
  150    HB3  LYS  25           2HB      LYS  25 -12.143   6.409   0.800
  151    HG2  LYS  25           1HG      LYS  25 -11.327   7.443  -1.136
  152    HG3  LYS  25           2HG      LYS  25  -9.951   7.372  -0.033
  153    HD2  LYS  25           1HD      LYS  25  -9.399   5.152  -1.236
  154    HD3  LYS  25           2HD      LYS  25 -10.490   5.742  -2.491
  155    HE2  LYS  25           1HE      LYS  25  -8.208   6.336  -3.034
  156    HE3  LYS  25           2HE      LYS  25  -9.137   7.790  -2.673
  157    HZ1  LYS  25           3HZ      LYS  25  -6.926   7.792  -1.642
  158    HZ2  LYS  25           1HZ      LYS  25  -7.338   6.412  -0.753
  159    HZ3  LYS  25           2HZ      LYS  25  -8.163   7.865  -0.490
  160    H    SER  26           H        SER  26 -11.264   6.332   3.362
  161    HA   SER  26           HA       SER  26  -9.421   8.443   3.429
  162    HB2  SER  26           1HB      SER  26 -11.034   7.199   5.668
  163    HB3  SER  26           2HB      SER  26 -10.156   8.723   5.800
  164    HG   SER  26           HG       SER  26 -11.774   8.633   3.609
  165    H    HIS  27           H        HIS  27  -9.412   5.301   5.066
  166    HA   HIS  27           HA       HIS  27  -7.199   5.615   6.692
  167    HB2  HIS  27           1HB      HIS  27  -8.300   3.204   5.262
  168    HB3  HIS  27           2HB      HIS  27  -6.897   3.089   6.320
  169    HD1  HIS  27           HD1      HIS  27  -9.710   1.723   6.838
  170    HD2  HIS  27           HD2      HIS  27  -8.328   5.230   8.586
  171    HE1  HIS  27           HE1      HIS  27 -11.003   1.960   8.982
  172    H    LEU  28           H        LEU  28  -7.198   4.151   3.435
  173    HA   LEU  28           HA       LEU  28  -4.475   3.861   3.120
  174    HB2  LEU  28           1HB      LEU  28  -5.847   2.881   1.499
  175    HB3  LEU  28           2HB      LEU  28  -6.681   4.397   1.163
  176    HG   LEU  28           HG       LEU  28  -4.498   5.221   0.173
  177   HD11  LEU  28          1HD1      LEU  28  -2.941   3.475  -0.585
  178   HD12  LEU  28          2HD1      LEU  28  -3.838   2.285   0.356
  179   HD13  LEU  28          3HD1      LEU  28  -3.001   3.605   1.173
  180   HD21  LEU  28          3HD2      LEU  28  -5.198   4.575  -1.884
  181   HD22  LEU  28          1HD2      LEU  28  -6.604   4.036  -0.966
  182   HD23  LEU  28          2HD2      LEU  28  -5.353   2.879  -1.422
  183    H    ASN  29           H        ASN  29  -6.473   6.688   2.327
  184    HA   ASN  29           HA       ASN  29  -4.469   8.287   1.225
  185    HB2  ASN  29           1HB      ASN  29  -7.035   8.664   1.353
  186    HB3  ASN  29           2HB      ASN  29  -6.686   9.442   2.894
  187   HD21  ASN  29          1HD2      ASN  29  -6.755  11.548   2.643
  188   HD22  ASN  29          2HD2      ASN  29  -6.065  12.442   1.335
  189    H    GLN  30           H        GLN  30  -5.702   8.299   4.572
  190    HA   GLN  30           HA       GLN  30  -3.793  10.117   5.559
  191    HB2  GLN  30           1HB      GLN  30  -5.743   9.817   6.855
  192    HB3  GLN  30           2HB      GLN  30  -5.555   8.068   6.883
  193    HG2  GLN  30           1HG      GLN  30  -5.025   9.020   9.041
  194    HG3  GLN  30           2HG      GLN  30  -3.591   8.298   8.313
  195   HE21  GLN  30          1HE2      GLN  30  -2.987   9.894  10.239
  196   HE22  GLN  30          2HE2      GLN  30  -2.447  11.444   9.699
  197    H    HIS  31           H        HIS  31  -3.424   6.951   4.524
  198    HA   HIS  31           HA       HIS  31  -1.250   6.299   6.342
  199    HB2  HIS  31           1HB      HIS  31  -2.393   4.353   5.879
  200    HB3  HIS  31           2HB      HIS  31  -2.766   4.839   4.228
  201    HD1  HIS  31           HD1      HIS  31   0.100   3.491   6.292
  202    HD2  HIS  31           HD2      HIS  31  -1.056   3.869   2.320
  203    HE1  HIS  31           HE1      HIS  31   1.783   2.167   4.974
  204    H    GLN  32           H        GLN  32  -1.735   7.086   2.928
  205    HA   GLN  32           HA       GLN  32   0.882   6.706   2.037
  206    HB2  GLN  32           1HB      GLN  32  -1.435   8.341   1.113
  207    HB3  GLN  32           2HB      GLN  32   0.141   8.658   0.400
  208    HG2  GLN  32           1HG      GLN  32   0.307   6.320  -0.282
  209    HG3  GLN  32           2HG      GLN  32  -1.272   6.001   0.434
  210   HE21  GLN  32          1HE2      GLN  32  -2.488   5.537  -1.287
  211   HE22  GLN  32          2HE2      GLN  32  -2.725   6.579  -2.644
  212    H    ARG  33           H        ARG  33  -0.288   8.938   4.262
  213    HA   ARG  33           HA       ARG  33   1.311  11.193   3.720
  214    HB2  ARG  33           1HB      ARG  33   0.439  10.298   6.465
  215    HB3  ARG  33           2HB      ARG  33   0.757  11.937   5.916
  216    HG2  ARG  33           1HG      ARG  33  -1.602  10.189   5.381
  217    HG3  ARG  33           2HG      ARG  33  -1.548  11.852   5.970
  218    HD2  ARG  33           1HD      ARG  33  -0.753  11.003   3.189
  219    HD3  ARG  33           2HD      ARG  33  -2.345  11.626   3.620
  220    HE   ARG  33           HE       ARG  33   0.043  13.142   3.221
  221   HH11  ARG  33          1HH1      ARG  33  -2.969  13.039   4.963
  222   HH12  ARG  33          2HH1      ARG  33  -3.058  14.757   5.170
  223   HH21  ARG  33          1HH2      ARG  33  -0.063  15.405   3.487
  224   HH22  ARG  33          2HH2      ARG  33  -1.405  16.102   4.330
  225    H    ILE  34           H        ILE  34   2.088   8.098   4.936
  226    HA   ILE  34           HA       ILE  34   4.455   8.909   6.370
  227    HB   ILE  34           HB       ILE  34   4.790   6.665   6.900
  228   HG12  ILE  34          1HG1      ILE  34   3.184   6.024   4.425
  229   HG13  ILE  34          2HG1      ILE  34   4.885   5.681   4.719
  230   HG21  ILE  34          1HG2      ILE  34   2.164   7.720   7.057
  231   HG22  ILE  34          2HG2      ILE  34   2.036   5.989   6.746
  232   HG23  ILE  34          3HG2      ILE  34   2.952   6.569   8.137
  233   HD11  ILE  34          3HD1      ILE  34   3.973   4.244   6.681
  234   HD12  ILE  34          1HD1      ILE  34   2.464   4.300   5.770
  235   HD13  ILE  34          2HD1      ILE  34   3.917   3.625   5.031
  236    H    HIS  35           H        HIS  35   3.638   7.884   3.150
  237    HA   HIS  35           HA       HIS  35   6.426   7.480   2.415
  238    HB2  HIS  35           1HB      HIS  35   3.992   7.381   0.626
  239    HB3  HIS  35           2HB      HIS  35   5.595   6.737   0.281
  240    HD1  HIS  35           HD1      HIS  35   6.310   4.871   2.322
  241    HD2  HIS  35           HD2      HIS  35   2.310   5.404   1.332
  242    HE1  HIS  35           HE1      HIS  35   5.137   2.795   3.121
  243    H    THR  36           H        THR  36   3.897   9.854   2.113
  244    HA   THR  36           HA       THR  36   5.057  11.391   0.031
  245    HB   THR  36           HB       THR  36   2.640  11.480   0.986
  246    HG1  THR  36           HG1      THR  36   2.650  13.025  -0.449
  247   HG21  THR  36          3HG2      THR  36   3.476  12.073   3.297
  248   HG22  THR  36          1HG2      THR  36   2.202  13.111   2.659
  249   HG23  THR  36          2HG2      THR  36   3.877  13.665   2.654
  250    H    GLY  37           H        GLY  37   5.635  11.173   3.444
  251    HA2  GLY  37           1HA      GLY  37   6.758  13.664   3.984
  252    HA3  GLY  37           2HA      GLY  37   7.202  12.168   4.793
  253    H    GLU  38           H        GLU  38   8.247  10.795   2.549
  254    HA   GLU  38           HA       GLU  38  10.819  12.138   2.366
  255    HB2  GLU  38           1HB      GLU  38   9.896   9.377   1.564
  256    HB3  GLU  38           2HB      GLU  38  11.525   9.974   1.275
  257    HG2  GLU  38           1HG      GLU  38  11.841  10.277   3.678
  258    HG3  GLU  38           2HG      GLU  38  10.210   9.676   3.966
  259    H    LYS  39           H        LYS  39  11.965  11.668   0.129
  260    HA   LYS  39           HA       LYS  39  10.282  12.966  -1.881
  261    HB2  LYS  39           1HB      LYS  39  12.646  13.764  -1.144
  262    HB3  LYS  39           2HB      LYS  39  13.228  12.469  -2.182
  263    HG2  LYS  39           1HG      LYS  39  11.408  14.690  -3.087
  264    HG3  LYS  39           2HG      LYS  39  13.162  14.681  -3.286
  265    HD2  LYS  39           1HD      LYS  39  12.647  12.324  -4.389
  266    HD3  LYS  39           2HD      LYS  39  11.077  13.080  -4.673
  267    HE2  LYS  39           1HE      LYS  39  12.299  13.588  -6.594
  268    HE3  LYS  39           2HE      LYS  39  12.421  15.051  -5.618
  269    HZ1  LYS  39           3HZ      LYS  39  14.494  13.463  -6.619
  270    HZ2  LYS  39           1HZ      LYS  39  14.538  13.354  -4.931
  271    HZ3  LYS  39           2HZ      LYS  39  14.611  14.867  -5.684
  272    HA   PRO  40           HA       PRO  40   9.961   8.830  -3.665
  273    HB2  PRO  40           1HB      PRO  40   7.930   9.480  -5.345
  274    HB3  PRO  40           2HB      PRO  40   7.680   9.108  -3.635
  275    HG2  PRO  40           1HG      PRO  40   7.856  11.773  -4.988
  276    HG3  PRO  40           2HG      PRO  40   6.729  11.228  -3.732
  277    HD2  PRO  40           1HD      PRO  40   8.894  12.758  -3.182
  278    HD3  PRO  40           2HD      PRO  40   8.258  11.556  -2.040
  279    H    SER  41           H        SER  41  11.816   8.654  -4.866
  280    HA   SER  41           HA       SER  41  11.753   9.897  -7.535
  281    HB2  SER  41           1HB      SER  41  13.517  10.723  -5.736
  282    HB3  SER  41           2HB      SER  41  14.379   9.274  -6.252
  283    HG   SER  41           HG       SER  41  14.018  11.645  -7.554
  284    H    GLY  42           H        GLY  42  10.857   8.022  -8.442
  285    HA2  GLY  42           1HA      GLY  42  12.720   5.730  -8.542
  286    HA3  GLY  42           2HA      GLY  42  10.976   5.520  -8.481
  287    HA   PRO  43           HA       PRO  43  12.638   5.789 -12.921
  288    HB2  PRO  43           1HB      PRO  43  12.319   3.179 -13.595
  289    HB3  PRO  43           2HB      PRO  43  13.816   3.816 -12.906
  290    HG2  PRO  43           1HG      PRO  43  11.587   2.343 -11.556
  291    HG3  PRO  43           2HG      PRO  43  13.338   2.146 -11.360
  292    HD2  PRO  43           1HD      PRO  43  11.822   3.534  -9.597
  293    HD3  PRO  43           2HD      PRO  43  13.511   3.957  -9.945
  294    H    SER  44           H        SER  44   9.876   5.013 -11.201
  295    HA   SER  44           HA       SER  44   8.181   4.324 -13.425
  296    HB2  SER  44           1HB      SER  44   7.738   3.513 -11.115
  297    HB3  SER  44           2HB      SER  44   7.404   5.173 -10.624
  298    HG   SER  44           HG       SER  44   5.907   3.453 -12.247
  299    H    SER  45           H        SER  45   7.988   5.885 -14.929
  300    HA   SER  45           HA       SER  45   7.851   8.668 -14.284
  301    HB2  SER  45           1HB      SER  45   8.673   7.505 -16.478
  302    HB3  SER  45           2HB      SER  45   6.969   7.557 -16.929
  303    HG   SER  45           HG       SER  45   8.626   9.455 -17.302
  304    H    GLY  46           H        GLY  46   5.970   9.946 -15.445
  305    HA2  GLY  46           1HA      GLY  46   3.567   9.837 -15.962
  306    HA3  GLY  46           2HA      GLY  46   3.421   8.681 -14.646