*HEADER    PROTEIN BINDING                         30-MAR-07   2YQQ              
*TITLE     SOLUTION STRUCTURE OF THE ZF-HIT DOMAIN IN ZINC FINGER HIT            
*TITLE    2 DOMAIN-CONTAINING PROTEIN 3 (TRIP-3)                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER HIT DOMAIN-CONTAINING PROTEIN 3;               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-HIT DOMAIN;                                             
*COMPND   5 SYNONYM: THYROID RECEPTOR-INTERACTING PROTEIN 3, TRIP-3,             
*COMPND   6 THYROID HORMONE RECEPTOR INTERACTOR 3, HNF-4A COACTIVATOR;           
*COMPND   7 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: ZNHIT3;                                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P060925-03;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    NMR, STRUCTURE GENOMICS, ZF-HIT DOMAIN, TRIP-3, STRUCTURAL            
*KEYWDS   2 GENOMICS, NPPSFA, NATIONAL PROJECT ON PROTEIN STRUCTURAL             
*KEYWDS   3 AND FUNCTIONAL ANALYSES, RIKEN STRUCTURAL                            
*KEYWDS   4 GENOMICS/PROTEOMICS INITIATIVE, RSGI, PROTEIN BINDING                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    S.SUZUKI, F.HE, S.SUZUKI, Y.MUTO, M.INOUE, T.KIGAWA,                  
*AUTHOR   2 T.TERADA, M.SHIROUZU, S.YOKOYAMA, RIKEN STRUCTURAL                   
*AUTHOR   3 GENOMICS/PROTEOMICS INITIATIVE (RSGI)                                
*REVDAT   1   12-MAY-09 2YQQ    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
15 CYSS CB   201 ZN   ZN   3.25  5.00E+00
18 CYSS SG   201 ZN   ZN   2.19  5.00E+00
18 CYSS CB   201 ZN   ZN   3.25  5.00E+00
34 CYSS SG   201 ZN   ZN   2.19  5.00E+00
34 CYSS CB   201 ZN   ZN   3.25  5.00E+00
38 CYSS SG   201 ZN   ZN   2.19  5.00E+00
38 CYSS CB   201 ZN   ZN   3.25  5.00E+00
15 CYSS SG  18 CYSS SG   3.56  5.00E+00
15 CYSS SG  34 CYSS SG   3.56  5.00E+00
15 CYSS SG  38 CYSS SG   3.56  5.00E+00
18 CYSS SG  34 CYSS SG   3.56  5.00E+00
18 CYSS SG  38 CYSS SG   3.56  5.00E+00
34 CYSS SG  38 CYSS SG   3.56  5.00E+00

26 CYSS SG   401 ZN   ZN   2.19  5.00E+00
26 CYSS CB   401 ZN   ZN   3.25  5.00E+00
29 CYSS SG   401 ZN   ZN   2.19  5.00E+00
29 CYSS CB   401 ZN   ZN   3.25  5.00E+00
42 HIS NE2   401 ZN   ZN   1.90  5.00E+00
46 CYSS SG   401 ZN   ZN   2.19  5.00E+00
46 CYSS CB   401 ZN   ZN   3.25  5.00E+00
26 CYSS SG  29 CYSS SG   3.56  5.00E+00
26 CYSS SG  42 HIS NE2   3.32  5.00E+00
26 CYSS SG  46 CYSS SG   3.56  5.00E+00
29 CYSS SG  42 HIS NE2   3.32  5.00E+00
29 CYSS SG  46 CYSS SG   3.56  5.00E+00
42 HIS NE2  46 CYSS SG   3.32  5.00E+00
15 CYSS SG   201 ZN   ZN   2.39  5.00E+00
15 CYSS CB   201 ZN   ZN   3.51  5.00E+00
18 CYSS SG   201 ZN   ZN   2.39  5.00E+00
18 CYSS CB   201 ZN   ZN   3.51  5.00E+00
34 CYSS SG   201 ZN   ZN   2.39  5.00E+00
34 CYSS CB   201 ZN   ZN   3.51  5.00E+00
38 CYSS SG   201 ZN   ZN   2.39  5.00E+00
38 CYSS CB   201 ZN   ZN   3.51  5.00E+00
15 CYSS SG  18 CYSS SG   3.96  5.00E+00
15 CYSS SG  34 CYSS SG   3.96  5.00E+00
15 CYSS SG  38 CYSS SG   3.96  5.00E+00
18 CYSS SG  34 CYSS SG   3.96  5.00E+00
18 CYSS SG  38 CYSS SG   3.96  5.00E+00
34 CYSS SG  38 CYSS SG   3.96  5.00E+00

26 CYSS SG   401 ZN   ZN   2.39  5.00E+00
26 CYSS CB   401 ZN   ZN   3.51  5.00E+00
29 CYSS SG   401 ZN   ZN   2.39  5.00E+00
29 CYSS CB   401 ZN   ZN   3.51  5.00E+00
42 HIS NE2   401 ZN   ZN   2.10  5.00E+00
46 CYSS SG   401 ZN   ZN   2.39  5.00E+00
46 CYSS CB   401 ZN   ZN   3.51  5.00E+00
26 CYSS SG  29 CYSS SG   3.96  5.00E+00
26 CYSS SG  42 HIS NE2   3.72  5.00E+00
26 CYSS SG  46 CYSS SG   3.96  5.00E+00
29 CYSS SG  42 HIS NE2   3.72  5.00E+00
29 CYSS SG  46 CYSS SG   3.96  5.00E+00
42 HIS NE2  46 CYSS SG   3.72  5.00E+00
  14  VAL PHI   -157.2  -97.2
  14  VAL PSI    121.8  181.8
  24  TYR PHI   -148.7  -88.7
  24  TYR PSI    114.9  174.9
  25  ARG PHI   -144.8  -84.8
  25  ARG PSI    103.2  163.2
  31  VAL PHI   -127.1  -67.1
  31  VAL PSI    110.6  170.6
  33  TYR PHI   -156.1  -96.1
  33  TYR PSI    113.5  173.5
  35  SER PHI   -115.7  -55.7
  35  SER PSI    125.4  185.4
  36  VAL PHI    -90.2  -30.2
  36  VAL PSI    -64.0   -4.0
  37  VAL PHI    -92.6  -32.6
  37  VAL PSI    -71.4  -11.4
  39  PHE PHI    -92.7  -32.7
  39  PHE PSI    -75.9  -15.9
  40  ARG PHI    -90.1  -30.1
  40  ARG PSI    -72.9  -12.9
  41  LYS PHI    -98.3  -38.3
  41  LYS PSI    -66.2   -6.2
  42  HIS PHI    -95.3  -35.3
  42  HIS PSI    -71.4  -11.4
  43  LYS PHI    -93.4  -33.4
  43  LYS PSI    -69.6   -9.6
  44  GLU PHI    -98.5  -38.5
  44  GLU PSI    -61.8   -1.8
  45  GLN PHI   -129.5  -69.5
  45  GLN PSI    -33.5   26.5
  47  ASN PHI   -119.4  -59.4
  47  ASN PSI    101.1  161.1
  31  VAL CHI1   -90.0  -30.0
  37  VAL CHI1   150.0  210.0

          
 28 ALA  HN     29 CYSS HN      3.42 #SUP  0.81  #QF  0.81
 29 CYSS HN     29 CYSS HB2     3.85 #SUP  0.98  #QF  0.98
 13 VAL  HN     13 VAL  QG1     3.52 #SUP  0.96  #QF  0.96
 13 VAL  HN     13 VAL  HB      3.84 #SUP  0.98  #QF  0.98
 12 THR  HA     13 VAL  HN      3.43 #SUP  0.98  #QF  0.85
 14 VAL  HN     14 VAL  QG2     3.14 #SUP  0.98  #QF  0.98
 13 VAL  QG2    14 VAL  HN      3.67 #SUP  0.93  #QF  0.69
 13 VAL  HB     14 VAL  HN      4.08 #SUP  0.90  #QF  0.90
 13 VAL  HN     14 VAL  HN      4.69 #SUP  1.00
 14 VAL  HB     15 CYSS HN      3.46 #SUP  0.99  #QF  0.99
 15 CYSS HN     20 GLU  HN      4.55 #SUP  0.99  #QF  0.99
 16 VAL  HN     16 VAL  QG1     3.54 #SUP  1.00  #QF  0.93
 16 VAL  HN     16 VAL  HB      3.63 #SUP  0.99  #QF  0.99
 16 VAL  HN     17 ILE  HG12    5.10 #SUP  1.00  #QF  0.95
 16 VAL  HN     32 PRO  HB2     5.32 #SUP  1.00  #QF  0.95
 14 VAL  QG2    16 VAL  HN      5.42 #SUP  0.98  #QF  0.84
 16 VAL  HN     17 ILE  QD1     5.50 #SUP  0.98  #QF  0.84
 17 ILE  HN     17 ILE  HG12    3.72 #SUP  0.99  #QF  0.99
 16 VAL  HN     17 ILE  HN      3.97 #SUP  0.83  #QF  0.83
 17 ILE  HN     19 LEU  HN      4.58 #SUP  0.84  #QF  0.84
 17 ILE  HG12   18 CYSS HN      4.50 #SUP  1.00
 18 CYSS HN     18 CYSS HB3     3.75 #SUP  0.98  #QF  0.98
 17 ILE  HB     18 CYSS HN      3.23 #SUP  0.98  #QF  0.98
 15 CYSS HB3    18 CYSS HN      3.71 #SUP  1.00  #QF  0.84
 18 CYSS HN     19 LEU  HA      4.52 #SUP  1.00
 17 ILE  HN     18 CYSS HN      3.31 #SUP  0.99  #QF  0.99
 19 LEU  HN     19 LEU  QD1     4.65 #SUP  1.00
 14 VAL  HB     19 LEU  HN      4.57 #SUP  0.99  #QF  0.99
 19 LEU  HN     19 LEU  HB2     3.97 #SUP  1.00
 15 CYSS HB2    19 LEU  HN      4.12 #SUP  0.95  #QF  0.95
 15 CYSS HB3    19 LEU  HN      3.43 #SUP  0.95  #QF  0.95
 19 LEU  HN     19 LEU  HA      2.91 #SUP  0.99  #QF  0.99
 18 CYSS HN     19 LEU  HN      3.25 #SUP  0.99  #QF  0.99
 19 LEU  HN     20 GLU  HN      3.61 #SUP  0.94  #QF  0.94
 15 CYSS HN     19 LEU  HN      4.53 #SUP  0.97  #QF  0.97
 20 GLU  HN     20 GLU  HB2     3.33 #SUP  0.75  #QF  0.75
 15 CYSS HB2    20 GLU  HN      3.88 #SUP  0.96  #QF  0.87
 21 LYS  HN     21 LYS  HG3     4.62 #SUP  0.96  #QF  0.96
 21 LYS  HN     21 LYS  HB2     3.63 #SUP  0.75  #QF  0.58
 20 GLU  HB3    21 LYS  HN      2.94 #SUP  0.64  #QF  0.64
 20 GLU  HA     21 LYS  HN      3.08 #SUP  0.98  #QF  0.67
 24 TYR  HN     24 TYR  HB2     3.54 #SUP  0.98  #QF  0.98
 22 PRO  HB2    24 TYR  HN      3.95 #SUP  0.93  #QF  0.93
 24 TYR  HN     24 TYR  HB3     3.97 #SUP  0.99  #QF  0.99
 24 TYR  HN     24 TYR  QD      3.79 #SUP  0.96  #QF  0.96
 24 TYR  HB2    25 ARG  HN      3.83 #SUP  0.99  #QF  0.99
 25 ARG  HN     25 ARG  HB2     3.94 #SUP  1.00
 25 ARG  HN     25 ARG  HB3     3.94 #SUP  1.00  #QF  0.99
 25 ARG  HN     25 ARG  HG3     4.24 #SUP  1.00  #QF  0.99
 24 TYR  HB3    25 ARG  HN      3.33 #SUP  0.96  #QF  0.96
 24 TYR  QD     25 ARG  HN      4.52 #SUP  0.99  #QF  0.99
 26 CYSS HN     31 VAL  HN      4.64 #SUP  0.96  #QF  0.96
 27 PRO  HG2    28 ALA  HN      4.21 #SUP  0.88  #QF  0.88
 27 PRO  HD2    28 ALA  HN      3.80 #SUP  0.87  #QF  0.87
 28 ALA  HN     30 ARG  HN      3.34 #SUP  0.65  #QF  0.65
 30 ARG  HN     30 ARG  HG2     5.20 #SUP  0.92  #QF  0.54
 30 ARG  HN     30 ARG  HG3     5.20 #SUP  0.92  #QF  0.54
 26 CYSS HB2    30 ARG  HN      4.81 #SUP  0.98  #QF  0.98
 26 CYSS HB3    30 ARG  HN      3.82 #SUP  0.85  #QF  0.85
 24 TYR  HN     33 TYR  HN      3.91 #SUP  0.95  #QF  0.95
 33 TYR  HN     33 TYR  QD      4.16 #SUP  0.74  #QF  0.74
 32 PRO  HA     33 TYR  HN      2.98 #SUP  0.95  #QF  0.95
 25 ARG  HA     33 TYR  HN      4.00 #SUP  0.98  #QF  0.98
 24 TYR  HB2    33 TYR  HN      5.26 #SUP  0.60  #QF  0.60
 22 PRO  HB3    33 TYR  HN      4.10 #SUP  0.99  #QF  0.98
 32 PRO  HB2    33 TYR  HN      4.13 #SUP  1.00
 33 TYR  HN     33 TYR  HB3     4.12 #SUP  1.00  #QF  0.99
 34 CYSS HN     38 CYSS HB3     4.19 #SUP  0.98  #QF  0.97
 15 CYSS HB3    34 CYSS HN      4.34 #SUP  0.97  #QF  0.61
 15 CYSS HB2    34 CYSS HN      3.95 #SUP  0.98  #QF  0.98
 34 CYSS HN     34 CYSS HB3     3.74 #SUP  0.93  #QF  0.93
 34 CYSS HN     35 SER  HN      3.49 #SUP  0.98  #QF  0.98
 35 SER  HN     39 PHE  HN      4.80 #SUP  0.99  #QF  0.99
 33 TYR  QD     35 SER  HN      3.16 #SUP  0.77  #QF  0.77
 36 VAL  QG1    37 VAL  HN      4.09 #SUP  0.99  #QF  0.95
 37 VAL  HN     37 VAL  HB      3.04 #SUP  0.97  #QF  0.97
 35 SER  HB2    37 VAL  HN      4.19 #SUP  0.95  #QF  0.95
 35 SER  HB3    37 VAL  HN      4.19 #SUP  0.88  #QF  0.88
 37 VAL  QG2    38 CYSS HN      3.77 #SUP  0.96  #QF  0.96
 38 CYSS HN     38 CYSS HB2     3.22 #SUP  0.74  #QF  0.74
 39 PHE  HN     39 PHE  HB2     3.68 #SUP  0.61  #QF  0.61
 38 CYSS HN     39 PHE  HN      3.33 #SUP  0.99  #QF  0.99
 39 PHE  HN     40 ARG  HN      3.50 #SUP  0.95  #QF  0.95
 17 ILE  HG13   39 PHE  HN      5.50 #SUP  0.99  #QF  0.90
 39 PHE  HN     40 ARG  HB2     5.50 #SUP  0.99  #QF  0.90
 39 PHE  HN     40 ARG  HG2     5.50 #SUP  0.99  #QF  0.90
 39 PHE  HN     39 PHE  QD      4.39 #SUP  0.96  #QF  0.96
 33 TYR  QD     39 PHE  HN      4.22 #SUP  0.66  #QF  0.66
 36 VAL  HA     39 PHE  HN      3.73 #SUP  0.99  #QF  0.99
 40 ARG  HB2    41 LYS  HN      3.49 #SUP  0.97  #QF  0.61
 40 ARG  HN     41 LYS  HN      4.10 #SUP  0.95  #QF  0.95
 41 LYS  HN     42 HIS  HN      3.96 #SUP  0.96  #QF  0.96
 42 HIS  HN     42 HIS  HB2     3.98 #SUP  1.00
 42 HIS  HN     42 HIS  HB3     3.88 #SUP  0.99  #QF  0.99
 42 HIS  HN     43 LYS  HN      3.88 #SUP  0.83  #QF  0.83
 42 HIS  HB3    43 LYS  HN      4.41 #SUP  0.96  #QF  0.96
 43 LYS  HN     44 GLU  HN      4.32 #SUP  0.99  #QF  0.99
 44 GLU  HN     44 GLU  HB2     3.77 #SUP  0.96  #QF  0.96
 44 GLU  HN     45 GLN  HN      3.70 #SUP  0.92  #QF  0.92
 45 GLN  HN     45 GLN  HG2     3.98 #SUP  0.76  #QF  0.21
 45 GLN  HN     45 GLN  HG3     3.98 #SUP  0.76  #QF  0.21
 43 LYS  HA     45 GLN  HN      4.64 #SUP  0.98  #QF  0.98
 45 GLN  HN     46 CYSS HN      2.83 #SUP  0.85  #QF  0.85
 46 CYSS HN     46 CYSS HB2     3.11 #SUP  0.98  #QF  0.98
 46 CYSS HN     46 CYSS HB3     3.11 #SUP  0.94  #QF  0.94
 43 LYS  HA     46 CYSS HN      3.64 #SUP  0.92  #QF  0.92
 46 CYSS HA     47 ASN  HN      3.50 #SUP  0.98  #QF  0.98
 48 PRO  HG2    49 GLU  HN      4.48 #SUP  1.00  #QF  0.36
 48 PRO  HA     49 GLU  HN      3.18 #SUP  0.99  #QF  0.53
 49 GLU  HN     50 THR  HN      4.46 #SUP  0.94  #QF  0.94
 40 ARG  HA     42 HIS  HN      5.48 #SUP  1.00  #QF  0.99
 24 TYR  HN     34 CYSS HA      3.69 #SUP  0.26  #QF  0.26
 37 VAL  HB     38 CYSS HN      3.39 #SUP  0.78  #QF  0.78
 27 PRO  HD3    28 ALA  HN      4.21 #SUP  1.00
 26 CYSS HN     33 TYR  QD      4.93 #SUP  0.46  #QF  0.46
 25 ARG  HN     33 TYR  QE      4.60 #SUP  0.99  #QF  0.99
 22 PRO  HB3    24 TYR  HN      4.82 #SUP  0.93  #QF  0.93
 17 ILE  HG13   18 CYSS HN      4.57 #SUP  1.00
 18 CYSS HN     38 CYSS HB3     4.64 #SUP  0.96  #QF  0.96
 17 ILE  HN     38 CYSS HB3     4.80 #SUP  0.99  #QF  0.99
 15 CYSS HB3    17 ILE  HN      4.85 #SUP  0.41  #QF  0.41
 16 VAL  HN     33 TYR  HB3     5.50 #SUP  0.88  #QF  0.88
 15 CYSS HB3    16 VAL  HN      4.83 #SUP  0.90  #QF  0.90
 15 CYSS HN     19 LEU  HA      4.16 #SUP  0.97  #QF  0.97
 15 CYSS HN     16 VAL  HN      4.49 #SUP  0.51  #QF  0.51
 12 THR  QG2    13 VAL  HN      4.59 #SUP  0.73  #QF  0.73
 33 TYR  QD     34 CYSS HN      4.61 #SUP  0.87  #QF  0.87
 33 TYR  QE     35 SER  HN      4.39 #SUP  0.89  #QF  0.89
 24 TYR  QD     35 SER  HN      5.21 #SUP  0.95  #QF  0.95
 33 TYR  HA     35 SER  HN      4.96 #SUP  1.00
 48 PRO  HD2    49 GLU  HN      5.50 #SUP  0.99  #QF  0.99
 50 THR  HN     50 THR  QG2     4.75 #SUP  0.95  #QF  0.95
 44 GLU  HB2    45 GLN  HN      4.37 #SUP  0.97  #QF  0.97
 38 CYSS HB2    39 PHE  HN      3.51 #SUP  0.59  #QF  0.59
 36 VAL  HB     37 VAL  HN      3.68 #SUP  0.78  #QF  0.78
 35 SER  HN     38 CYSS HB2     3.35 #SUP  0.65  #QF  0.65
 24 TYR  QE     35 SER  HA      3.91 #SUP  0.67  #QF  0.67
 12 THR  HA     13 VAL  QG1     4.22 #SUP  0.78  #QF  0.78
 12 THR  HA     12 THR  QG2     3.39 #SUP  0.78  #QF  0.78
 13 VAL  HA     14 VAL  QG2     3.76 #SUP  0.58  #QF  0.58
 13 VAL  HA     13 VAL  QG2     3.02 #SUP  0.95  #QF  0.95
 22 PRO  HA     34 CYSS HB3     3.65 #SUP  0.98  #QF  0.98
 22 PRO  HA     34 CYSS HB2     4.47 #SUP  1.00
 13 VAL  HA     14 VAL  HN      2.82 #SUP  0.97  #QF  0.97
 13 VAL  HN     13 VAL  QG2     3.96 #SUP  0.98  #QF  0.98
 13 VAL  QG2    22 PRO  HG3     4.81 #SUP  0.80  #QF  0.80
 13 VAL  QG2    32 PRO  HG2     4.30 #SUP  0.87  #QF  0.87
 13 VAL  QG1    22 PRO  HG3     3.82 #SUP  0.99  #QF  0.99
 13 VAL  QG1    32 PRO  HG2     4.04 #SUP  0.96  #QF  0.96
 13 VAL  QG1    32 PRO  HG3     3.77 #SUP  0.99  #QF  0.99
 13 VAL  HA     13 VAL  QG1     3.32 #SUP  0.97  #QF  0.97
 13 VAL  QG1    14 VAL  HN      3.87 #SUP  0.97  #QF  0.97
 13 VAL  QG1    32 PRO  HD3     4.45 #SUP  0.79  #QF  0.79
 14 VAL  HA     14 VAL  QG1     3.14 #SUP  0.99  #QF  0.99
 14 VAL  HA     22 PRO  HG3     3.81 #SUP  0.93  #QF  0.93
 14 VAL  HA     22 PRO  HD3     3.10 #SUP  0.99  #QF  0.99
 14 VAL  HA     15 CYSS HN      3.28 #SUP  0.97  #QF  0.97
 14 VAL  HB     19 LEU  HA      3.25 #SUP  0.99  #QF  0.99
 13 VAL  HA     14 VAL  QG1     4.07 #SUP  0.87  #QF  0.75
 14 VAL  QG1    19 LEU  HA      4.50 #SUP  0.87  #QF  0.75
 14 VAL  HN     14 VAL  QG1     3.72 #SUP  0.97  #QF  0.97
 14 VAL  QG1    15 CYSS HN      4.18 #SUP  0.95  #QF  0.95
 14 VAL  QG1    19 LEU  HB3     4.35 #SUP  0.89  #QF  0.89
 14 VAL  QG1    19 LEU  HB2     5.48 #SUP  1.00
 14 VAL  QG1    22 PRO  HD3     4.16 #SUP  1.00
 14 VAL  QG2    19 LEU  HB3     3.79 #SUP  1.00
 14 VAL  QG2    19 LEU  HB2     4.16 #SUP  0.99  #QF  0.99
 14 VAL  QG2    19 LEU  HA      3.26 #SUP  0.99  #QF  0.99
 14 VAL  HA     14 VAL  QG2     4.01 #SUP  1.00
 14 VAL  QG2    15 CYSS HN      4.30 #SUP  0.94  #QF  0.94
 14 VAL  QG2    19 LEU  HN      4.30 #SUP  0.93  #QF  0.93
 14 VAL  QG2    16 VAL  HA      4.31 #SUP  0.98  #QF  0.98
 15 CYSS HA     16 VAL  QG1     4.41 #SUP  0.95  #QF  0.54
 15 CYSS HA     16 VAL  QG2     4.69 #SUP  0.95  #QF  0.54
 15 CYSS HA     22 PRO  HB3     3.90 #SUP  0.99  #QF  0.99
 15 CYSS HA     32 PRO  HB2     3.99 #SUP  0.92  #QF  0.92
 15 CYSS HA     22 PRO  HB2     5.11 #SUP  0.92  #QF  0.92
 15 CYSS HA     33 TYR  HB2     5.50 #SUP  1.00  #QF  0.84
 15 CYSS HA     33 TYR  HB3     5.50 #SUP  1.00  #QF  0.84
 15 CYSS HA     16 VAL  HN      3.01 #SUP  0.98  #QF  0.98
 15 CYSS HA     34 CYSS HN      4.53 #SUP  0.98  #QF  0.98
 15 CYSS HB2    22 PRO  HA      4.30 #SUP  0.94  #QF  0.94
 15 CYSS HB2    22 PRO  HB3     4.41 #SUP  0.99  #QF  0.99
 15 CYSS HB2    18 CYSS HN      4.70 #SUP  0.95  #QF  0.95
 15 CYSS HN     15 CYSS HB2     3.47 #SUP  0.98  #QF  0.98
 15 CYSS HB3    20 GLU  HN      3.49 #SUP  0.93  #QF  0.93
 15 CYSS HN     15 CYSS HB3     3.39 #SUP  0.98  #QF  0.98
 15 CYSS HB3    19 LEU  HA      4.28 #SUP  0.98  #QF  0.98
 15 CYSS HB3    20 GLU  HB2     4.38 #SUP  0.90  #QF  0.90
 14 VAL  HB     15 CYSS HB3     4.62 #SUP  0.99  #QF  0.99
 15 CYSS HB2    20 GLU  HB2     4.60 #SUP  0.89  #QF  0.89
 16 VAL  HA     16 VAL  QG1     2.89 #SUP  0.84  #QF  0.84
 16 VAL  HB     17 ILE  QD1     3.91 #SUP  0.92  #QF  0.92
 16 VAL  QG2    17 ILE  HA      4.23 #SUP  0.34  #QF  0.34
 17 ILE  HA     17 ILE  HG12    4.01 #SUP  1.00
 17 ILE  HB     38 CYSS HB3     3.57 #SUP  0.99  #QF  0.99
 17 ILE  HN     17 ILE  HB      3.47 #SUP  0.99  #QF  0.99
 17 ILE  HB     38 CYSS HB2     4.18 #SUP  1.00
 17 ILE  HB     17 ILE  QD1     4.04 #SUP  1.00
 17 ILE  HN     17 ILE  HG13    4.11 #SUP  1.00
 17 ILE  HG12   38 CYSS HA      4.94 #SUP  1.00
 17 ILE  QG2    17 ILE  QD1     2.99 #SUP  0.98  #QF  0.98
 17 ILE  QG2    17 ILE  HG12    3.55 #SUP  1.00
 17 ILE  QG2    17 ILE  HG13    2.99 #SUP  0.71  #QF  0.71
 17 ILE  QG2    18 CYSS HB3     3.77 #SUP  0.99  #QF  0.99
 17 ILE  QG2    38 CYSS HB3     4.03 #SUP  0.94  #QF  0.89
 17 ILE  HA     17 ILE  QG2     3.21 #SUP  1.00
 17 ILE  QG2    18 CYSS HN      3.78 #SUP  0.97  #QF  0.97
 17 ILE  HN     17 ILE  QG2     3.94 #SUP  1.00
 17 ILE  QG2    18 CYSS HA      4.10 #SUP  0.98  #QF  0.98
 17 ILE  QG2    18 CYSS HB2     4.93 #SUP  1.00
 17 ILE  HA     17 ILE  QD1     2.95 #SUP  1.00
 17 ILE  QD1    42 HIS  HB2     3.59 #SUP  0.94  #QF  0.85
 17 ILE  QD1    42 HIS  HB3     4.39 #SUP  1.00
 17 ILE  HN     17 ILE  QD1     3.86 #SUP  1.00  #QF  0.99
 17 ILE  QD1    42 HIS  HN      4.30 #SUP  1.00  #QF  0.99
 18 CYSS HN     18 CYSS HB2     4.00 #SUP  0.96  #QF  0.96
 14 VAL  QG2    19 LEU  HG      4.39 #SUP  0.98  #QF  0.98
 19 LEU  HA     19 LEU  HG      4.11 #SUP  0.99  #QF  0.99
 19 LEU  HN     19 LEU  HG      4.05 #SUP  0.98  #QF  0.98
 19 LEU  HB3    19 LEU  QD1     3.26 #SUP  0.98  #QF  0.98
 19 LEU  HB2    19 LEU  QD1     3.61 #SUP  0.99  #QF  0.99
 19 LEU  HA     19 LEU  QD1     4.20 #SUP  0.99  #QF  0.99
 19 LEU  HB3    19 LEU  QD2     3.26 #SUP  0.99  #QF  0.99
 19 LEU  HB2    19 LEU  QD2     3.61 #SUP  0.99  #QF  0.99
 19 LEU  HA     19 LEU  QD2     4.20 #SUP  1.00
 19 LEU  HN     19 LEU  QD2     4.65 #SUP  0.99  #QF  0.99
 20 GLU  HA     20 GLU  HG2     3.98 #SUP  0.99  #QF  0.99
 20 GLU  HA     20 GLU  HG3     3.98 #SUP  0.99  #QF  0.99
 15 CYSS HB3    20 GLU  HB3     5.50 #SUP  0.91  #QF  0.84
 20 GLU  HB3    34 CYSS HB2     5.50 #SUP  0.91  #QF  0.84
 20 GLU  HB2    21 LYS  HN      3.66 #SUP  0.63  #QF  0.63
 18 CYSS HB2    20 GLU  HB2     5.50 #SUP  1.00  #QF  0.99
 18 CYSS HB2    20 GLU  HG2     4.84 #SUP  0.84  #QF  0.77
 20 GLU  HN     20 GLU  HG2     3.96 #SUP  0.97  #QF  0.97
 18 CYSS HB2    20 GLU  HG3     4.84 #SUP  0.21  #QF  0.21
 20 GLU  HN     20 GLU  HG3     3.96 #SUP  0.62  #QF  0.62
 21 LYS  HA     22 PRO  HD3     2.97 #SUP  0.99  #QF  0.99
 14 VAL  QG1    21 LYS  HA      4.30 #SUP  0.90  #QF  0.90
 15 CYSS HN     21 LYS  HA      4.69 #SUP  0.96  #QF  0.96
 21 LYS  HB3    22 PRO  HD3     5.43 #SUP  1.00
 21 LYS  HN     21 LYS  HB3     3.63 #SUP  0.89  #QF  0.89
 21 LYS  HG2    22 PRO  HD2     4.46 #SUP  0.96  #QF  0.96
 21 LYS  HA     21 LYS  HG2     4.12 #SUP  0.93  #QF  0.93
 21 LYS  HN     21 LYS  HG2     4.62 #SUP  0.89  #QF  0.89
 21 LYS  HG3    22 PRO  HD2     4.46 #SUP  0.93  #QF  0.93
 21 LYS  HA     21 LYS  HG3     4.12 #SUP  0.99  #QF  0.99
 21 LYS  HA     21 LYS  HD2     5.50 #SUP  1.00  #QF  0.99
 21 LYS  HA     21 LYS  HD3     5.50 #SUP  1.00  #QF  0.99
 21 LYS  HN     21 LYS  HD2     5.50 #SUP  0.94  #QF  0.73
 21 LYS  HN     21 LYS  HD3     5.50 #SUP  0.94  #QF  0.73
 22 PRO  HA     34 CYSS HA      3.14 #SUP  0.82  #QF  0.82
 13 VAL  QG1    22 PRO  HB2     4.89 #SUP  0.89  #QF  0.89
 22 PRO  HB2    33 TYR  HN      4.21 #SUP  0.89  #QF  0.89
 22 PRO  HB3    32 PRO  HB2     3.93 #SUP  0.87  #QF  0.87
 15 CYSS HN     22 PRO  HB3     4.75 #SUP  0.99  #QF  0.99
 22 PRO  HB3    25 ARG  HA      5.50 #SUP  0.83  #QF  0.83
 21 LYS  HA     22 PRO  HG2     5.11 #SUP  0.88  #QF  0.33
 21 LYS  HA     22 PRO  HG3     4.51 #SUP  0.99  #QF  0.99
 14 VAL  HB     22 PRO  HD3     3.92 #SUP  1.00  #QF  0.87
 15 CYSS HN     22 PRO  HD3     4.06 #SUP  0.99  #QF  0.99
 23 LYS  HA     23 LYS  HD2     5.36 #SUP  1.00  #QF  0.75
 23 LYS  HA     23 LYS  HD3     5.36 #SUP  1.00  #QF  0.75
 14 VAL  QG1    22 PRO  HD2     4.52 #SUP  0.99  #QF  0.99
 13 VAL  QG1    22 PRO  HD2     5.08 #SUP  0.94  #QF  0.94
 21 LYS  HA     22 PRO  HD2     3.03 #SUP  1.00
 14 VAL  HA     22 PRO  HD2     3.47 #SUP  1.00
 15 CYSS HN     22 PRO  HD2     4.41 #SUP  0.99  #QF  0.99
 23 LYS  HA     23 LYS  HG2     3.77 #SUP  0.91  #QF  0.63
 23 LYS  HA     23 LYS  HG3     3.77 #SUP  0.99  #QF  0.99
 23 LYS  HB2    24 TYR  QE      5.25 #SUP  0.99  #QF  0.81
 23 LYS  HB3    24 TYR  QE      5.25 #SUP  1.00  #QF  0.95
 25 ARG  HA     25 ARG  HG2     3.49 #SUP  1.00  #QF  0.99
 25 ARG  HA     26 CYSS HN      3.30 #SUP  0.96  #QF  0.96
 25 ARG  HA     25 ARG  HG3     4.10 #SUP  1.00
 24 TYR  HA     25 ARG  HA      4.90 #SUP  1.00  #QF  0.98
 25 ARG  HA     26 CYSS HA      5.21 #SUP  1.00  #QF  0.98
 25 ARG  HB2    26 CYSS HN      4.75 #SUP  0.90  #QF  0.90
 25 ARG  HB3    26 CYSS HN      4.75 #SUP  0.89  #QF  0.89
 25 ARG  HG3    32 PRO  HB3     4.65 #SUP  0.62  #QF  0.62
 25 ARG  HA     25 ARG  HD2     5.10 #SUP  1.00  #QF  0.35
 25 ARG  HA     25 ARG  HD3     5.10 #SUP  1.00  #QF  0.35
 25 ARG  HD2    32 PRO  HA      5.32 #SUP  0.98  #QF  0.69
 25 ARG  HD3    32 PRO  HA      5.32 #SUP  0.98  #QF  0.69
 26 CYSS HN     26 CYSS HB3     3.52 #SUP  0.95  #QF  0.95
 26 CYSS HB3    31 VAL  HN      3.22 #SUP  0.93  #QF  0.28
 26 CYSS HB3    31 VAL  QG2     4.37 #SUP  0.93  #QF  0.93
 26 CYSS HB3    31 VAL  QG1     4.37 #SUP  0.96  #QF  0.96
 26 CYSS HB3    30 ARG  HA      4.35 #SUP  0.93  #QF  0.93
 26 CYSS HB3    28 ALA  HN      4.74 #SUP  0.90  #QF  0.90
 26 CYSS HB2    31 VAL  QG2     4.64 #SUP  0.94  #QF  0.94
 26 CYSS HB2    31 VAL  QG1     4.64 #SUP  0.97  #QF  0.97
 26 CYSS HB2    31 VAL  HN      3.80 #SUP  0.95  #QF  0.95
 26 CYSS HN     26 CYSS HB2     3.78 #SUP  0.97  #QF  0.97
 27 PRO  HD2    33 TYR  QE      4.70 #SUP  0.99  #QF  0.99
 28 ALA  QB     29 CYSS HN      3.23 #SUP  0.95  #QF  0.95
 28 ALA  HN     28 ALA  QB      3.05 #SUP  0.86  #QF  0.86
 27 PRO  HG2    28 ALA  QB      4.17 #SUP  0.66  #QF  0.41
 28 ALA  QB     29 CYSS HB3     4.26 #SUP  0.98  #QF  0.98
 29 CYSS HN     29 CYSS HB3     4.08 #SUP  0.97  #QF  0.97
 26 CYSS HN     30 ARG  HA      4.56 #SUP  0.95  #QF  0.95
 30 ARG  HA     30 ARG  HG3     4.05 #SUP  0.88  #QF  0.56
 30 ARG  HA     30 ARG  HD2     4.29 #SUP  1.00
 30 ARG  HA     30 ARG  HG2     4.05 #SUP  1.00  #QF  0.99
 30 ARG  HB3    30 ARG  HD2     4.20 #SUP  1.00
 30 ARG  HN     30 ARG  HD2     4.67 #SUP  0.70  #QF  0.70
 30 ARG  HB3    30 ARG  HD3     4.20 #SUP  0.99  #QF  0.99
 30 ARG  HA     30 ARG  HD3     4.29 #SUP  1.00
 30 ARG  HN     30 ARG  HD3     4.67 #SUP  0.82  #QF  0.82
 31 VAL  HB     32 PRO  HD3     3.93 #SUP  1.00
 31 VAL  HN     31 VAL  HB      3.94 #SUP  0.99  #QF  0.99
 31 VAL  HN     31 VAL  QG1     4.03 #SUP  0.98  #QF  0.98
 31 VAL  QG1    32 PRO  HD2     4.71 #SUP  0.99  #QF  0.99
 31 VAL  HN     31 VAL  QG2     4.03 #SUP  0.98  #QF  0.98
 25 ARG  HG2    32 PRO  HA      3.83 #SUP  0.99  #QF  0.88
 25 ARG  HA     32 PRO  HA      3.34 #SUP  0.99  #QF  0.99
 13 VAL  QG1    32 PRO  HB3     3.99 #SUP  0.99  #QF  0.95
 22 PRO  HB3    32 PRO  HB3     4.13 #SUP  0.99  #QF  0.90
 25 ARG  HG2    32 PRO  HB3     4.73 #SUP  0.99  #QF  0.90
 32 PRO  HB3    33 TYR  HN      4.27 #SUP  1.00
 13 VAL  QG1    32 PRO  HB2     4.32 #SUP  0.99  #QF  0.96
 13 VAL  QG2    32 PRO  HB2     4.88 #SUP  0.99  #QF  0.96
 22 PRO  HD3    32 PRO  HB2     4.79 #SUP  0.99  #QF  0.57
 13 VAL  QG2    32 PRO  HG3     4.32 #SUP  1.00
 16 VAL  QG1    32 PRO  HG3     4.31 #SUP  0.95  #QF  0.89
 13 VAL  HA     32 PRO  HG3     5.45 #SUP  0.92  #QF  0.92
 31 VAL  HA     32 PRO  HG3     4.52 #SUP  0.93  #QF  0.93
 22 PRO  HB3    32 PRO  HG2     5.01 #SUP  0.95  #QF  0.95
 31 VAL  HA     32 PRO  HG2     4.55 #SUP  0.93  #QF  0.93
 16 VAL  QG1    32 PRO  HD3     3.78 #SUP  0.70  #QF  0.70
 31 VAL  HA     32 PRO  HD3     2.94 #SUP  0.98  #QF  0.98
 31 VAL  QG2    32 PRO  HD2     4.71 #SUP  0.98  #QF  0.98
 16 VAL  QG1    32 PRO  HD2     3.59 #SUP  0.99  #QF  0.89
 31 VAL  HB     32 PRO  HD2     3.26 #SUP  0.90  #QF  0.71
 31 VAL  HA     32 PRO  HD2     3.26 #SUP  0.99  #QF  0.99
 33 TYR  HA     34 CYSS HN      3.32 #SUP  0.94  #QF  0.94
 15 CYSS HB2    33 TYR  HA      4.16 #SUP  0.99  #QF  0.99
 15 CYSS HA     33 TYR  HA      3.35 #SUP  1.00
 15 CYSS HB3    33 TYR  HA      4.58 #SUP  0.96  #QF  0.96
 22 PRO  HB3    33 TYR  HA      4.64 #SUP  0.99  #QF  0.99
 33 TYR  HB2    34 CYSS HN      3.67 #SUP  0.91  #QF  0.91
 24 TYR  HN     33 TYR  QE      4.39 #SUP  0.83  #QF  0.83
 24 TYR  QD     33 TYR  QE      3.96 #SUP  1.00  #QF  0.99
 24 TYR  HB3    33 TYR  QE      4.22 #SUP  0.99  #QF  0.99
 24 TYR  HB2    33 TYR  QE      4.20 #SUP  0.99  #QF  0.99
 27 PRO  HD3    33 TYR  QE      4.12 #SUP  0.99  #QF  0.99
 34 CYSS HN     34 CYSS HB2     3.97 #SUP  0.92  #QF  0.92
 24 TYR  QD     35 SER  HA      4.01 #SUP  0.97  #QF  0.78
 36 VAL  HA     36 VAL  QG1     3.58 #SUP  0.69  #QF  0.69
 36 VAL  HA     39 PHE  HB2     3.86 #SUP  0.72  #QF  0.72
 36 VAL  HA     36 VAL  QG2     3.58 #SUP  0.94  #QF  0.94
 36 VAL  QG2    37 VAL  HN      4.09 #SUP  0.91  #QF  0.91
 37 VAL  HA     37 VAL  QG2     3.25 #SUP  0.91  #QF  0.91
 37 VAL  HA     40 ARG  HB2     3.59 #SUP  0.81  #QF  0.81
 37 VAL  HA     40 ARG  HN      4.39 #SUP  0.88  #QF  0.88
 37 VAL  HN     37 VAL  QG1     3.92 #SUP  0.98  #QF  0.98
 37 VAL  HA     37 VAL  QG1     3.08 #SUP  0.99  #QF  0.99
 37 VAL  HN     37 VAL  QG2     3.88 #SUP  0.95  #QF  0.95
 17 ILE  QG2    38 CYSS HA      3.52 #SUP  0.89  #QF  0.89
 17 ILE  HG13   38 CYSS HA      3.28 #SUP  0.57  #QF  0.57
 17 ILE  HB     38 CYSS HA      4.26 #SUP  0.94  #QF  0.94
 38 CYSS HA     41 LYS  HN      4.13 #SUP  0.71  #QF  0.71
 17 ILE  HG12   38 CYSS HB3     4.07 #SUP  1.00
 17 ILE  HG13   38 CYSS HB3     3.95 #SUP  0.97  #QF  0.97
 35 SER  HN     38 CYSS HB3     4.65 #SUP  1.00
 38 CYSS HN     38 CYSS HB3     3.87 #SUP  0.96  #QF  0.96
 38 CYSS HB3    39 PHE  HN      4.37 #SUP  1.00
 17 ILE  HG12   38 CYSS HB2     4.93 #SUP  1.00
 17 ILE  HG13   38 CYSS HB2     4.34 #SUP  0.99  #QF  0.99
 34 CYSS HN     38 CYSS HB2     4.48 #SUP  0.84  #QF  0.84
 39 PHE  HA     42 HIS  HB3     3.84 #SUP  0.88  #QF  0.88
 39 PHE  HA     39 PHE  QD      3.62 #SUP  0.99  #QF  0.99
 39 PHE  HA     43 LYS  HN      4.92 #SUP  0.62  #QF  0.62
 33 TYR  QE     39 PHE  HB2     4.44 #SUP  0.95  #QF  0.95
 39 PHE  HB2    40 ARG  HN      4.24 #SUP  0.95  #QF  0.95
 36 VAL  HA     39 PHE  HB3     3.86 #SUP  0.98  #QF  0.98
 33 TYR  QE     39 PHE  HB3     4.44 #SUP  0.97  #QF  0.97
 39 PHE  HB3    40 ARG  HN      4.24 #SUP  0.93  #QF  0.93
 39 PHE  HN     39 PHE  HB3     3.68 #SUP  0.98  #QF  0.98
 26 CYSS HB2    39 PHE  QD      4.05 #SUP  0.79  #QF  0.36
 26 CYSS HB2    39 PHE  QE      4.03 #SUP  0.84  #QF  0.84
 39 PHE  HA     39 PHE  QE      4.66 #SUP  0.97  #QF  0.97
 40 ARG  HA     43 LYS  HB3     4.00 #SUP  0.96  #QF  0.96
 40 ARG  HA     40 ARG  HG2     3.35 #SUP  1.00
 40 ARG  HA     40 ARG  HD2     5.46 #SUP  1.00  #QF  0.65
 40 ARG  HA     40 ARG  HD3     5.46 #SUP  1.00  #QF  0.65
 40 ARG  HN     40 ARG  HB2     3.53 #SUP  0.99  #QF  0.92
 40 ARG  HA     40 ARG  HG3     3.81 #SUP  0.98  #QF  0.98
 40 ARG  HN     40 ARG  HG3     4.36 #SUP  0.93  #QF  0.93
 40 ARG  HN     40 ARG  HG2     3.79 #SUP  0.94  #QF  0.94
 41 LYS  HA     44 GLU  HN      4.62 #SUP  0.98  #QF  0.98
 41 LYS  HN     41 LYS  HB2     3.38 #SUP  0.94  #QF  0.94
 41 LYS  HB2    42 HIS  HN      3.87 #SUP  0.97  #QF  0.90
 17 ILE  QD1    41 LYS  HB2     3.71 #SUP  0.59  #QF  0.59
 17 ILE  QG2    41 LYS  HB2     3.75 #SUP  0.82  #QF  0.82
 41 LYS  HN     41 LYS  HG2     4.21 #SUP  0.99  #QF  0.99
 41 LYS  HN     41 LYS  HG3     4.21 #SUP  0.97  #QF  0.97
 41 LYS  HN     41 LYS  HD2     5.34 #SUP  0.92  #QF  0.78
 41 LYS  HN     41 LYS  HD3     5.34 #SUP  0.92  #QF  0.78
 39 PHE  QE     42 HIS  HD2     4.33 #SUP  0.45  #QF  0.45
 31 VAL  QG2    42 HIS  HE1     4.45 #SUP  0.91  #QF  0.91
 31 VAL  QG1    42 HIS  HE1     4.45 #SUP  0.71  #QF  0.71
 43 LYS  HB3    44 GLU  HN      4.62 #SUP  0.80  #QF  0.80
 43 LYS  HN     43 LYS  HB3     3.85 #SUP  0.99  #QF  0.99
 43 LYS  HN     43 LYS  HB2     3.79 #SUP  0.99  #QF  0.99
 43 LYS  HA     43 LYS  HD2     4.37 #SUP  0.99  #QF  0.99
 43 LYS  HA     43 LYS  HD3     4.37 #SUP  0.99  #QF  0.99
 44 GLU  HA     44 GLU  HG3     3.94 #SUP  0.99  #QF  0.99
 44 GLU  HA     44 GLU  HG2     3.94 #SUP  1.00
 44 GLU  HN     44 GLU  HB3     3.77 #SUP  0.96  #QF  0.96
 44 GLU  HB3    45 GLN  HN      4.37 #SUP  0.99  #QF  0.99
 44 GLU  HN     44 GLU  HG2     4.01 #SUP  0.98  #QF  0.98
 44 GLU  HN     44 GLU  HG3     4.01 #SUP  0.96  #QF  0.96
 45 GLN  HB2    46 CYSS HN      4.61 #SUP  0.98  #QF  0.98
 45 GLN  HB3    46 CYSS HN      4.61 #SUP  0.99  #QF  0.99
 45 GLN  HA     45 GLN  HG2     4.25 #SUP  0.99  #QF  0.39
 45 GLN  HA     45 GLN  HG3     4.25 #SUP  0.99  #QF  0.39
 45 GLN  HG2    46 CYSS HN      5.50 #SUP  0.99  #QF  0.44
 45 GLN  HG3    46 CYSS HN      5.50 #SUP  0.99  #QF  0.44
 42 HIS  HE1    46 CYSS HA      4.31 #SUP  0.94  #QF  0.94
 43 LYS  HA     46 CYSS HB2     3.60 #SUP  0.99  #QF  0.99
 39 PHE  QE     46 CYSS HB2     5.18 #SUP  0.99  #QF  0.42
 45 GLN  HN     46 CYSS HB2     5.44 #SUP  0.99  #QF  0.42
 42 HIS  HE1    46 CYSS HB2     5.06 #SUP  0.93  #QF  0.93
 43 LYS  HA     46 CYSS HB3     3.60 #SUP  0.99  #QF  0.99
 39 PHE  QE     46 CYSS HB3     5.18 #SUP  0.97  #QF  0.21
 45 GLN  HN     46 CYSS HB3     5.44 #SUP  0.97  #QF  0.21
 47 ASN  HA     48 PRO  HD3     3.21 #SUP  0.98  #QF  0.98
 50 THR  HA     50 THR  QG2     3.67 #SUP  0.86  #QF  0.86
 16 VAL  HA     16 VAL  QG2     3.38 #SUP  0.98  #QF  0.98
 16 VAL  QG1    17 ILE  HA      5.50 #SUP  0.94  #QF  0.94
 16 VAL  HN     16 VAL  QG2     3.16 #SUP  0.96  #QF  0.96
 16 VAL  QG2    17 ILE  HN      3.65 #SUP  0.97  #QF  0.97
 16 VAL  QG2    17 ILE  QD1     3.02 #SUP  0.96  #QF  0.96
 16 VAL  QG2    17 ILE  HG12    3.42 #SUP  0.99  #QF  0.99
 16 VAL  QG2    17 ILE  HG13    3.89 #SUP  0.91  #QF  0.91
 16 VAL  QG2    42 HIS  HB2     3.94 #SUP  0.76  #QF  0.76
 16 VAL  QG2    32 PRO  HD2     3.82 #SUP  0.90  #QF  0.90
 36 VAL  HA     40 ARG  HN      4.56 #SUP  0.90  #QF  0.90
 39 PHE  HA     42 HIS  HN      4.71 #SUP  0.92  #QF  0.92
 39 PHE  HA     42 HIS  HB2     4.96 #SUP  0.21  #QF  0.21
 40 ARG  HA     43 LYS  HB2     3.80 #SUP  0.87  #QF  0.87
 26 CYSS HN     32 PRO  HA      4.76 #SUP  0.93  #QF  0.93
 23 LYS  HN     34 CYSS HA      4.36 #SUP  0.80  #QF  0.80
 47 ASN  HA     48 PRO  HD2     3.04 #SUP  0.85  #QF  0.85
 28 ALA  QB     48 PRO  HA      4.68 #SUP  0.93  #QF  0.93
 29 CYSS HB3    48 PRO  HA      4.36 #SUP  0.98  #QF  0.98
 29 CYSS HB2    48 PRO  HA      4.27 #SUP  0.99  #QF  0.99
 47 ASN  HA     48 PRO  HG3     4.86 #SUP  0.98  #QF  0.98
 28 ALA  QB     48 PRO  HD3     4.83 #SUP  0.94  #QF  0.94
 29 CYSS HB3    48 PRO  HD3     4.62 #SUP  0.56  #QF  0.56
 47 ASN  HN     48 PRO  HD3     4.87 #SUP  0.99  #QF  0.99
 28 ALA  QB     48 PRO  HD2     4.97 #SUP  0.77  #QF  0.77
 47 ASN  HB3    48 PRO  HD2     4.88 #SUP  0.95  #QF  0.95
 47 ASN  HN     48 PRO  HD2     5.00 #SUP  0.99  #QF  0.99
 47 ASN  HB2    48 PRO  HD2     4.88 #SUP  0.89  #QF  0.89
 26 CYSS HN     33 TYR  QE      4.39 #SUP  0.79  #QF  0.79
 25 ARG  HA     33 TYR  QE      5.00 #SUP  0.98  #QF  0.98
 33 TYR  QE     39 PHE  HN      5.00 #SUP  0.62  #QF  0.62
 16 VAL  HN     33 TYR  HA      4.46 #SUP  0.53  #QF  0.53
 33 TYR  HA     33 TYR  QD      4.80 #SUP  0.99  #QF  0.99
 17 ILE  HG13   33 TYR  HA      5.11 #SUP  0.45  #QF  0.45
 33 TYR  HB2    35 SER  HN      4.77 #SUP  0.98  #QF  0.98
 33 TYR  QE     36 VAL  HA      4.44 #SUP  0.82  #QF  0.82
 36 VAL  HA     39 PHE  QD      4.41 #SUP  0.98  #QF  0.98
 36 VAL  QG1    40 ARG  HG2     5.34 #SUP  0.65  #QF  0.65
 39 PHE  QD     40 ARG  HG2     5.01 #SUP  0.34  #QF  0.34
 27 PRO  HD3    39 PHE  HZ      5.18 #SUP  0.96  #QF  0.96
 25 ARG  HA     30 ARG  HA      5.04 #SUP  1.00
 25 ARG  HG2    30 ARG  HB3     5.50 #SUP  1.00  #QF  0.94
 29 CYSS HA     30 ARG  HB2     4.78 #SUP  0.95  #QF  0.76
 28 ALA  QB     29 CYSS HA      4.54 #SUP  0.99  #QF  0.99
 29 CYSS HA     30 ARG  HG2     5.50 #SUP  0.62  #QF  0.35
 29 CYSS HA     30 ARG  HG3     5.50 #SUP  0.62  #QF  0.35
 29 CYSS HB3    48 PRO  HG3     5.50 #SUP  0.95  #QF  0.95
 28 ALA  QB     29 CYSS HB2     4.97 #SUP  0.99  #QF  0.99
 29 CYSS HB2    30 ARG  HB2     5.05 #SUP  0.66  #QF  0.66
 28 ALA  QB     48 PRO  HG3     4.05 #SUP  0.93  #QF  0.93
 27 PRO  HA     30 ARG  HN      4.79 #SUP  0.73  #QF  0.73
 26 CYSS HA     27 PRO  HD2     3.23 #SUP  0.93  #QF  0.93
 27 PRO  HD2    39 PHE  QE      3.88 #SUP  0.97  #QF  0.97
 26 CYSS HA     27 PRO  HD3     3.15 #SUP  0.91  #QF  0.91
 25 ARG  HA     26 CYSS HB3     4.91 #SUP  0.95  #QF  0.95
 25 ARG  HA     32 PRO  HB3     5.50 #SUP  0.85  #QF  0.85
 25 ARG  HA     33 TYR  QD      4.66 #SUP  0.48  #QF  0.48
 25 ARG  HG2    26 CYSS HN      4.90 #SUP  0.90  #QF  0.90
 25 ARG  HN     25 ARG  HG2     4.97 #SUP  0.99  #QF  0.99
 25 ARG  HG2    30 ARG  HA      4.75 #SUP  0.94  #QF  0.94
 24 TYR  HA     25 ARG  HG3     4.24 #SUP  0.59  #QF  0.59
 24 TYR  HA     24 TYR  QD      3.33 #SUP  0.90  #QF  0.90
 24 TYR  QD     33 TYR  QD      4.62 #SUP  0.80  #QF  0.80
 23 LYS  HE2    24 TYR  QE      5.50 #SUP  0.95  #QF  0.84
 23 LYS  HE3    24 TYR  QE      5.50 #SUP  0.95  #QF  0.84
 24 TYR  QE     33 TYR  QE      4.81 #SUP  0.95  #QF  0.95
 24 TYR  HN     24 TYR  QE      4.53 #SUP  0.92  #QF  0.92
 23 LYS  HB2    23 LYS  HE2     5.50 #SUP  0.99  #QF  0.91
 23 LYS  HB2    23 LYS  HE3     5.50 #SUP  0.99  #QF  0.91
 23 LYS  HB3    23 LYS  HE2     5.50 #SUP  1.00  #QF  0.99
 23 LYS  HB3    23 LYS  HE3     5.50 #SUP  1.00  #QF  0.99
 22 PRO  HA     34 CYSS HN      4.57 #SUP  0.93  #QF  0.93
 15 CYSS HN     22 PRO  HG3     4.87 #SUP  0.94  #QF  0.94
 14 VAL  HN     22 PRO  HG3     4.94 #SUP  0.98  #QF  0.98
 21 LYS  HB3    21 LYS  HE2     5.50 #SUP  1.00  #QF  0.99
 21 LYS  HB3    21 LYS  HE3     5.50 #SUP  1.00  #QF  0.99
 21 LYS  HB2    21 LYS  HE2     5.50 #SUP  1.00  #QF  0.99
 21 LYS  HB2    21 LYS  HE3     5.50 #SUP  1.00  #QF  0.99
 21 LYS  HB2    22 PRO  HD3     5.43 #SUP  0.98  #QF  0.98
 21 LYS  HG2    22 PRO  HD3     5.21 #SUP  1.00
 21 LYS  HG3    22 PRO  HD3     5.21 #SUP  0.99  #QF  0.99
 18 CYSS HB2    19 LEU  HN      4.56 #SUP  0.97  #QF  0.97
 18 CYSS HB2    20 GLU  HN      5.04 #SUP  0.68  #QF  0.68
 18 CYSS HB3    19 LEU  HN      4.65 #SUP  0.88  #QF  0.88
 17 ILE  QG2    41 LYS  HN      5.42 #SUP  0.96  #QF  0.96
 17 ILE  QD1    18 CYSS HN      4.96 #SUP  0.99  #QF  0.99
 17 ILE  QD1    38 CYSS HB3     4.26 #SUP  0.96  #QF  0.96
 16 VAL  HB     32 PRO  HD2     5.50 #SUP  0.99  #QF  0.99
 16 VAL  HB     17 ILE  HN      4.84 #SUP  0.97  #QF  0.97
 16 VAL  QG2    33 TYR  HA      4.66 #SUP  0.99  #QF  0.99
 15 CYSS HB2    16 VAL  HN      4.76 #SUP  0.98  #QF  0.98
 15 CYSS HB3    22 PRO  HB3     5.05 #SUP  0.95  #QF  0.95
 14 VAL  QG2    15 CYSS HB3     4.84 #SUP  0.96  #QF  0.96
 13 VAL  HN     14 VAL  QG1     5.10 #SUP  0.75  #QF  0.75
 25 ARG  HD2    32 PRO  HB3     5.50 #SUP  0.98  #QF  0.74
 25 ARG  HD3    32 PRO  HB3     5.50 #SUP  0.98  #QF  0.74
 14 VAL  HN     32 PRO  HG3     4.72 #SUP  0.88  #QF  0.88
 16 VAL  HN     32 PRO  HG3     4.79 #SUP  0.83  #QF  0.83
 16 VAL  HN     32 PRO  HD3     5.49 #SUP  1.00  #QF  0.97
 31 VAL  HN     32 PRO  HD3     5.50 #SUP  1.00  #QF  0.97
 13 VAL  QG2    32 PRO  HD3     5.50 #SUP  0.93  #QF  0.78
 13 VAL  QG1    32 PRO  HD2     5.14 #SUP  1.00  #QF  0.98
 13 VAL  QG2    32 PRO  HD2     5.48 #SUP  1.00  #QF  0.98
 16 VAL  HN     32 PRO  HD2     4.61 #SUP  0.96  #QF  0.96
 17 ILE  HG12   33 TYR  HA      5.28 #SUP  0.98  #QF  0.91
 32 PRO  HB2    33 TYR  HA      5.50 #SUP  0.98  #QF  0.91
 17 ILE  QD1    33 TYR  HB2     5.35 #SUP  0.57  #QF  0.57
 33 TYR  QE     39 PHE  QD      4.53 #SUP  0.93  #QF  0.93
 34 CYSS HB3    35 SER  HN      4.96 #SUP  0.97  #QF  0.97
 33 TYR  HA     34 CYSS HB3     4.91 #SUP  0.93  #QF  0.93
 20 GLU  HB2    34 CYSS HB3     4.52 #SUP  0.71  #QF  0.71
 20 GLU  HB2    34 CYSS HB2     4.74 #SUP  0.74  #QF  0.74
 34 CYSS HB2    35 SER  HN      5.00 #SUP  0.97  #QF  0.97
 35 SER  HA     37 VAL  HN      4.83 #SUP  0.89  #QF  0.89
 37 VAL  QG2    40 ARG  HG3     4.66 #SUP  0.37  #QF  0.37
 37 VAL  QG2    40 ARG  HD2     5.50 #SUP  0.95  #QF  0.90
 37 VAL  QG2    40 ARG  HD3     5.50 #SUP  0.95  #QF  0.90
 17 ILE  QD1    38 CYSS HA      4.55 #SUP  1.00
 17 ILE  QG2    38 CYSS HB2     4.55 #SUP  0.61  #QF  0.61
 39 PHE  QD     40 ARG  HN      4.99 #SUP  0.70  #QF  0.70
 39 PHE  QE     43 LYS  HD2     4.78 #SUP  0.95  #QF  0.95
 27 PRO  HD3    39 PHE  QE      5.06 #SUP  0.99  #QF  0.99
 39 PHE  QE     43 LYS  HG2     5.50 #SUP  0.91  #QF  0.84
 39 PHE  QE     43 LYS  HG3     5.50 #SUP  0.91  #QF  0.84
 36 VAL  QG2    40 ARG  HG2     5.34 #SUP  0.87  #QF  0.87
 17 ILE  QD1    41 LYS  HG2     5.50 #SUP  0.84  #QF  0.27
 17 ILE  QD1    41 LYS  HG3     5.50 #SUP  0.84  #QF  0.27
 17 ILE  QD1    42 HIS  HA      3.98 #SUP  0.99  #QF  0.99
 42 HIS  HB2    43 LYS  HN      4.84 #SUP  0.99  #QF  0.99
 42 HIS  HD2    43 LYS  HB2     4.64 #SUP  0.82  #QF  0.76
 26 CYSS HB2    42 HIS  HD2     4.36 #SUP  0.50  #QF  0.50
 42 HIS  HD2    43 LYS  HA      4.56 #SUP  0.90  #QF  0.25
 31 VAL  HB     42 HIS  HE1     5.50 #SUP  0.99  #QF  0.90
 39 PHE  QE     43 LYS  HA      4.96 #SUP  0.99  #QF  0.70
 43 LYS  HB2    44 GLU  HN      4.95 #SUP  0.92  #QF  0.92
 39 PHE  QE     43 LYS  HD3     4.78 #SUP  0.94  #QF  0.94
 43 LYS  HB3    44 GLU  HA      4.78 #SUP  0.88  #QF  0.88
 42 HIS  HE1    46 CYSS HB3     5.06 #SUP  0.89  #QF  0.89
 47 ASN  HA     48 PRO  HG2     4.72 #SUP  0.98  #QF  0.98
 29 CYSS HA     48 PRO  HA      4.54 #SUP  0.96  #QF  0.96
 28 ALA  QB     48 PRO  HG2     5.04 #SUP  0.97  #QF  0.97
 16 VAL  QG2    42 HIS  HB3     5.50 #SUP  0.99  #QF  0.97
 17 ILE  HG13   42 HIS  HB2     5.17 #SUP  0.89  #QF  0.86
 41 LYS  HB2    42 HIS  HB2     5.50 #SUP  0.89  #QF  0.86
 25 ARG  HG3    32 PRO  HA      4.32 #SUP  0.97  #QF  0.46
 27 PRO  HD2    39 PHE  HZ      4.02 #SUP  0.83  #QF  0.83
 14 VAL  HB     19 LEU  QQD     4.61 
 16 VAL  HA     19 LEU  QQD     4.05 
 17 ILE  HN     19 LEU  QQD     4.81 
 17 ILE  QG2    41 LYS  QD      3.40 
 18 CYSS HB2    20 GLU  QG      4.26 
 19 LEU  HN     19 LEU  QQD     3.40 
 19 LEU  HA     19 LEU  QQD     3.06 
 19 LEU  HB2    19 LEU  QQD     2.96 
 20 GLU  HN     20 GLU  QG      3.39 
 20 GLU  HA     20 GLU  QG      3.30 
 20 GLU  HA     21 LYS  QB      4.84 
 20 GLU  HB3    21 LYS  QB      4.52 
 20 GLU  QG     21 LYS  HN      4.09 
 21 LYS  HN     21 LYS  QB      2.88 
 21 LYS  HN     21 LYS  QG      4.01 
 21 LYS  HA     21 LYS  QD      4.82 
 21 LYS  QB     21 LYS  QE      4.23 
 21 LYS  QB     22 PRO  HD2     3.85 
 21 LYS  QB     22 PRO  HD3     4.66 
 21 LYS  QG     22 PRO  HD3     4.50 
 23 LYS  HN     23 LYS  QG      4.90 
 23 LYS  HA     23 LYS  QG      3.31 
 23 LYS  HA     23 LYS  QD      4.63 
 23 LYS  QB     23 LYS  QD      3.30 
 23 LYS  QB     23 LYS  QE      4.26 
 23 LYS  QB     24 TYR  HN      3.79 
 23 LYS  QB     24 TYR  QD      3.77 
 23 LYS  QB     24 TYR  QE      4.47 
 23 LYS  QG     23 LYS  QE      3.33 
 23 LYS  QG     24 TYR  QE      4.21 
 23 LYS  QG     34 CYSS HA      4.32 
 23 LYS  QD     24 TYR  QD      4.38 
 23 LYS  QD     24 TYR  QE      4.72 
 25 ARG  HA     25 ARG  QD      4.41 
 25 ARG  QB     25 ARG  QD      3.08 
 25 ARG  QB     26 CYSS HN      4.16 
 25 ARG  QB     27 PRO  HA      5.34 
 25 ARG  QB     30 ARG  HA      3.49 
 25 ARG  QB     30 ARG  HB3     5.34 
 25 ARG  QB     33 TYR  QE      5.34 
 25 ARG  QD     30 ARG  HA      4.50 
 25 ARG  QD     30 ARG  HB2     4.82 
 25 ARG  QD     30 ARG  HB3     4.02 
 25 ARG  QD     32 PRO  HA      4.48 
 26 CYSS HB3    31 VAL  QQG     3.70 
 27 PRO  QB     28 ALA  HN      3.88 
 28 ALA  QB     48 PRO  QB      4.58 
 29 CYSS HA     48 PRO  QB      4.79 
 29 CYSS HB2    31 VAL  QQG     4.68 
 30 ARG  HN     30 ARG  QG      4.37 
 30 ARG  HB2    30 ARG  QD      3.70 
 30 ARG  HB3    30 ARG  QD      3.69 
 31 VAL  HN     31 VAL  QQG     3.47 
 31 VAL  QQG    32 PRO  HD2     3.74 
 31 VAL  QQG    32 PRO  HD3     4.22 
 31 VAL  QQG    42 HIS  HB2     5.32 
 31 VAL  QQG    42 HIS  HB3     5.44 
 31 VAL  QQG    42 HIS  HD2     5.29 
 33 TYR  QE     36 VAL  QQG     4.64 
 33 TYR  QE     39 PHE  QB      3.88 
 35 SER  HA     36 VAL  QQG     4.42 
 35 SER  QB     36 VAL  QQG     4.53 
 35 SER  QB     37 VAL  HN      3.43 
 35 SER  QB     37 VAL  HB      4.72 
 35 SER  QB     37 VAL  QG1     5.34 
 36 VAL  HA     36 VAL  QQG     3.01 
 36 VAL  HA     39 PHE  QB      3.19 
 36 VAL  QQG    37 VAL  HN      3.58 
 36 VAL  QQG    39 PHE  HN      4.40 
 36 VAL  QQG    39 PHE  QB      4.08 
 36 VAL  QQG    39 PHE  QD      4.68 
 36 VAL  QQG    40 ARG  HB2     5.03 
 36 VAL  QQG    40 ARG  HB3     5.44 
 36 VAL  QQG    40 ARG  HG2     4.23 
 36 VAL  QQG    40 ARG  HG3     4.81 
 36 VAL  QQG    40 ARG  QD      3.98 
 37 VAL  HA     40 ARG  QD      4.42 
 38 CYSS HA     41 LYS  QG      4.25 
 38 CYSS HA     41 LYS  QD      3.51 
 39 PHE  HN     39 PHE  QB      2.84 
 39 PHE  QE     43 LYS  QG      4.78 
 39 PHE  QE     43 LYS  QD      4.20 
 39 PHE  QE     46 CYSS QB      4.46 
 39 PHE  HZ     43 LYS  QD      4.60 
 40 ARG  HA     40 ARG  QD      4.78 
 40 ARG  HA     43 LYS  QG      4.84 
 40 ARG  HB3    40 ARG  QD      3.33 
 41 LYS  HN     41 LYS  QD      4.54 
 41 LYS  HA     41 LYS  QG      3.58 
 41 LYS  HA     41 LYS  QE      5.34 
 41 LYS  HA     44 GLU  QB      3.81 
 41 LYS  HA     44 GLU  QG      3.98 
 41 LYS  HB2    41 LYS  QD      3.58 
 41 LYS  HB3    41 LYS  QE      4.85 
 42 HIS  HD2    43 LYS  QG      5.34 
 42 HIS  HD2    46 CYSS QB      4.66 
 42 HIS  HE1    46 CYSS QB      4.23 
 43 LYS  HN     43 LYS  QG      4.52 
 43 LYS  HB2    46 CYSS QB      4.29 
 43 LYS  QD     46 CYSS QB      5.18 
 43 LYS  QE     46 CYSS QB      4.74 
 44 GLU  HN     44 GLU  QG      3.46 
 44 GLU  HA     44 GLU  QG      3.17 
 44 GLU  QB     45 GLN  HN      3.56 
 45 GLN  HN     45 GLN  QB      3.25 
 45 GLN  HN     45 GLN  QG      3.41 
 45 GLN  HA     45 GLN  QG      3.59 
 45 GLN  QG     46 CYSS HN      4.85 
 47 ASN  QB     48 PRO  HD2     4.10 
 49 GLU  HN     49 GLU  QB      3.68 
 49 GLU  HN     49 GLU  QG      3.80 
 49 GLU  HA     49 GLU  QG      3.66 
 52 GLY  QA     53 PRO  QD      3.12 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1   3.247  27.974  36.845
    2    HA2  GLY   1           1HA      GLY   1   5.114  26.023  37.068
    3    HA3  GLY   1           2HA      GLY   1   4.292  25.951  38.619
    4    H    SER   2           H        SER   2   3.556  26.045  35.135
    5    HA   SER   2           HA       SER   2   2.065  23.654  35.181
    6    HB2  SER   2           1HB      SER   2   0.562  25.432  36.401
    7    HB3  SER   2           2HB      SER   2   0.235  25.991  34.761
    8    HG   SER   2           HG       SER   2  -0.399  23.808  34.281
    9    H    SER   3           H        SER   3   1.879  22.889  33.157
   10    HA   SER   3           HA       SER   3   1.946  24.764  30.907
   11    HB2  SER   3           1HB      SER   3   3.677  23.428  29.770
   12    HB3  SER   3           2HB      SER   3   4.277  24.099  31.285
   13    HG   SER   3           HG       SER   3   3.858  21.475  30.555
   14    H    GLY   4           H        GLY   4   1.454  23.664  28.815
   15    HA2  GLY   4           1HA      GLY   4   0.288  21.067  28.799
   16    HA3  GLY   4           2HA      GLY   4  -0.954  22.306  28.906
   17    H    SER   5           H        SER   5   2.053  21.777  27.057
   18    HA   SER   5           HA       SER   5   0.605  22.680  24.656
   19    HB2  SER   5           1HB      SER   5   2.713  23.929  25.537
   20    HB3  SER   5           2HB      SER   5   3.603  22.572  24.847
   21    HG   SER   5           HG       SER   5   2.100  23.161  22.925
   22    H    SER   6           H        SER   6   0.237  21.252  23.097
   23    HA   SER   6           HA       SER   6   1.512  18.624  23.278
   24    HB2  SER   6           1HB      SER   6  -1.040  18.981  23.114
   25    HB3  SER   6           2HB      SER   6  -0.743  19.339  21.413
   26    HG   SER   6           HG       SER   6  -1.232  17.077  21.996
   27    H    GLY   7           H        GLY   7   3.351  18.460  22.165
   28    HA2  GLY   7           1HA      GLY   7   4.218  20.086  20.092
   29    HA3  GLY   7           2HA      GLY   7   4.806  18.456  20.389
   30    H    LEU   8           H        LEU   8   2.640  20.435  18.527
   31    HA   LEU   8           HA       LEU   8   1.077  18.598  17.216
   32    HB2  LEU   8           1HB      LEU   8   1.362  21.216  16.992
   33    HB3  LEU   8           2HB      LEU   8   2.336  20.754  15.598
   34    HG   LEU   8           HG       LEU   8  -0.055  21.342  15.105
   35   HD11  LEU   8          1HD1      LEU   8  -0.191  18.749  14.051
   36   HD12  LEU   8          2HD1      LEU   8   1.525  19.137  14.172
   37   HD13  LEU   8          3HD1      LEU   8   0.442  20.199  13.272
   38   HD21  LEU   8          3HD2      LEU   8  -0.984  18.683  15.907
   39   HD22  LEU   8          1HD2      LEU   8  -1.791  20.248  16.006
   40   HD23  LEU   8          2HD2      LEU   8  -0.638  19.771  17.252
   41    H    LYS   9           H        LYS   9   1.690  16.739  16.334
   42    HA   LYS   9           HA       LYS   9   4.018  16.755  14.530
   43    HB2  LYS   9           1HB      LYS   9   4.708  14.614  15.293
   44    HB3  LYS   9           2HB      LYS   9   4.430  15.584  16.733
   45    HG2  LYS   9           1HG      LYS   9   2.189  13.922  15.724
   46    HG3  LYS   9           2HG      LYS   9   3.539  13.110  16.519
   47    HD2  LYS   9           1HD      LYS   9   3.185  14.251  18.535
   48    HD3  LYS   9           2HD      LYS   9   2.181  15.481  17.764
   49    HE2  LYS   9           1HE      LYS   9   0.645  14.135  18.888
   50    HE3  LYS   9           2HE      LYS   9   0.579  13.548  17.227
   51    HZ1  LYS   9           3HZ      LYS   9   1.319  11.555  17.841
   52    HZ2  LYS   9           1HZ      LYS   9   0.980  12.018  19.433
   53    HZ3  LYS   9           2HZ      LYS   9   2.545  12.194  18.816
   54    H    CYS  10           H        CYS  10   3.972  14.921  12.952
   55    HA   CYS  10           HA       CYS  10   1.200  14.388  12.107
   56    HB2  CYS  10           1HB      CYS  10   1.940  14.443   9.815
   57    HB3  CYS  10           2HB      CYS  10   2.497  15.910  10.611
   58    HG   CYS  10           HG       CYS  10   4.394  13.186   9.792
   59    H    SER  11           H        SER  11   0.993  12.411  10.702
   60    HA   SER  11           HA       SER  11   2.493  10.226  11.955
   61    HB2  SER  11           1HB      SER  11  -0.039  10.065  10.306
   62    HB3  SER  11           2HB      SER  11   0.676   8.776  11.274
   63    HG   SER  11           HG       SER  11   0.356  10.246  13.106
   64    H    THR  12           H        THR  12   3.914   9.042  10.853
   65    HA   THR  12           HA       THR  12   3.935   9.267   7.913
   66    HB   THR  12           HB       THR  12   6.393   8.919   9.634
   67    HG1  THR  12           HG1      THR  12   6.434  11.021   9.842
   68   HG21  THR  12          3HG2      THR  12   6.076   8.343   7.007
   69   HG22  THR  12          1HG2      THR  12   7.598   8.874   7.723
   70   HG23  THR  12          2HG2      THR  12   6.550  10.039   6.913
   71    H    VAL  13           H        VAL  13   3.816   7.407   6.835
   72    HA   VAL  13           HA       VAL  13   4.395   4.911   8.294
   73    HB   VAL  13           HB       VAL  13   1.975   5.275   7.741
   74   HG11  VAL  13          1HG1      VAL  13   1.785   6.299   5.710
   75   HG12  VAL  13          2HG1      VAL  13   3.133   5.403   5.007
   76   HG13  VAL  13          3HG1      VAL  13   1.564   4.622   5.211
   77   HG21  VAL  13          3HG2      VAL  13   2.957   3.037   8.101
   78   HG22  VAL  13          1HG2      VAL  13   1.602   3.013   6.972
   79   HG23  VAL  13          2HG2      VAL  13   3.256   2.914   6.368
   80    H    VAL  14           H        VAL  14   5.082   3.091   6.938
   81    HA   VAL  14           HA       VAL  14   6.414   3.915   4.449
   82    HB   VAL  14           HB       VAL  14   8.386   2.575   5.038
   83   HG11  VAL  14          1HG1      VAL  14   7.578   5.041   6.293
   84   HG12  VAL  14          2HG1      VAL  14   8.714   4.157   7.313
   85   HG13  VAL  14          3HG1      VAL  14   9.153   4.569   5.655
   86   HG21  VAL  14          3HG2      VAL  14   7.309   2.403   7.839
   87   HG22  VAL  14          1HG2      VAL  14   7.079   1.113   6.659
   88   HG23  VAL  14          2HG2      VAL  14   8.708   1.581   7.148
   89    H    CYS  15           H        CYS  15   6.763   2.248   2.926
   90    HA   CYS  15           HA       CYS  15   4.805   0.558   2.302
   91    HB2  CYS  15           1HB      CYS  15   6.958   0.923   1.024
   92    HB3  CYS  15           2HB      CYS  15   7.685  -0.315   2.044
   93    H    VAL  16           H        VAL  16   3.787  -1.113   3.179
   94    HA   VAL  16           HA       VAL  16   4.745  -2.301   5.612
   95    HB   VAL  16           HB       VAL  16   2.681  -3.670   5.499
   96   HG11  VAL  16          1HG1      VAL  16   2.936  -0.951   5.973
   97   HG12  VAL  16          2HG1      VAL  16   1.502  -1.081   4.952
   98   HG13  VAL  16          3HG1      VAL  16   1.594  -1.982   6.466
   99   HG21  VAL  16          3HG2      VAL  16   1.112  -2.572   3.577
  100   HG22  VAL  16          1HG2      VAL  16   2.674  -2.615   2.758
  101   HG23  VAL  16          2HG2      VAL  16   1.976  -4.100   3.406
  102    H    ILE  17           H        ILE  17   5.968  -2.750   2.773
  103    HA   ILE  17           HA       ILE  17   6.119  -5.686   2.988
  104    HB   ILE  17           HB       ILE  17   6.559  -4.035   0.498
  105   HG12  ILE  17          1HG1      ILE  17   4.192  -4.049   1.249
  106   HG13  ILE  17          2HG1      ILE  17   4.423  -4.891  -0.280
  107   HG21  ILE  17          1HG2      ILE  17   6.215  -6.469  -0.452
  108   HG22  ILE  17          2HG2      ILE  17   7.795  -5.916   0.101
  109   HG23  ILE  17          3HG2      ILE  17   6.799  -6.927   1.147
  110   HD11  ILE  17          3HD1      ILE  17   4.528  -7.023   1.103
  111   HD12  ILE  17          1HD1      ILE  17   3.891  -6.051   2.430
  112   HD13  ILE  17          2HD1      ILE  17   2.959  -6.234   0.943
  113    H    CYS  18           H        CYS  18   7.986  -2.885   1.802
  114    HA   CYS  18           HA       CYS  18  10.438  -4.267   2.664
  115    HB2  CYS  18           1HB      CYS  18  11.643  -2.945   1.036
  116    HB3  CYS  18           2HB      CYS  18  10.280  -3.724   0.241
  117    H    LEU  19           H        LEU  19   8.402  -1.592   3.240
  118    HA   LEU  19           HA       LEU  19   8.452   0.024   4.848
  119    HB2  LEU  19           1HB      LEU  19  11.135  -1.029   5.698
  120    HB3  LEU  19           2HB      LEU  19   9.979  -0.104   6.654
  121    HG   LEU  19           HG       LEU  19   9.253  -2.829   5.651
  122   HD11  LEU  19          1HD1      LEU  19  11.302  -3.332   6.680
  123   HD12  LEU  19          2HD1      LEU  19  10.078  -3.649   7.910
  124   HD13  LEU  19          3HD1      LEU  19  11.033  -2.168   7.978
  125   HD21  LEU  19          3HD2      LEU  19   8.304  -0.893   7.679
  126   HD22  LEU  19          1HD2      LEU  19   8.192  -2.605   8.089
  127   HD23  LEU  19          2HD2      LEU  19   7.393  -1.991   6.641
  128    H    GLU  20           H        GLU  20   9.044   0.895   2.448
  129    HA   GLU  20           HA       GLU  20  11.247   2.786   2.902
  130    HB2  GLU  20           1HB      GLU  20  10.680   1.326   0.317
  131    HB3  GLU  20           2HB      GLU  20  11.843   2.630   0.503
  132    HG2  GLU  20           1HG      GLU  20  12.910   1.138   2.303
  133    HG3  GLU  20           2HG      GLU  20  11.955  -0.156   1.581
  134    H    LYS  21           H        LYS  21  11.068   4.772   1.665
  135    HA   LYS  21           HA       LYS  21   8.732   6.116   1.897
  136    HB2  LYS  21           1HB      LYS  21  11.044   6.432   0.034
  137    HB3  LYS  21           2HB      LYS  21   9.621   7.435  -0.220
  138    HG2  LYS  21           1HG      LYS  21   9.818   8.373   1.979
  139    HG3  LYS  21           2HG      LYS  21  11.132   7.264   2.378
  140    HD2  LYS  21           1HD      LYS  21  11.436   9.023  -0.005
  141    HD3  LYS  21           2HD      LYS  21  11.607   9.743   1.598
  142    HE2  LYS  21           1HE      LYS  21  13.771   9.119   1.219
  143    HE3  LYS  21           2HE      LYS  21  13.168   7.651   1.986
  144    HZ1  LYS  21           3HZ      LYS  21  13.608   6.505   0.158
  145    HZ2  LYS  21           1HZ      LYS  21  14.341   7.878  -0.506
  146    HZ3  LYS  21           2HZ      LYS  21  12.706   7.565  -0.804
  147    HA   PRO  22           HA       PRO  22   6.264   3.776  -1.086
  148    HB2  PRO  22           1HB      PRO  22   3.882   4.643  -0.113
  149    HB3  PRO  22           2HB      PRO  22   4.799   3.324   0.625
  150    HG2  PRO  22           1HG      PRO  22   4.643   6.203   1.429
  151    HG3  PRO  22           2HG      PRO  22   4.607   4.753   2.449
  152    HD2  PRO  22           1HD      PRO  22   6.838   6.253   2.129
  153    HD3  PRO  22           2HD      PRO  22   6.896   4.497   2.386
  154    H    LYS  23           H        LYS  23   6.090   4.563  -3.081
  155    HA   LYS  23           HA       LYS  23   5.752   7.381  -3.572
  156    HB2  LYS  23           1HB      LYS  23   5.901   5.030  -5.467
  157    HB3  LYS  23           2HB      LYS  23   5.867   6.716  -5.966
  158    HG2  LYS  23           1HG      LYS  23   7.970   7.117  -4.810
  159    HG3  LYS  23           2HG      LYS  23   8.001   5.437  -4.268
  160    HD2  LYS  23           1HD      LYS  23   9.424   5.550  -6.157
  161    HD3  LYS  23           2HD      LYS  23   7.933   4.782  -6.709
  162    HE2  LYS  23           1HE      LYS  23   7.215   6.730  -7.813
  163    HE3  LYS  23           2HE      LYS  23   8.388   7.740  -6.968
  164    HZ1  LYS  23           3HZ      LYS  23   8.980   7.253  -9.305
  165    HZ2  LYS  23           1HZ      LYS  23   9.118   5.615  -8.907
  166    HZ3  LYS  23           2HZ      LYS  23  10.157   6.747  -8.200
  167    H    TYR  24           H        TYR  24   3.782   4.486  -3.743
  168    HA   TYR  24           HA       TYR  24   1.424   6.176  -4.134
  169    HB2  TYR  24           1HB      TYR  24   1.516   3.570  -5.589
  170    HB3  TYR  24           2HB      TYR  24   0.601   5.026  -5.959
  171    HD1  TYR  24           HD1      TYR  24   3.945   3.466  -6.138
  172    HD2  TYR  24           HD2      TYR  24   1.487   6.704  -7.395
  173    HE1  TYR  24           HE1      TYR  24   5.641   4.100  -7.802
  174    HE2  TYR  24           HE2      TYR  24   3.176   7.346  -9.063
  175    HH   TYR  24           HH       TYR  24   6.269   5.632  -9.301
  176    H    ARG  25           H        ARG  25  -0.621   4.706  -3.893
  177    HA   ARG  25           HA       ARG  25  -0.167   2.713  -1.782
  178    HB2  ARG  25           1HB      ARG  25  -1.895   5.154  -1.686
  179    HB3  ARG  25           2HB      ARG  25  -2.399   3.712  -0.816
  180    HG2  ARG  25           1HG      ARG  25  -0.350   3.727   0.468
  181    HG3  ARG  25           2HG      ARG  25   0.242   5.111  -0.453
  182    HD2  ARG  25           1HD      ARG  25  -2.318   5.178   1.125
  183    HD3  ARG  25           2HD      ARG  25  -0.757   5.606   1.825
  184    HE   ARG  25           HE       ARG  25  -2.311   7.155  -0.053
  185   HH11  ARG  25          2HH1      ARG  25   0.818   6.617   1.376
  186   HH12  ARG  25          1HH1      ARG  25   1.397   8.211   1.025
  187   HH21  ARG  25          2HH2      ARG  25  -1.559   9.257  -0.522
  188   HH22  ARG  25          1HH2      ARG  25   0.045   9.713  -0.054
  189    H    CYS  26           H        CYS  26  -2.098   1.334  -1.397
  190    HA   CYS  26           HA       CYS  26  -3.110   0.373  -3.894
  191    HB2  CYS  26           1HB      CYS  26  -2.538  -1.157  -2.055
  192    HB3  CYS  26           2HB      CYS  26  -3.808  -0.445  -1.065
  193    HA   PRO  27           HA       PRO  27  -6.720   2.954  -3.987
  194    HB2  PRO  27           1HB      PRO  27  -7.896   1.755  -6.119
  195    HB3  PRO  27           2HB      PRO  27  -6.528   2.863  -6.274
  196    HG2  PRO  27           1HG      PRO  27  -6.552  -0.130  -6.288
  197    HG3  PRO  27           2HG      PRO  27  -5.651   0.986  -7.330
  198    HD2  PRO  27           1HD      PRO  27  -4.515  -0.273  -5.219
  199    HD3  PRO  27           2HD      PRO  27  -4.018   1.348  -5.744
  200    H    ALA  28           H        ALA  28  -6.495   0.030  -2.685
  201    HA   ALA  28           HA       ALA  28  -9.412  -0.348  -2.478
  202    HB1  ALA  28           3HB      ALA  28  -7.232  -2.414  -2.203
  203    HB2  ALA  28           1HB      ALA  28  -8.955  -2.707  -1.967
  204    HB3  ALA  28           2HB      ALA  28  -8.348  -2.243  -3.558
  205    H    CYS  29           H        CYS  29  -6.555  -1.341  -0.587
  206    HA   CYS  29           HA       CYS  29  -8.004  -0.697   1.864
  207    HB2  CYS  29           1HB      CYS  29  -6.011  -1.817   2.959
  208    HB3  CYS  29           2HB      CYS  29  -6.990  -2.848   1.921
  209    H    ARG  30           H        ARG  30  -5.757   0.713  -0.210
  210    HA   ARG  30           HA       ARG  30  -4.574   2.655  -0.117
  211    HB2  ARG  30           1HB      ARG  30  -5.914   3.039   2.567
  212    HB3  ARG  30           2HB      ARG  30  -5.086   4.279   1.633
  213    HG2  ARG  30           1HG      ARG  30  -7.443   2.796   0.525
  214    HG3  ARG  30           2HG      ARG  30  -7.635   4.219   1.551
  215    HD2  ARG  30           1HD      ARG  30  -5.875   5.224  -0.156
  216    HD3  ARG  30           2HD      ARG  30  -6.561   3.989  -1.210
  217    HE   ARG  30           HE       ARG  30  -8.743   5.239  -0.204
  218   HH11  ARG  30          2HH1      ARG  30  -5.859   6.350  -1.808
  219   HH12  ARG  30          1HH1      ARG  30  -6.633   7.719  -2.533
  220   HH21  ARG  30          2HH2      ARG  30  -9.773   7.039  -1.153
  221   HH22  ARG  30          1HH2      ARG  30  -8.859   8.111  -2.160
  222    H    VAL  31           H        VAL  31  -3.131   0.490   0.439
  223    HA   VAL  31           HA       VAL  31  -1.645   0.997   2.912
  224    HB   VAL  31           HB       VAL  31  -0.499  -1.150   2.414
  225   HG11  VAL  31          1HG1      VAL  31  -3.437  -0.922   2.802
  226   HG12  VAL  31          2HG1      VAL  31  -2.751  -2.529   2.559
  227   HG13  VAL  31          3HG1      VAL  31  -2.194  -1.525   3.898
  228   HG21  VAL  31          3HG2      VAL  31  -0.551  -1.948   0.339
  229   HG22  VAL  31          1HG2      VAL  31  -2.262  -2.313   0.566
  230   HG23  VAL  31          2HG2      VAL  31  -1.774  -0.768  -0.130
  231    HA   PRO  32           HA       PRO  32   1.708   2.950   0.843
  232    HB2  PRO  32           1HB      PRO  32   3.734   2.306   2.531
  233    HB3  PRO  32           2HB      PRO  32   2.492   3.499   2.932
  234    HG2  PRO  32           1HG      PRO  32   2.696   0.627   3.753
  235    HG3  PRO  32           2HG      PRO  32   2.247   2.040   4.726
  236    HD2  PRO  32           1HD      PRO  32   0.411   0.327   3.713
  237    HD3  PRO  32           2HD      PRO  32   0.084   2.058   3.931
  238    H    TYR  33           H        TYR  33   2.621   2.263  -0.980
  239    HA   TYR  33           HA       TYR  33   4.329  -0.102  -0.930
  240    HB2  TYR  33           1HB      TYR  33   3.196  -1.330  -2.491
  241    HB3  TYR  33           2HB      TYR  33   1.825  -0.512  -1.750
  242    HD1  TYR  33           HD2      TYR  33   4.292  -0.003  -4.513
  243    HD2  TYR  33           HD1      TYR  33   0.300   0.524  -3.140
  244    HE1  TYR  33           HE2      TYR  33   3.667   0.920  -6.705
  245    HE2  TYR  33           HE1      TYR  33  -0.337   1.447  -5.329
  246    HH   TYR  33           HH       TYR  33   0.398   1.443  -7.613
  247    H    CYS  34           H        CYS  34   6.180   0.313  -1.932
  248    HA   CYS  34           HA       CYS  34   6.702   2.778  -3.192
  249    HB2  CYS  34           1HB      CYS  34   8.835   1.486  -3.962
  250    HB3  CYS  34           2HB      CYS  34   8.591   1.813  -2.249
  251    H    SER  35           H        SER  35   7.115  -0.408  -4.724
  252    HA   SER  35           HA       SER  35   6.058   0.763  -7.214
  253    HB2  SER  35           1HB      SER  35   8.263  -1.253  -6.780
  254    HB3  SER  35           2HB      SER  35   7.497  -1.014  -8.350
  255    HG   SER  35           HG       SER  35   9.456   0.248  -7.921
  256    H    VAL  36           H        VAL  36   5.533  -1.242  -8.782
  257    HA   VAL  36           HA       VAL  36   3.182  -2.394  -7.796
  258    HB   VAL  36           HB       VAL  36   4.859  -3.313 -10.136
  259   HG11  VAL  36          1HG1      VAL  36   3.081  -4.893  -9.175
  260   HG12  VAL  36          2HG1      VAL  36   1.908  -3.732  -9.799
  261   HG13  VAL  36          3HG1      VAL  36   3.024  -4.539 -10.901
  262   HG21  VAL  36          3HG2      VAL  36   2.732  -1.992 -11.185
  263   HG22  VAL  36          1HG2      VAL  36   3.032  -1.051  -9.724
  264   HG23  VAL  36          2HG2      VAL  36   4.318  -1.271 -10.910
  265    H    VAL  37           H        VAL  37   6.453  -3.704  -8.088
  266    HA   VAL  37           HA       VAL  37   6.134  -6.351  -7.603
  267    HB   VAL  37           HB       VAL  37   8.193  -4.572  -6.289
  268   HG11  VAL  37          1HG1      VAL  37   7.738  -7.464  -6.215
  269   HG12  VAL  37          2HG1      VAL  37   9.380  -6.998  -6.663
  270   HG13  VAL  37          3HG1      VAL  37   8.687  -6.435  -5.142
  271   HG21  VAL  37          3HG2      VAL  37   9.532  -5.737  -8.264
  272   HG22  VAL  37          1HG2      VAL  37   7.925  -5.776  -8.989
  273   HG23  VAL  37          2HG2      VAL  37   8.635  -4.237  -8.501
  274    H    CYS  38           H        CYS  38   6.735  -4.077  -4.920
  275    HA   CYS  38           HA       CYS  38   6.078  -5.792  -2.851
  276    HB2  CYS  38           1HB      CYS  38   6.113  -2.820  -3.151
  277    HB3  CYS  38           2HB      CYS  38   5.392  -3.508  -1.699
  278    H    PHE  39           H        PHE  39   3.988  -3.881  -4.908
  279    HA   PHE  39           HA       PHE  39   1.629  -4.192  -3.347
  280    HB2  PHE  39           1HB      PHE  39   1.699  -2.376  -4.898
  281    HB3  PHE  39           2HB      PHE  39   2.081  -3.452  -6.238
  282    HD1  PHE  39           HD1      PHE  39  -0.575  -3.030  -3.649
  283    HD2  PHE  39           HD2      PHE  39   0.384  -3.946  -7.694
  284    HE1  PHE  39           HE1      PHE  39  -2.972  -3.222  -4.171
  285    HE2  PHE  39           HE2      PHE  39  -2.011  -4.138  -8.222
  286    HZ   PHE  39           HZ       PHE  39  -3.692  -3.775  -6.460
  287    H    ARG  40           H        ARG  40   3.230  -6.118  -5.761
  288    HA   ARG  40           HA       ARG  40   1.107  -7.754  -6.570
  289    HB2  ARG  40           1HB      ARG  40   4.058  -8.357  -6.334
  290    HB3  ARG  40           2HB      ARG  40   2.898  -9.416  -7.124
  291    HG2  ARG  40           1HG      ARG  40   2.337  -7.347  -8.563
  292    HG3  ARG  40           2HG      ARG  40   3.883  -6.728  -7.978
  293    HD2  ARG  40           1HD      ARG  40   3.500  -9.380  -9.360
  294    HD3  ARG  40           2HD      ARG  40   4.051  -7.905 -10.152
  295    HE   ARG  40           HE       ARG  40   5.731  -8.371  -7.982
  296   HH11  ARG  40          2HH1      ARG  40   4.894  -9.870 -11.011
  297   HH12  ARG  40          1HH1      ARG  40   6.446 -10.609 -11.224
  298   HH21  ARG  40          2HH2      ARG  40   7.779  -9.339  -8.251
  299   HH22  ARG  40          1HH2      ARG  40   8.086 -10.307  -9.653
  300    H    LYS  41           H        LYS  41   3.662  -8.591  -4.222
  301    HA   LYS  41           HA       LYS  41   2.536 -10.910  -3.238
  302    HB2  LYS  41           1HB      LYS  41   4.138  -8.881  -1.670
  303    HB3  LYS  41           2HB      LYS  41   3.906 -10.569  -1.236
  304    HG2  LYS  41           1HG      LYS  41   5.214 -11.319  -3.050
  305    HG3  LYS  41           2HG      LYS  41   5.205  -9.725  -3.809
  306    HD2  LYS  41           1HD      LYS  41   7.343 -10.007  -2.804
  307    HD3  LYS  41           2HD      LYS  41   6.444  -8.873  -1.793
  308    HE2  LYS  41           1HE      LYS  41   7.482 -10.360  -0.295
  309    HE3  LYS  41           2HE      LYS  41   5.799 -10.879  -0.377
  310    HZ1  LYS  41           3HZ      LYS  41   8.190 -12.171  -1.513
  311    HZ2  LYS  41           1HZ      LYS  41   6.669 -12.461  -2.193
  312    HZ3  LYS  41           2HZ      LYS  41   6.957 -12.847  -0.572
  313    H    HIS  42           H        HIS  42   1.654  -7.615  -2.609
  314    HA   HIS  42           HA       HIS  42   0.112  -8.176  -0.251
  315    HB2  HIS  42           1HB      HIS  42   0.774  -5.973  -0.232
  316    HB3  HIS  42           2HB      HIS  42   0.601  -5.794  -1.976
  317    HD1  HIS  42           HD1      HIS  42  -1.640  -6.155   1.076
  318    HD2  HIS  42           HD2      HIS  42  -1.627  -4.441  -2.709
  319    HE1  HIS  42           HE1      HIS  42  -3.783  -4.849   0.922
  320    H    LYS  43           H        LYS  43  -0.897  -6.944  -3.445
  321    HA   LYS  43           HA       LYS  43  -3.551  -7.150  -3.374
  322    HB2  LYS  43           1HB      LYS  43  -2.296  -6.566  -5.404
  323    HB3  LYS  43           2HB      LYS  43  -1.851  -8.254  -5.620
  324    HG2  LYS  43           1HG      LYS  43  -3.608  -8.047  -7.079
  325    HG3  LYS  43           2HG      LYS  43  -4.423  -8.649  -5.634
  326    HD2  LYS  43           1HD      LYS  43  -4.163  -5.707  -5.959
  327    HD3  LYS  43           2HD      LYS  43  -5.322  -6.550  -6.989
  328    HE2  LYS  43           1HE      LYS  43  -6.037  -7.655  -4.711
  329    HE3  LYS  43           2HE      LYS  43  -5.299  -6.207  -4.028
  330    HZ1  LYS  43           3HZ      LYS  43  -7.698  -5.970  -4.445
  331    HZ2  LYS  43           1HZ      LYS  43  -7.425  -6.191  -6.100
  332    HZ3  LYS  43           2HZ      LYS  43  -6.778  -4.844  -5.309
  333    H    GLU  44           H        GLU  44  -1.378  -9.924  -3.675
  334    HA   GLU  44           HA       GLU  44  -3.086 -11.980  -4.187
  335    HB2  GLU  44           1HB      GLU  44  -0.748 -11.867  -2.288
  336    HB3  GLU  44           2HB      GLU  44  -1.598 -13.363  -2.645
  337    HG2  GLU  44           1HG      GLU  44  -1.117 -12.793  -5.108
  338    HG3  GLU  44           2HG      GLU  44   0.076 -11.673  -4.454
  339    H    GLN  45           H        GLN  45  -2.427 -10.606  -0.970
  340    HA   GLN  45           HA       GLN  45  -4.928 -11.851  -0.033
  341    HB2  GLN  45           1HB      GLN  45  -2.366 -11.299   1.464
  342    HB3  GLN  45           2HB      GLN  45  -3.875 -11.726   2.261
  343    HG2  GLN  45           1HG      GLN  45  -3.859 -13.799   0.759
  344    HG3  GLN  45           2HG      GLN  45  -2.169 -13.399   0.459
  345   HE21  GLN  45          1HE2      GLN  45  -4.292 -15.029   2.445
  346   HE22  GLN  45          2HE2      GLN  45  -3.233 -15.335   3.775
  347    H    CYS  46           H        CYS  46  -4.384  -9.183  -1.285
  348    HA   CYS  46           HA       CYS  46  -4.474  -7.117   0.582
  349    HB2  CYS  46           1HB      CYS  46  -4.111  -6.418  -1.611
  350    HB3  CYS  46           2HB      CYS  46  -5.432  -7.394  -2.246
  351    H    ASN  47           H        ASN  47  -5.848  -7.064   2.245
  352    HA   ASN  47           HA       ASN  47  -8.683  -7.673   1.739
  353    HB2  ASN  47           1HB      ASN  47  -8.004  -9.158   3.408
  354    HB3  ASN  47           2HB      ASN  47  -6.948  -7.973   4.170
  355   HD21  ASN  47          1HD2      ASN  47  -7.954  -8.549   6.158
  356   HD22  ASN  47          2HD2      ASN  47  -9.492  -7.886   6.583
  357    HA   PRO  48           HA       PRO  48  -8.932  -3.184   2.246
  358    HB2  PRO  48           1HB      PRO  48 -11.408  -2.988   1.150
  359    HB3  PRO  48           2HB      PRO  48  -9.935  -3.102   0.180
  360    HG2  PRO  48           1HG      PRO  48 -11.898  -5.243   0.903
  361    HG3  PRO  48           2HG      PRO  48 -11.113  -4.925  -0.654
  362    HD2  PRO  48           1HD      PRO  48 -10.266  -6.865   1.035
  363    HD3  PRO  48           2HD      PRO  48  -9.157  -5.971  -0.025
  364    H    GLU  49           H        GLU  49 -10.979  -1.845   3.017
  365    HA   GLU  49           HA       GLU  49 -11.529  -2.711   5.663
  366    HB2  GLU  49           1HB      GLU  49 -12.780  -0.469   4.067
  367    HB3  GLU  49           2HB      GLU  49 -12.938  -0.692   5.804
  368    HG2  GLU  49           1HG      GLU  49 -10.712  -0.142   6.202
  369    HG3  GLU  49           2HG      GLU  49 -10.249  -0.408   4.522
  370    H    THR  50           H        THR  50 -12.761  -4.482   5.921
  371    HA   THR  50           HA       THR  50 -14.848  -5.322   4.266
  372    HB   THR  50           HB       THR  50 -15.557  -6.760   6.159
  373    HG1  THR  50           HG1      THR  50 -13.879  -6.549   7.992
  374   HG21  THR  50          3HG2      THR  50 -13.528  -8.075   6.290
  375   HG22  THR  50          1HG2      THR  50 -12.560  -6.687   5.796
  376   HG23  THR  50          2HG2      THR  50 -13.695  -7.419   4.662
  377    H    SER  51           H        SER  51 -17.092  -5.196   4.439
  378    HA   SER  51           HA       SER  51 -18.162  -2.723   5.180
  379    HB2  SER  51           1HB      SER  51 -19.080  -4.622   3.601
  380    HB3  SER  51           2HB      SER  51 -19.915  -5.150   5.062
  381    HG   SER  51           HG       SER  51 -21.214  -3.500   4.906
  382    H    GLY  52           H        GLY  52 -19.381  -2.028   6.918
  383    HA2  GLY  52           1HA      GLY  52 -20.505  -2.286   8.986
  384    HA3  GLY  52           2HA      GLY  52 -19.754  -3.864   9.169
  385    HA   PRO  53           HA       PRO  53 -17.558  -0.662  11.805
  386    HB2  PRO  53           1HB      PRO  53 -17.975  -1.908  14.181
  387    HB3  PRO  53           2HB      PRO  53 -19.109  -0.735  13.499
  388    HG2  PRO  53           1HG      PRO  53 -19.218  -3.726  13.447
  389    HG3  PRO  53           2HG      PRO  53 -20.522  -2.564  13.754
  390    HD2  PRO  53           1HD      PRO  53 -20.184  -3.776  11.356
  391    HD3  PRO  53           2HD      PRO  53 -20.833  -2.131  11.511
  392    H    SER  54           H        SER  54 -15.425  -0.936  11.785
  393    HA   SER  54           HA       SER  54 -14.321  -3.548  12.562
  394    HB2  SER  54           1HB      SER  54 -12.537  -3.188  10.812
  395    HB3  SER  54           2HB      SER  54 -14.146  -3.519  10.171
  396    HG   SER  54           HG       SER  54 -14.353  -1.160  10.029
  397    H    SER  55           H        SER  55 -13.475  -0.155  11.885
  398    HA   SER  55           HA       SER  55 -11.879  -0.139  14.348
  399    HB2  SER  55           1HB      SER  55 -10.009   0.906  13.304
  400    HB3  SER  55           2HB      SER  55 -10.424  -0.475  12.288
  401    HG   SER  55           HG       SER  55 -10.908   0.840  10.719
  402    H    GLY  56           H        GLY  56 -11.844   1.800  15.451
  403    HA2  GLY  56           1HA      GLY  56 -12.570   4.305  14.467
  404    HA3  GLY  56           2HA      GLY  56 -14.040   3.538  15.051
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1   5.023  25.680  37.960
    2    HA2  GLY   1           1HA      GLY   1   6.011  23.660  37.303
    3    HA3  GLY   1           2HA      GLY   1   4.478  23.096  37.950
    4    H    SER   2           H        SER   2   6.477  23.193  35.248
    5    HA   SER   2           HA       SER   2   4.500  23.007  33.201
    6    HB2  SER   2           1HB      SER   2   6.296  22.574  31.713
    7    HB3  SER   2           2HB      SER   2   6.955  23.675  32.923
    8    HG   SER   2           HG       SER   2   7.424  20.929  32.565
    9    H    SER   3           H        SER   3   3.857  21.173  32.021
   10    HA   SER   3           HA       SER   3   4.564  18.539  33.012
   11    HB2  SER   3           1HB      SER   3   2.768  18.996  34.519
   12    HB3  SER   3           2HB      SER   3   1.770  19.669  33.229
   13    HG   SER   3           HG       SER   3   2.652  17.030  32.978
   14    H    GLY   4           H        GLY   4   4.988  17.412  31.240
   15    HA2  GLY   4           1HA      GLY   4   3.315  16.602  29.290
   16    HA3  GLY   4           2HA      GLY   4   3.838  18.170  28.692
   17    H    SER   5           H        SER   5   4.300  15.642  27.438
   18    HA   SER   5           HA       SER   5   6.903  14.668  27.927
   19    HB2  SER   5           1HB      SER   5   4.914  14.414  25.721
   20    HB3  SER   5           2HB      SER   5   6.583  13.963  25.375
   21    HG   SER   5           HG       SER   5   6.495  12.438  26.984
   22    H    SER   6           H        SER   6   5.741  16.703  25.234
   23    HA   SER   6           HA       SER   6   6.745  18.396  24.082
   24    HB2  SER   6           1HB      SER   6   7.544  19.007  26.475
   25    HB3  SER   6           2HB      SER   6   9.091  18.331  25.965
   26    HG   SER   6           HG       SER   6   7.684  20.415  24.644
   27    H    GLY   7           H        GLY   7   7.082  15.775  23.247
   28    HA2  GLY   7           1HA      GLY   7   9.902  15.574  22.450
   29    HA3  GLY   7           2HA      GLY   7   8.711  14.286  22.345
   30    H    LEU   8           H        LEU   8   9.378  13.938  20.165
   31    HA   LEU   8           HA       LEU   8   8.149  15.854  18.304
   32    HB2  LEU   8           1HB      LEU   8  10.874  14.630  18.199
   33    HB3  LEU   8           2HB      LEU   8  10.036  15.043  16.705
   34    HG   LEU   8           HG       LEU   8   9.814  17.397  17.818
   35   HD11  LEU   8          1HD1      LEU   8  10.636  16.870  19.997
   36   HD12  LEU   8          2HD1      LEU   8  11.824  17.903  19.202
   37   HD13  LEU   8          3HD1      LEU   8  12.110  16.167  19.330
   38   HD21  LEU   8          3HD2      LEU   8  12.571  16.649  16.920
   39   HD22  LEU   8          1HD2      LEU   8  11.641  18.107  16.576
   40   HD23  LEU   8          2HD2      LEU   8  11.208  16.583  15.802
   41    H    LYS   9           H        LYS   9   7.186  14.970  16.471
   42    HA   LYS   9           HA       LYS   9   7.252  12.094  16.074
   43    HB2  LYS   9           1HB      LYS   9   4.910  13.569  17.166
   44    HB3  LYS   9           2HB      LYS   9   4.593  12.320  15.970
   45    HG2  LYS   9           1HG      LYS   9   5.542  10.639  17.336
   46    HG3  LYS   9           2HG      LYS   9   6.233  11.830  18.440
   47    HD2  LYS   9           1HD      LYS   9   4.062  12.450  19.236
   48    HD3  LYS   9           2HD      LYS   9   3.272  11.478  17.993
   49    HE2  LYS   9           1HE      LYS   9   5.130  10.233  19.990
   50    HE3  LYS   9           2HE      LYS   9   3.438  10.532  20.385
   51    HZ1  LYS   9           3HZ      LYS   9   4.353   8.953  18.043
   52    HZ2  LYS   9           1HZ      LYS   9   2.759   9.146  18.575
   53    HZ3  LYS   9           2HZ      LYS   9   3.865   8.279  19.516
   54    H    CYS  10           H        CYS  10   6.151  11.436  14.085
   55    HA   CYS  10           HA       CYS  10   5.469  13.560  12.220
   56    HB2  CYS  10           1HB      CYS  10   7.919  11.874  12.032
   57    HB3  CYS  10           2HB      CYS  10   7.053  12.229  10.542
   58    HG   CYS  10           HG       CYS  10   7.497  14.865  10.484
   59    H    SER  11           H        SER  11   3.542  12.922  11.522
   60    HA   SER  11           HA       SER  11   2.693  10.210  11.501
   61    HB2  SER  11           1HB      SER  11   1.295  12.418  11.665
   62    HB3  SER  11           2HB      SER  11   1.311  12.342   9.903
   63    HG   SER  11           HG       SER  11   0.675   9.973  11.158
   64    H    THR  12           H        THR  12   4.342   9.205  10.223
   65    HA   THR  12           HA       THR  12   3.707   9.274   7.374
   66    HB   THR  12           HB       THR  12   5.601  10.785   7.526
   67    HG1  THR  12           HG1      THR  12   5.451   8.879   5.915
   68   HG21  THR  12          3HG2      THR  12   6.564  10.048   9.629
   69   HG22  THR  12          1HG2      THR  12   7.786   9.983   8.360
   70   HG23  THR  12          2HG2      THR  12   7.008   8.499   8.912
   71    H    VAL  13           H        VAL  13   3.658   7.294   6.492
   72    HA   VAL  13           HA       VAL  13   4.726   5.063   8.094
   73    HB   VAL  13           HB       VAL  13   2.249   5.100   7.800
   74   HG11  VAL  13          1HG1      VAL  13   2.064   4.076   5.169
   75   HG12  VAL  13          2HG1      VAL  13   1.368   5.564   5.815
   76   HG13  VAL  13          3HG1      VAL  13   2.975   5.583   5.088
   77   HG21  VAL  13          3HG2      VAL  13   3.140   2.709   6.297
   78   HG22  VAL  13          1HG2      VAL  13   3.893   3.000   7.865
   79   HG23  VAL  13          2HG2      VAL  13   2.141   2.832   7.745
   80    H    VAL  14           H        VAL  14   5.612   3.245   6.956
   81    HA   VAL  14           HA       VAL  14   6.682   3.953   4.301
   82    HB   VAL  14           HB       VAL  14   8.662   2.605   4.828
   83   HG11  VAL  14          1HG1      VAL  14   9.722   4.157   6.322
   84   HG12  VAL  14          2HG1      VAL  14   8.590   5.046   5.302
   85   HG13  VAL  14          3HG1      VAL  14   8.164   4.666   6.971
   86   HG21  VAL  14          3HG2      VAL  14   9.016   1.971   7.247
   87   HG22  VAL  14          1HG2      VAL  14   7.292   2.256   7.485
   88   HG23  VAL  14          2HG2      VAL  14   7.833   1.003   6.367
   89    H    CYS  15           H        CYS  15   7.184   2.126   2.892
   90    HA   CYS  15           HA       CYS  15   5.113   0.487   2.313
   91    HB2  CYS  15           1HB      CYS  15   7.255   0.824   0.987
   92    HB3  CYS  15           2HB      CYS  15   7.970  -0.430   1.994
   93    H    VAL  16           H        VAL  16   4.149  -1.233   3.175
   94    HA   VAL  16           HA       VAL  16   5.153  -2.351   5.633
   95    HB   VAL  16           HB       VAL  16   3.087  -3.755   5.549
   96   HG11  VAL  16          1HG1      VAL  16   1.858  -2.088   6.456
   97   HG12  VAL  16          2HG1      VAL  16   3.367  -1.188   6.291
   98   HG13  VAL  16          3HG1      VAL  16   2.097  -1.014   5.079
   99   HG21  VAL  16          3HG2      VAL  16   1.652  -3.784   3.792
  100   HG22  VAL  16          1HG2      VAL  16   2.004  -2.117   3.336
  101   HG23  VAL  16          2HG2      VAL  16   3.123  -3.407   2.895
  102    H    ILE  17           H        ILE  17   6.435  -2.831   2.885
  103    HA   ILE  17           HA       ILE  17   6.577  -5.765   3.127
  104    HB   ILE  17           HB       ILE  17   6.964  -4.233   0.558
  105   HG12  ILE  17          1HG1      ILE  17   4.626  -4.059   1.377
  106   HG13  ILE  17          2HG1      ILE  17   4.756  -4.987  -0.113
  107   HG21  ILE  17          1HG2      ILE  17   8.130  -6.292   0.489
  108   HG22  ILE  17          2HG2      ILE  17   6.790  -7.157   1.239
  109   HG23  ILE  17          3HG2      ILE  17   6.631  -6.542  -0.406
  110   HD11  ILE  17          3HD1      ILE  17   4.647  -7.061   1.217
  111   HD12  ILE  17          1HD1      ILE  17   4.407  -6.084   2.666
  112   HD13  ILE  17          2HD1      ILE  17   3.206  -6.056   1.374
  113    H    CYS  18           H        CYS  18   8.343  -2.954   1.819
  114    HA   CYS  18           HA       CYS  18  10.856  -4.286   2.577
  115    HB2  CYS  18           1HB      CYS  18  11.954  -2.843   0.934
  116    HB3  CYS  18           2HB      CYS  18  10.651  -3.759   0.184
  117    H    LEU  19           H        LEU  19   8.776  -1.715   3.336
  118    HA   LEU  19           HA       LEU  19   8.868  -0.128   4.970
  119    HB2  LEU  19           1HB      LEU  19  11.655  -1.062   5.596
  120    HB3  LEU  19           2HB      LEU  19  10.532  -0.212   6.654
  121    HG   LEU  19           HG       LEU  19   9.975  -2.990   5.650
  122   HD11  LEU  19          1HD1      LEU  19  10.824  -3.716   7.913
  123   HD12  LEU  19          2HD1      LEU  19  11.595  -2.135   8.034
  124   HD13  LEU  19          3HD1      LEU  19  12.054  -3.243   6.741
  125   HD21  LEU  19          3HD2      LEU  19   9.068  -1.672   8.192
  126   HD22  LEU  19          1HD2      LEU  19   8.396  -3.086   7.381
  127   HD23  LEU  19          2HD2      LEU  19   8.190  -1.484   6.674
  128    H    GLU  20           H        GLU  20   9.229   0.823   2.559
  129    HA   GLU  20           HA       GLU  20  11.354   2.820   2.894
  130    HB2  GLU  20           1HB      GLU  20  10.719   1.330   0.343
  131    HB3  GLU  20           2HB      GLU  20  11.780   2.728   0.442
  132    HG2  GLU  20           1HG      GLU  20  13.104   1.349   2.153
  133    HG3  GLU  20           2HG      GLU  20  12.202  -0.029   1.525
  134    H    LYS  21           H        LYS  21  11.001   4.775   1.578
  135    HA   LYS  21           HA       LYS  21   8.532   5.925   1.987
  136    HB2  LYS  21           1HB      LYS  21  10.867   6.911   1.213
  137    HB3  LYS  21           2HB      LYS  21  10.123   6.813  -0.377
  138    HG2  LYS  21           1HG      LYS  21   8.486   8.370   0.151
  139    HG3  LYS  21           2HG      LYS  21   8.699   8.149   1.889
  140    HD2  LYS  21           1HD      LYS  21   9.794  10.135   1.630
  141    HD3  LYS  21           2HD      LYS  21  11.136   9.029   1.327
  142    HE2  LYS  21           1HE      LYS  21  10.639   9.197  -1.105
  143    HE3  LYS  21           2HE      LYS  21   9.425  10.420  -0.731
  144    HZ1  LYS  21           3HZ      LYS  21  12.295  10.652  -0.835
  145    HZ2  LYS  21           1HZ      LYS  21  11.608  11.355   0.543
  146    HZ3  LYS  21           2HZ      LYS  21  11.106  11.845  -0.996
  147    HA   PRO  22           HA       PRO  22   6.245   3.649  -1.156
  148    HB2  PRO  22           1HB      PRO  22   3.805   4.447  -0.274
  149    HB3  PRO  22           2HB      PRO  22   4.721   3.140   0.487
  150    HG2  PRO  22           1HG      PRO  22   4.463   6.005   1.316
  151    HG3  PRO  22           2HG      PRO  22   4.418   4.542   2.317
  152    HD2  PRO  22           1HD      PRO  22   6.625   6.097   2.109
  153    HD3  PRO  22           2HD      PRO  22   6.714   4.340   2.347
  154    H    LYS  23           H        LYS  23   5.942   4.387  -3.153
  155    HA   LYS  23           HA       LYS  23   5.664   7.221  -3.648
  156    HB2  LYS  23           1HB      LYS  23   5.765   4.887  -5.569
  157    HB3  LYS  23           2HB      LYS  23   5.822   6.584  -6.027
  158    HG2  LYS  23           1HG      LYS  23   7.928   6.859  -4.866
  159    HG3  LYS  23           2HG      LYS  23   7.860   5.187  -4.305
  160    HD2  LYS  23           1HD      LYS  23   7.732   4.570  -6.796
  161    HD3  LYS  23           2HD      LYS  23   8.279   6.222  -7.092
  162    HE2  LYS  23           1HE      LYS  23  10.348   5.846  -6.152
  163    HE3  LYS  23           2HE      LYS  23   9.766   4.522  -5.143
  164    HZ1  LYS  23           3HZ      LYS  23  10.877   3.341  -6.707
  165    HZ2  LYS  23           1HZ      LYS  23  10.647   4.491  -7.927
  166    HZ3  LYS  23           2HZ      LYS  23   9.389   3.442  -7.505
  167    H    TYR  24           H        TYR  24   3.686   4.327  -3.869
  168    HA   TYR  24           HA       TYR  24   1.334   6.033  -4.248
  169    HB2  TYR  24           1HB      TYR  24   1.394   3.433  -5.707
  170    HB3  TYR  24           2HB      TYR  24   0.527   4.916  -6.092
  171    HD1  TYR  24           HD1      TYR  24   3.870   3.318  -6.152
  172    HD2  TYR  24           HD2      TYR  24   1.439   6.502  -7.585
  173    HE1  TYR  24           HE1      TYR  24   5.608   3.898  -7.793
  174    HE2  TYR  24           HE2      TYR  24   3.170   7.090  -9.231
  175    HH   TYR  24           HH       TYR  24   6.217   5.271  -9.423
  176    H    ARG  25           H        ARG  25  -0.723   4.722  -3.894
  177    HA   ARG  25           HA       ARG  25  -0.289   2.662  -1.837
  178    HB2  ARG  25           1HB      ARG  25  -1.872   5.175  -1.699
  179    HB3  ARG  25           2HB      ARG  25  -2.561   3.748  -0.938
  180    HG2  ARG  25           1HG      ARG  25  -0.695   3.527   0.521
  181    HG3  ARG  25           2HG      ARG  25   0.210   4.761  -0.359
  182    HD2  ARG  25           1HD      ARG  25  -1.445   6.440   0.308
  183    HD3  ARG  25           2HD      ARG  25  -2.340   5.204   1.191
  184    HE   ARG  25           HE       ARG  25   0.061   5.035   2.340
  185   HH11  ARG  25          2HH1      ARG  25  -1.910   7.795   1.555
  186   HH12  ARG  25          1HH1      ARG  25  -1.318   8.756   2.870
  187   HH21  ARG  25          2HH2      ARG  25   0.849   6.290   4.074
  188   HH22  ARG  25          1HH2      ARG  25   0.252   7.899   4.301
  189    H    CYS  26           H        CYS  26  -2.007   1.135  -1.582
  190    HA   CYS  26           HA       CYS  26  -3.080   0.202  -3.999
  191    HB2  CYS  26           1HB      CYS  26  -2.645  -1.254  -2.065
  192    HB3  CYS  26           2HB      CYS  26  -3.937  -0.458  -1.173
  193    HA   PRO  27           HA       PRO  27  -6.614   2.843  -4.410
  194    HB2  PRO  27           1HB      PRO  27  -7.787   1.495  -6.454
  195    HB3  PRO  27           2HB      PRO  27  -6.376   2.536  -6.674
  196    HG2  PRO  27           1HG      PRO  27  -6.510  -0.444  -6.417
  197    HG3  PRO  27           2HG      PRO  27  -5.546   0.541  -7.533
  198    HD2  PRO  27           1HD      PRO  27  -4.504  -0.558  -5.289
  199    HD3  PRO  27           2HD      PRO  27  -3.936   0.990  -5.946
  200    H    ALA  28           H        ALA  28  -6.526   0.042  -2.846
  201    HA   ALA  28           HA       ALA  28  -9.460  -0.160  -2.627
  202    HB1  ALA  28           3HB      ALA  28  -8.089  -2.521  -1.692
  203    HB2  ALA  28           1HB      ALA  28  -9.370  -2.365  -2.894
  204    HB3  ALA  28           2HB      ALA  28  -7.683  -2.169  -3.371
  205    H    CYS  29           H        CYS  29  -6.665  -1.301  -0.728
  206    HA   CYS  29           HA       CYS  29  -8.024  -0.482   1.715
  207    HB2  CYS  29           1HB      CYS  29  -6.121  -1.662   2.840
  208    HB3  CYS  29           2HB      CYS  29  -7.064  -2.685   1.761
  209    H    ARG  30           H        ARG  30  -5.686   0.712  -0.430
  210    HA   ARG  30           HA       ARG  30  -4.433   2.613  -0.429
  211    HB2  ARG  30           1HB      ARG  30  -5.751   3.194   2.229
  212    HB3  ARG  30           2HB      ARG  30  -4.882   4.346   1.225
  213    HG2  ARG  30           1HG      ARG  30  -7.189   4.737   0.891
  214    HG3  ARG  30           2HG      ARG  30  -6.592   3.932  -0.562
  215    HD2  ARG  30           1HD      ARG  30  -7.629   1.918  -0.019
  216    HD3  ARG  30           2HD      ARG  30  -7.793   2.353   1.681
  217    HE   ARG  30           HE       ARG  30  -9.556   3.104  -0.494
  218   HH11  ARG  30          2HH1      ARG  30  -8.578   3.641   2.804
  219   HH12  ARG  30          1HH1      ARG  30 -10.070   4.395   3.261
  220   HH21  ARG  30          2HH2      ARG  30 -11.524   4.095   0.095
  221   HH22  ARG  30          1HH2      ARG  30 -11.745   4.652   1.719
  222    H    VAL  31           H        VAL  31  -3.111   0.395   0.264
  223    HA   VAL  31           HA       VAL  31  -1.650   0.881   2.739
  224    HB   VAL  31           HB       VAL  31  -0.459  -1.248   2.143
  225   HG11  VAL  31          1HG1      VAL  31  -2.102  -1.654   3.679
  226   HG12  VAL  31          2HG1      VAL  31  -3.383  -1.030   2.638
  227   HG13  VAL  31          3HG1      VAL  31  -2.701  -2.629   2.338
  228   HG21  VAL  31          3HG2      VAL  31  -0.608  -2.050   0.078
  229   HG22  VAL  31          1HG2      VAL  31  -2.336  -2.311   0.316
  230   HG23  VAL  31          2HG2      VAL  31  -1.758  -0.784  -0.352
  231    HA   PRO  32           HA       PRO  32   1.724   2.942   0.803
  232    HB2  PRO  32           1HB      PRO  32   3.671   2.380   2.611
  233    HB3  PRO  32           2HB      PRO  32   2.377   3.544   2.923
  234    HG2  PRO  32           1HG      PRO  32   2.612   0.692   3.802
  235    HG3  PRO  32           2HG      PRO  32   2.073   2.106   4.725
  236    HD2  PRO  32           1HD      PRO  32   0.342   0.328   3.642
  237    HD3  PRO  32           2HD      PRO  32  -0.043   2.052   3.813
  238    H    TYR  33           H        TYR  33   2.736   2.241  -0.962
  239    HA   TYR  33           HA       TYR  33   4.534  -0.044  -0.779
  240    HB2  TYR  33           1HB      TYR  33   3.512  -1.381  -2.328
  241    HB3  TYR  33           2HB      TYR  33   2.080  -0.603  -1.663
  242    HD1  TYR  33           HD2      TYR  33   4.631   0.028  -4.327
  243    HD2  TYR  33           HD1      TYR  33   0.540   0.203  -3.173
  244    HE1  TYR  33           HE2      TYR  33   4.039   0.840  -6.572
  245    HE2  TYR  33           HE1      TYR  33  -0.064   1.015  -5.414
  246    HH   TYR  33           HH       TYR  33   1.621   2.391  -7.389
  247    H    CYS  34           H        CYS  34   6.346   0.233  -1.944
  248    HA   CYS  34           HA       CYS  34   6.876   2.737  -3.156
  249    HB2  CYS  34           1HB      CYS  34   8.990   1.455  -3.963
  250    HB3  CYS  34           2HB      CYS  34   8.766   1.732  -2.239
  251    H    SER  35           H        SER  35   7.186  -0.456  -4.706
  252    HA   SER  35           HA       SER  35   6.128   0.755  -7.177
  253    HB2  SER  35           1HB      SER  35   8.366  -1.196  -6.728
  254    HB3  SER  35           2HB      SER  35   7.503  -1.182  -8.266
  255    HG   SER  35           HG       SER  35   8.335   0.725  -8.738
  256    H    VAL  36           H        VAL  36   5.592  -1.289  -8.741
  257    HA   VAL  36           HA       VAL  36   3.207  -2.370  -7.731
  258    HB   VAL  36           HB       VAL  36   3.104  -3.706  -9.751
  259   HG11  VAL  36          1HG1      VAL  36   3.151  -0.989  -9.659
  260   HG12  VAL  36          2HG1      VAL  36   4.341  -1.318 -10.920
  261   HG13  VAL  36          3HG1      VAL  36   2.697  -1.938 -11.073
  262   HG21  VAL  36          3HG2      VAL  36   5.990  -2.920 -10.138
  263   HG22  VAL  36          1HG2      VAL  36   5.370  -4.541  -9.824
  264   HG23  VAL  36          2HG2      VAL  36   4.993  -3.732 -11.345
  265    H    VAL  37           H        VAL  37   6.431  -3.784  -8.117
  266    HA   VAL  37           HA       VAL  37   6.052  -6.411  -7.601
  267    HB   VAL  37           HB       VAL  37   8.193  -4.695  -6.337
  268   HG11  VAL  37          1HG1      VAL  37   7.634  -7.240  -5.639
  269   HG12  VAL  37          2HG1      VAL  37   8.732  -7.516  -6.993
  270   HG13  VAL  37          3HG1      VAL  37   9.255  -6.548  -5.614
  271   HG21  VAL  37          3HG2      VAL  37   8.244  -6.280  -8.904
  272   HG22  VAL  37          1HG2      VAL  37   8.064  -4.528  -8.795
  273   HG23  VAL  37          2HG2      VAL  37   9.554  -5.298  -8.247
  274    H    CYS  38           H        CYS  38   6.762  -4.130  -4.949
  275    HA   CYS  38           HA       CYS  38   6.116  -5.823  -2.855
  276    HB2  CYS  38           1HB      CYS  38   6.217  -2.853  -3.168
  277    HB3  CYS  38           2HB      CYS  38   5.524  -3.521  -1.694
  278    H    PHE  39           H        PHE  39   4.032  -3.920  -4.908
  279    HA   PHE  39           HA       PHE  39   1.700  -4.157  -3.275
  280    HB2  PHE  39           1HB      PHE  39   1.640  -2.338  -4.750
  281    HB3  PHE  39           2HB      PHE  39   2.206  -3.302  -6.110
  282    HD1  PHE  39           HD1      PHE  39  -0.595  -3.823  -3.709
  283    HD2  PHE  39           HD2      PHE  39   0.595  -3.221  -7.751
  284    HE1  PHE  39           HE1      PHE  39  -2.922  -4.148  -4.439
  285    HE2  PHE  39           HE2      PHE  39  -1.730  -3.544  -8.488
  286    HZ   PHE  39           HZ       PHE  39  -3.492  -4.008  -6.831
  287    H    ARG  40           H        ARG  40   3.149  -6.049  -5.833
  288    HA   ARG  40           HA       ARG  40   0.990  -7.635  -6.584
  289    HB2  ARG  40           1HB      ARG  40   3.916  -8.373  -6.391
  290    HB3  ARG  40           2HB      ARG  40   2.697  -9.321  -7.233
  291    HG2  ARG  40           1HG      ARG  40   2.263  -7.295  -8.658
  292    HG3  ARG  40           2HG      ARG  40   3.696  -6.574  -7.924
  293    HD2  ARG  40           1HD      ARG  40   4.660  -7.518  -9.760
  294    HD3  ARG  40           2HD      ARG  40   4.775  -8.880  -8.645
  295    HE   ARG  40           HE       ARG  40   3.189 -10.006  -9.887
  296   HH11  ARG  40          2HH1      ARG  40   3.434  -6.705 -10.964
  297   HH12  ARG  40          1HH1      ARG  40   2.491  -6.965 -12.394
  298   HH21  ARG  40          2HH2      ARG  40   1.947 -10.361 -11.766
  299   HH22  ARG  40          1HH2      ARG  40   1.645  -9.045 -12.849
  300    H    LYS  41           H        LYS  41   3.560  -8.572  -4.290
  301    HA   LYS  41           HA       LYS  41   2.445 -10.882  -3.319
  302    HB2  LYS  41           1HB      LYS  41   3.977  -8.843  -1.694
  303    HB3  LYS  41           2HB      LYS  41   3.778 -10.545  -1.297
  304    HG2  LYS  41           1HG      LYS  41   5.206 -11.238  -2.986
  305    HG3  LYS  41           2HG      LYS  41   5.038  -9.727  -3.883
  306    HD2  LYS  41           1HD      LYS  41   6.496  -8.589  -2.494
  307    HD3  LYS  41           2HD      LYS  41   6.244  -9.702  -1.148
  308    HE2  LYS  41           1HE      LYS  41   7.651 -10.437  -3.710
  309    HE3  LYS  41           2HE      LYS  41   8.479  -9.890  -2.252
  310    HZ1  LYS  41           3HZ      LYS  41   7.459 -12.471  -2.880
  311    HZ2  LYS  41           1HZ      LYS  41   6.814 -11.908  -1.421
  312    HZ3  LYS  41           2HZ      LYS  41   8.491 -12.003  -1.624
  313    H    HIS  42           H        HIS  42   1.813  -7.566  -2.255
  314    HA   HIS  42           HA       HIS  42   0.132  -8.222  -0.088
  315    HB2  HIS  42           1HB      HIS  42   0.809  -6.029   0.032
  316    HB3  HIS  42           2HB      HIS  42   0.664  -5.775  -1.704
  317    HD1  HIS  42           HD1      HIS  42  -1.333  -5.718   1.462
  318    HD2  HIS  42           HD2      HIS  42  -1.833  -4.888  -2.578
  319    HE1  HIS  42           HE1      HIS  42  -3.534  -4.514   1.290
  320    H    LYS  43           H        LYS  43  -0.828  -6.871  -3.250
  321    HA   LYS  43           HA       LYS  43  -3.493  -7.053  -3.194
  322    HB2  LYS  43           1HB      LYS  43  -1.763  -6.662  -5.187
  323    HB3  LYS  43           2HB      LYS  43  -2.253  -8.301  -5.597
  324    HG2  LYS  43           1HG      LYS  43  -4.241  -6.102  -5.121
  325    HG3  LYS  43           2HG      LYS  43  -3.523  -6.411  -6.703
  326    HD2  LYS  43           1HD      LYS  43  -4.918  -8.549  -5.109
  327    HD3  LYS  43           2HD      LYS  43  -5.771  -7.499  -6.243
  328    HE2  LYS  43           1HE      LYS  43  -3.322  -8.916  -7.170
  329    HE3  LYS  43           2HE      LYS  43  -4.812  -9.840  -6.988
  330    HZ1  LYS  43           3HZ      LYS  43  -5.343  -7.421  -8.342
  331    HZ2  LYS  43           1HZ      LYS  43  -5.558  -9.009  -8.884
  332    HZ3  LYS  43           2HZ      LYS  43  -4.076  -8.229  -9.119
  333    H    GLU  44           H        GLU  44  -1.357  -9.826  -3.791
  334    HA   GLU  44           HA       GLU  44  -3.088 -11.827  -4.351
  335    HB2  GLU  44           1HB      GLU  44  -0.717 -11.872  -2.487
  336    HB3  GLU  44           2HB      GLU  44  -1.579 -13.328  -2.963
  337    HG2  GLU  44           1HG      GLU  44  -0.979 -13.038  -5.243
  338    HG3  GLU  44           2HG      GLU  44  -0.341 -11.425  -4.930
  339    H    GLN  45           H        GLN  45  -2.397 -10.588  -1.095
  340    HA   GLN  45           HA       GLN  45  -4.847 -11.933  -0.162
  341    HB2  GLN  45           1HB      GLN  45  -3.839 -12.104   2.045
  342    HB3  GLN  45           2HB      GLN  45  -2.808 -12.876   0.847
  343    HG2  GLN  45           1HG      GLN  45  -1.236 -11.730   2.010
  344    HG3  GLN  45           2HG      GLN  45  -1.659 -10.504   0.816
  345   HE21  GLN  45          1HE2      GLN  45  -2.675 -11.647   4.017
  346   HE22  GLN  45          2HE2      GLN  45  -2.951 -10.075   4.679
  347    H    CYS  46           H        CYS  46  -4.481  -9.239  -1.337
  348    HA   CYS  46           HA       CYS  46  -4.616  -7.274   0.691
  349    HB2  CYS  46           1HB      CYS  46  -4.094  -6.420  -1.415
  350    HB3  CYS  46           2HB      CYS  46  -5.357  -7.351  -2.214
  351    H    ASN  47           H        ASN  47  -6.098  -7.511   2.266
  352    HA   ASN  47           HA       ASN  47  -8.904  -7.896   1.456
  353    HB2  ASN  47           1HB      ASN  47  -8.221  -9.744   2.818
  354    HB3  ASN  47           2HB      ASN  47  -7.475  -8.673   4.001
  355   HD21  ASN  47          1HD2      ASN  47  -8.597  -8.471   5.784
  356   HD22  ASN  47          2HD2      ASN  47 -10.318  -8.531   5.924
  357    HA   PRO  48           HA       PRO  48  -8.985  -3.603   2.894
  358    HB2  PRO  48           1HB      PRO  48 -11.336  -3.019   1.671
  359    HB3  PRO  48           2HB      PRO  48  -9.786  -3.020   0.822
  360    HG2  PRO  48           1HG      PRO  48 -11.903  -5.134   0.900
  361    HG3  PRO  48           2HG      PRO  48 -10.963  -4.544  -0.482
  362    HD2  PRO  48           1HD      PRO  48 -10.367  -6.849   0.808
  363    HD3  PRO  48           2HD      PRO  48  -9.124  -5.823   0.062
  364    H    GLU  49           H        GLU  49 -11.078  -2.335   3.729
  365    HA   GLU  49           HA       GLU  49 -11.824  -3.544   6.142
  366    HB2  GLU  49           1HB      GLU  49 -13.479  -1.677   6.312
  367    HB3  GLU  49           2HB      GLU  49 -11.838  -1.154   5.961
  368    HG2  GLU  49           1HG      GLU  49 -13.757  -1.600   3.723
  369    HG3  GLU  49           2HG      GLU  49 -13.846  -0.121   4.678
  370    H    THR  50           H        THR  50 -13.334  -4.987   6.634
  371    HA   THR  50           HA       THR  50 -14.916  -6.261   4.702
  372    HB   THR  50           HB       THR  50 -15.396  -6.244   7.687
  373    HG1  THR  50           HG1      THR  50 -13.429  -7.405   6.115
  374   HG21  THR  50          3HG2      THR  50 -15.903  -8.651   6.064
  375   HG22  THR  50          1HG2      THR  50 -16.994  -7.298   5.771
  376   HG23  THR  50          2HG2      THR  50 -16.833  -7.965   7.396
  377    H    SER  51           H        SER  51 -15.800  -3.888   7.199
  378    HA   SER  51           HA       SER  51 -18.539  -3.782   6.639
  379    HB2  SER  51           1HB      SER  51 -16.653  -1.737   7.814
  380    HB3  SER  51           2HB      SER  51 -18.391  -1.467   7.689
  381    HG   SER  51           HG       SER  51 -17.059  -2.825   9.550
  382    H    GLY  52           H        GLY  52 -19.286  -3.480   4.628
  383    HA2  GLY  52           1HA      GLY  52 -17.975  -1.831   2.697
  384    HA3  GLY  52           2HA      GLY  52 -19.553  -2.583   2.521
  385    HA   PRO  53           HA       PRO  53 -21.691   1.164   3.324
  386    HB2  PRO  53           1HB      PRO  53 -23.366   0.684   5.406
  387    HB3  PRO  53           2HB      PRO  53 -23.610  -0.007   3.798
  388    HG2  PRO  53           1HG      PRO  53 -22.402  -1.258   6.234
  389    HG3  PRO  53           2HG      PRO  53 -23.545  -1.952   5.070
  390    HD2  PRO  53           1HD      PRO  53 -20.891  -2.488   5.003
  391    HD3  PRO  53           2HD      PRO  53 -21.890  -2.426   3.537
  392    H    SER  54           H        SER  54 -20.516  -0.231   6.372
  393    HA   SER  54           HA       SER  54 -20.270   2.433   7.536
  394    HB2  SER  54           1HB      SER  54 -21.160   0.322   8.763
  395    HB3  SER  54           2HB      SER  54 -19.458  -0.116   8.910
  396    HG   SER  54           HG       SER  54 -20.755   2.194   9.914
  397    H    SER  55           H        SER  55 -18.528   3.474   6.757
  398    HA   SER  55           HA       SER  55 -15.948   2.049   6.801
  399    HB2  SER  55           1HB      SER  55 -16.819   2.911   4.562
  400    HB3  SER  55           2HB      SER  55 -16.543   4.535   5.193
  401    HG   SER  55           HG       SER  55 -14.765   2.757   4.195
  402    H    GLY  56           H        GLY  56 -17.548   5.141   7.469
  403    HA2  GLY  56           1HA      GLY  56 -17.031   6.828   8.936
  404    HA3  GLY  56           2HA      GLY  56 -16.148   5.614   9.850
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1  -6.764   4.431  25.856
    2    HA2  GLY   1           1HA      GLY   1  -6.076   5.116  23.374
    3    HA3  GLY   1           2HA      GLY   1  -7.827   5.197  23.256
    4    H    SER   2           H        SER   2  -6.111   7.393  22.846
    5    HA   SER   2           HA       SER   2  -6.102   9.013  25.230
    6    HB2  SER   2           1HB      SER   2  -5.358   9.520  22.354
    7    HB3  SER   2           2HB      SER   2  -5.399  10.823  23.541
    8    HG   SER   2           HG       SER   2  -3.333   9.608  23.180
    9    H    SER   3           H        SER   3  -8.184   9.337  25.908
   10    HA   SER   3           HA       SER   3 -10.179  10.324  24.037
   11    HB2  SER   3           1HB      SER   3 -10.736   8.633  25.810
   12    HB3  SER   3           2HB      SER   3 -10.460   9.888  27.018
   13    HG   SER   3           HG       SER   3 -12.706   9.468  26.068
   14    H    GLY   4           H        GLY   4 -10.749  12.396  23.798
   15    HA2  GLY   4           1HA      GLY   4 -11.212  14.581  24.657
   16    HA3  GLY   4           2HA      GLY   4  -9.981  14.323  25.883
   17    H    SER   5           H        SER   5  -7.802  14.622  25.364
   18    HA   SER   5           HA       SER   5  -7.201  16.706  23.640
   19    HB2  SER   5           1HB      SER   5  -5.427  14.542  24.784
   20    HB3  SER   5           2HB      SER   5  -4.804  15.926  23.887
   21    HG   SER   5           HG       SER   5  -4.824  16.255  26.172
   22    H    SER   6           H        SER   6  -5.603  16.591  21.794
   23    HA   SER   6           HA       SER   6  -6.605  14.653  19.856
   24    HB2  SER   6           1HB      SER   6  -6.624  17.022  19.216
   25    HB3  SER   6           2HB      SER   6  -4.881  17.113  19.468
   26    HG   SER   6           HG       SER   6  -6.301  16.109  17.347
   27    H    GLY   7           H        GLY   7  -5.280  13.302  18.633
   28    HA2  GLY   7           1HA      GLY   7  -2.476  13.092  19.519
   29    HA3  GLY   7           2HA      GLY   7  -3.505  11.668  19.483
   30    H    LEU   8           H        LEU   8  -2.860  10.424  17.855
   31    HA   LEU   8           HA       LEU   8  -1.933   9.823  15.835
   32    HB2  LEU   8           1HB      LEU   8  -4.318  11.527  15.241
   33    HB3  LEU   8           2HB      LEU   8  -3.369  10.842  13.923
   34    HG   LEU   8           HG       LEU   8  -5.421   9.549  14.550
   35   HD11  LEU   8          1HD1      LEU   8  -3.886   8.344  13.296
   36   HD12  LEU   8          2HD1      LEU   8  -4.112   7.334  14.724
   37   HD13  LEU   8          3HD1      LEU   8  -2.678   8.351  14.582
   38   HD21  LEU   8          3HD2      LEU   8  -3.817   8.984  17.042
   39   HD22  LEU   8          1HD2      LEU   8  -5.283   8.132  16.557
   40   HD23  LEU   8          2HD2      LEU   8  -5.352   9.849  16.953
   41    H    LYS   9           H        LYS   9  -0.405  11.853  16.944
   42    HA   LYS   9           HA       LYS   9   0.202  13.607  14.662
   43    HB2  LYS   9           1HB      LYS   9   1.342  15.060  16.229
   44    HB3  LYS   9           2HB      LYS   9  -0.286  14.736  16.810
   45    HG2  LYS   9           1HG      LYS   9   0.851  14.446  18.748
   46    HG3  LYS   9           2HG      LYS   9   0.967  12.801  18.117
   47    HD2  LYS   9           1HD      LYS   9   3.162  13.162  18.632
   48    HD3  LYS   9           2HD      LYS   9   3.148  13.783  16.980
   49    HE2  LYS   9           1HE      LYS   9   2.526  15.639  19.228
   50    HE3  LYS   9           2HE      LYS   9   4.203  15.173  18.948
   51    HZ1  LYS   9           3HZ      LYS   9   3.917  17.091  17.691
   52    HZ2  LYS   9           1HZ      LYS   9   2.379  16.640  17.148
   53    HZ3  LYS   9           2HZ      LYS   9   3.751  15.854  16.549
   54    H    CYS  10           H        CYS  10   2.499  14.035  14.233
   55    HA   CYS  10           HA       CYS  10   4.440  13.110  13.416
   56    HB2  CYS  10           1HB      CYS  10   4.909  13.960  15.771
   57    HB3  CYS  10           2HB      CYS  10   4.815  12.282  16.294
   58    HG   CYS  10           HG       CYS  10   6.850  12.163  13.838
   59    H    SER  11           H        SER  11   2.355  11.342  12.978
   60    HA   SER  11           HA       SER  11   3.644   8.737  13.475
   61    HB2  SER  11           1HB      SER  11   1.488   8.996  14.686
   62    HB3  SER  11           2HB      SER  11   0.679   9.256  13.141
   63    HG   SER  11           HG       SER  11   1.675   6.921  14.260
   64    H    THR  12           H        THR  12   4.742   8.454  11.602
   65    HA   THR  12           HA       THR  12   3.299   8.810   9.069
   66    HB   THR  12           HB       THR  12   5.482   9.956   9.269
   67    HG1  THR  12           HG1      THR  12   5.297   9.580   7.186
   68   HG21  THR  12          3HG2      THR  12   7.484   8.278   9.005
   69   HG22  THR  12          1HG2      THR  12   6.399   7.172   9.846
   70   HG23  THR  12          2HG2      THR  12   6.872   8.692  10.606
   71    H    VAL  13           H        VAL  13   3.754   7.181   7.355
   72    HA   VAL  13           HA       VAL  13   4.126   4.478   8.461
   73    HB   VAL  13           HB       VAL  13   1.679   5.210   7.911
   74   HG11  VAL  13          1HG1      VAL  13   2.181   6.099   5.687
   75   HG12  VAL  13          2HG1      VAL  13   2.702   4.496   5.163
   76   HG13  VAL  13          3HG1      VAL  13   1.017   4.777   5.605
   77   HG21  VAL  13          3HG2      VAL  13   3.053   2.759   7.934
   78   HG22  VAL  13          1HG2      VAL  13   1.328   3.033   8.180
   79   HG23  VAL  13          2HG2      VAL  13   1.945   2.692   6.564
   80    H    VAL  14           H        VAL  14   4.817   2.876   6.919
   81    HA   VAL  14           HA       VAL  14   5.934   3.938   4.422
   82    HB   VAL  14           HB       VAL  14   8.027   2.649   4.809
   83   HG11  VAL  14          1HG1      VAL  14   7.414   4.796   6.837
   84   HG12  VAL  14          2HG1      VAL  14   9.029   4.263   6.367
   85   HG13  VAL  14          3HG1      VAL  14   7.980   5.048   5.186
   86   HG21  VAL  14          3HG2      VAL  14   8.574   1.978   7.119
   87   HG22  VAL  14          1HG2      VAL  14   6.923   2.365   7.601
   88   HG23  VAL  14          2HG2      VAL  14   7.224   1.061   6.452
   89    H    CYS  15           H        CYS  15   6.713   2.145   2.976
   90    HA   CYS  15           HA       CYS  15   4.768   0.452   2.198
   91    HB2  CYS  15           1HB      CYS  15   7.019   0.867   1.085
   92    HB3  CYS  15           2HB      CYS  15   7.662  -0.398   2.127
   93    H    VAL  16           H        VAL  16   3.774  -1.305   2.944
   94    HA   VAL  16           HA       VAL  16   4.593  -2.449   5.461
   95    HB   VAL  16           HB       VAL  16   2.564  -3.873   5.201
   96   HG11  VAL  16          1HG1      VAL  16   1.596  -1.132   4.656
   97   HG12  VAL  16          2HG1      VAL  16   1.214  -2.229   5.985
   98   HG13  VAL  16          3HG1      VAL  16   2.729  -1.325   5.994
   99   HG21  VAL  16          3HG2      VAL  16   1.782  -4.216   3.145
  100   HG22  VAL  16          1HG2      VAL  16   1.180  -2.558   3.170
  101   HG23  VAL  16          2HG2      VAL  16   2.768  -2.910   2.488
  102    H    ILE  17           H        ILE  17   6.122  -2.852   2.844
  103    HA   ILE  17           HA       ILE  17   6.311  -5.784   3.057
  104    HB   ILE  17           HB       ILE  17   6.819  -4.254   0.511
  105   HG12  ILE  17          1HG1      ILE  17   4.419  -4.125   1.284
  106   HG13  ILE  17          2HG1      ILE  17   4.656  -4.897  -0.280
  107   HG21  ILE  17          1HG2      ILE  17   6.854  -7.112   1.325
  108   HG22  ILE  17          2HG2      ILE  17   6.329  -6.714  -0.310
  109   HG23  ILE  17          3HG2      ILE  17   7.932  -6.231   0.243
  110   HD11  ILE  17          3HD1      ILE  17   3.825  -6.081   2.316
  111   HD12  ILE  17          1HD1      ILE  17   3.165  -6.323   0.699
  112   HD13  ILE  17          2HD1      ILE  17   4.691  -7.084   1.152
  113    H    CYS  18           H        CYS  18   8.045  -2.884   1.921
  114    HA   CYS  18           HA       CYS  18  10.557  -4.151   2.789
  115    HB2  CYS  18           1HB      CYS  18  11.704  -2.682   1.213
  116    HB3  CYS  18           2HB      CYS  18  10.459  -3.613   0.386
  117    H    LEU  19           H        LEU  19   8.355  -1.654   3.436
  118    HA   LEU  19           HA       LEU  19   8.303  -0.035   5.036
  119    HB2  LEU  19           1HB      LEU  19  10.995  -1.066   5.906
  120    HB3  LEU  19           2HB      LEU  19   9.875  -0.085   6.849
  121    HG   LEU  19           HG       LEU  19   9.197  -2.867   5.926
  122   HD11  LEU  19          1HD1      LEU  19   9.735  -3.355   8.430
  123   HD12  LEU  19          2HD1      LEU  19  10.803  -1.962   8.271
  124   HD13  LEU  19          3HD1      LEU  19  11.025  -3.366   7.228
  125   HD21  LEU  19          3HD2      LEU  19   7.322  -1.471   6.591
  126   HD22  LEU  19          1HD2      LEU  19   8.122  -1.095   8.117
  127   HD23  LEU  19          2HD2      LEU  19   7.597  -2.745   7.781
  128    H    GLU  20           H        GLU  20   9.141   0.677   2.518
  129    HA   GLU  20           HA       GLU  20  11.204   2.704   3.086
  130    HB2  GLU  20           1HB      GLU  20  10.652   1.196   0.530
  131    HB3  GLU  20           2HB      GLU  20  11.661   2.633   0.599
  132    HG2  GLU  20           1HG      GLU  20  12.301   0.418   2.458
  133    HG3  GLU  20           2HG      GLU  20  12.660   0.187   0.748
  134    H    LYS  21           H        LYS  21  11.014   4.680   1.743
  135    HA   LYS  21           HA       LYS  21   8.641   5.999   2.087
  136    HB2  LYS  21           1HB      LYS  21  11.060   6.740   1.190
  137    HB3  LYS  21           2HB      LYS  21  10.188   6.741  -0.337
  138    HG2  LYS  21           1HG      LYS  21   8.878   8.509   0.248
  139    HG3  LYS  21           2HG      LYS  21   8.942   8.129   1.971
  140    HD2  LYS  21           1HD      LYS  21  11.324   9.133   0.427
  141    HD3  LYS  21           2HD      LYS  21  10.185  10.210   1.238
  142    HE2  LYS  21           1HE      LYS  21  11.584   7.964   2.666
  143    HE3  LYS  21           2HE      LYS  21  12.287   9.574   2.522
  144    HZ1  LYS  21           3HZ      LYS  21  11.139  10.075   4.339
  145    HZ2  LYS  21           1HZ      LYS  21  10.232   8.649   4.271
  146    HZ3  LYS  21           2HZ      LYS  21   9.734  10.010   3.400
  147    HA   PRO  22           HA       PRO  22   6.189   3.753  -0.963
  148    HB2  PRO  22           1HB      PRO  22   3.806   4.671  -0.041
  149    HB3  PRO  22           2HB      PRO  22   4.679   3.335   0.718
  150    HG2  PRO  22           1HG      PRO  22   4.567   6.218   1.513
  151    HG3  PRO  22           2HG      PRO  22   4.479   4.772   2.535
  152    HD2  PRO  22           1HD      PRO  22   6.747   6.224   2.259
  153    HD3  PRO  22           2HD      PRO  22   6.763   4.468   2.520
  154    H    LYS  23           H        LYS  23   6.023   4.522  -2.964
  155    HA   LYS  23           HA       LYS  23   5.765   7.353  -3.466
  156    HB2  LYS  23           1HB      LYS  23   6.035   4.952  -5.271
  157    HB3  LYS  23           2HB      LYS  23   5.817   6.583  -5.890
  158    HG2  LYS  23           1HG      LYS  23   8.096   6.369  -5.965
  159    HG3  LYS  23           2HG      LYS  23   7.874   7.129  -4.387
  160    HD2  LYS  23           1HD      LYS  23   8.445   5.235  -3.243
  161    HD3  LYS  23           2HD      LYS  23   7.852   4.160  -4.511
  162    HE2  LYS  23           1HE      LYS  23  10.136   3.883  -4.683
  163    HE3  LYS  23           2HE      LYS  23   9.833   5.134  -5.888
  164    HZ1  LYS  23           3HZ      LYS  23  11.658   5.895  -4.682
  165    HZ2  LYS  23           1HZ      LYS  23  11.007   5.430  -3.192
  166    HZ3  LYS  23           2HZ      LYS  23  10.360   6.754  -4.021
  167    H    TYR  24           H        TYR  24   3.749   4.496  -3.644
  168    HA   TYR  24           HA       TYR  24   1.425   6.217  -4.081
  169    HB2  TYR  24           1HB      TYR  24   1.472   3.637  -5.572
  170    HB3  TYR  24           2HB      TYR  24   0.644   5.142  -5.957
  171    HD1  TYR  24           HD1      TYR  24   3.960   3.485  -5.959
  172    HD2  TYR  24           HD2      TYR  24   1.611   6.715  -7.426
  173    HE1  TYR  24           HE1      TYR  24   5.742   4.046  -7.559
  174    HE2  TYR  24           HE2      TYR  24   3.386   7.285  -9.030
  175    HH   TYR  24           HH       TYR  24   5.933   5.226  -9.763
  176    H    ARG  25           H        ARG  25  -0.643   4.773  -3.903
  177    HA   ARG  25           HA       ARG  25  -0.253   2.746  -1.809
  178    HB2  ARG  25           1HB      ARG  25  -2.032   5.163  -1.749
  179    HB3  ARG  25           2HB      ARG  25  -2.466   3.719  -0.844
  180    HG2  ARG  25           1HG      ARG  25  -0.372   3.844   0.389
  181    HG3  ARG  25           2HG      ARG  25   0.096   5.272  -0.537
  182    HD2  ARG  25           1HD      ARG  25  -2.384   5.101   1.167
  183    HD3  ARG  25           2HD      ARG  25  -0.847   5.756   1.729
  184    HE   ARG  25           HE       ARG  25  -2.728   7.017  -0.056
  185   HH11  ARG  25          2HH1      ARG  25   0.558   6.927   1.088
  186   HH12  ARG  25          1HH1      ARG  25   0.901   8.563   0.630
  187   HH21  ARG  25          2HH2      ARG  25  -2.290   9.172  -0.665
  188   HH22  ARG  25          1HH2      ARG  25  -0.721   9.838  -0.367
  189    H    CYS  26           H        CYS  26  -2.193   1.367  -1.493
  190    HA   CYS  26           HA       CYS  26  -3.136   0.426  -4.020
  191    HB2  CYS  26           1HB      CYS  26  -2.633  -1.074  -2.104
  192    HB3  CYS  26           2HB      CYS  26  -4.008  -0.393  -1.241
  193    HA   PRO  27           HA       PRO  27  -6.720   3.034  -4.245
  194    HB2  PRO  27           1HB      PRO  27  -7.840   1.830  -6.404
  195    HB3  PRO  27           2HB      PRO  27  -6.456   2.923  -6.524
  196    HG2  PRO  27           1HG      PRO  27  -6.510  -0.070  -6.517
  197    HG3  PRO  27           2HG      PRO  27  -5.566   1.029  -7.538
  198    HD2  PRO  27           1HD      PRO  27  -4.510  -0.225  -5.383
  199    HD3  PRO  27           2HD      PRO  27  -3.980   1.387  -5.904
  200    H    ALA  28           H        ALA  28  -6.565   0.104  -2.931
  201    HA   ALA  28           HA       ALA  28  -9.493  -0.214  -2.780
  202    HB1  ALA  28           3HB      ALA  28  -8.646  -2.147  -3.844
  203    HB2  ALA  28           1HB      ALA  28  -7.319  -2.291  -2.691
  204    HB3  ALA  28           2HB      ALA  28  -8.975  -2.613  -2.175
  205    H    CYS  29           H        CYS  29  -6.681  -1.311  -0.877
  206    HA   CYS  29           HA       CYS  29  -8.143  -0.678   1.570
  207    HB2  CYS  29           1HB      CYS  29  -6.267  -1.898   2.689
  208    HB3  CYS  29           2HB      CYS  29  -7.151  -2.871   1.517
  209    H    ARG  30           H        ARG  30  -5.763   0.659  -0.439
  210    HA   ARG  30           HA       ARG  30  -4.547   2.580  -0.301
  211    HB2  ARG  30           1HB      ARG  30  -5.874   3.002   2.381
  212    HB3  ARG  30           2HB      ARG  30  -5.072   4.218   1.397
  213    HG2  ARG  30           1HG      ARG  30  -7.294   4.630   0.969
  214    HG3  ARG  30           2HG      ARG  30  -6.845   3.588  -0.383
  215    HD2  ARG  30           1HD      ARG  30  -7.999   1.777   0.455
  216    HD3  ARG  30           2HD      ARG  30  -7.914   2.361   2.117
  217    HE   ARG  30           HE       ARG  30  -9.482   4.102   0.529
  218   HH11  ARG  30          2HH1      ARG  30  -9.553   0.983   2.073
  219   HH12  ARG  30          1HH1      ARG  30 -11.275   0.974   2.269
  220   HH21  ARG  30          2HH2      ARG  30 -11.750   4.102   0.780
  221   HH22  ARG  30          1HH2      ARG  30 -12.523   2.748   1.532
  222    H    VAL  31           H        VAL  31  -3.118   0.443   0.192
  223    HA   VAL  31           HA       VAL  31  -1.706   0.819   2.735
  224    HB   VAL  31           HB       VAL  31  -0.525  -1.316   2.077
  225   HG11  VAL  31          1HG1      VAL  31  -2.072  -1.784   3.666
  226   HG12  VAL  31          2HG1      VAL  31  -3.388  -1.027   2.766
  227   HG13  VAL  31          3HG1      VAL  31  -2.831  -2.642   2.325
  228   HG21  VAL  31          3HG2      VAL  31  -1.585  -2.702   0.358
  229   HG22  VAL  31          1HG2      VAL  31  -2.675  -1.374  -0.039
  230   HG23  VAL  31          2HG2      VAL  31  -0.943  -1.208  -0.325
  231    HA   PRO  32           HA       PRO  32   1.716   2.823   0.834
  232    HB2  PRO  32           1HB      PRO  32   3.688   2.102   2.555
  233    HB3  PRO  32           2HB      PRO  32   2.443   3.289   2.963
  234    HG2  PRO  32           1HG      PRO  32   2.603   0.388   3.685
  235    HG3  PRO  32           2HG      PRO  32   2.136   1.769   4.695
  236    HD2  PRO  32           1HD      PRO  32   0.318   0.108   3.568
  237    HD3  PRO  32           2HD      PRO  32  -0.003   1.833   3.839
  238    H    TYR  33           H        TYR  33   2.695   2.202  -0.979
  239    HA   TYR  33           HA       TYR  33   4.398  -0.160  -0.969
  240    HB2  TYR  33           1HB      TYR  33   3.299  -1.362  -2.576
  241    HB3  TYR  33           2HB      TYR  33   1.911  -0.578  -1.831
  242    HD1  TYR  33           HD2      TYR  33   4.402   0.016  -4.554
  243    HD2  TYR  33           HD1      TYR  33   0.393   0.485  -3.209
  244    HE1  TYR  33           HE2      TYR  33   3.791   0.986  -6.730
  245    HE2  TYR  33           HE1      TYR  33  -0.229   1.455  -5.382
  246    HH   TYR  33           HH       TYR  33   1.009   2.688  -7.269
  247    H    CYS  34           H        CYS  34   6.258   0.293  -1.937
  248    HA   CYS  34           HA       CYS  34   6.743   2.794  -3.165
  249    HB2  CYS  34           1HB      CYS  34   8.952   1.612  -3.836
  250    HB3  CYS  34           2HB      CYS  34   8.616   1.866  -2.127
  251    H    SER  35           H        SER  35   7.175  -0.429  -4.629
  252    HA   SER  35           HA       SER  35   6.271   0.725  -7.186
  253    HB2  SER  35           1HB      SER  35   8.285  -1.492  -6.737
  254    HB3  SER  35           2HB      SER  35   7.744  -0.907  -8.311
  255    HG   SER  35           HG       SER  35   8.823   0.889  -6.435
  256    H    VAL  36           H        VAL  36   5.685  -1.220  -8.747
  257    HA   VAL  36           HA       VAL  36   3.295  -2.321  -7.818
  258    HB   VAL  36           HB       VAL  36   4.085  -2.001 -10.243
  259   HG11  VAL  36          1HG1      VAL  36   6.137  -3.363  -9.987
  260   HG12  VAL  36          2HG1      VAL  36   5.126  -4.797  -9.798
  261   HG13  VAL  36          3HG1      VAL  36   5.111  -3.900 -11.317
  262   HG21  VAL  36          3HG2      VAL  36   2.316  -4.000  -9.061
  263   HG22  VAL  36          1HG2      VAL  36   2.023  -2.859 -10.374
  264   HG23  VAL  36          2HG2      VAL  36   2.827  -4.394 -10.702
  265    H    VAL  37           H        VAL  37   6.525  -3.747  -8.073
  266    HA   VAL  37           HA       VAL  37   6.093  -6.378  -7.570
  267    HB   VAL  37           HB       VAL  37   8.231  -4.681  -6.274
  268   HG11  VAL  37          1HG1      VAL  37   8.080  -7.664  -6.690
  269   HG12  VAL  37          2HG1      VAL  37   9.501  -6.787  -6.121
  270   HG13  VAL  37          3HG1      VAL  37   8.032  -6.815  -5.146
  271   HG21  VAL  37          3HG2      VAL  37   8.449  -4.400  -8.594
  272   HG22  VAL  37          1HG2      VAL  37   9.598  -5.675  -8.189
  273   HG23  VAL  37          2HG2      VAL  37   8.048  -6.085  -8.924
  274    H    CYS  38           H        CYS  38   6.795  -4.104  -4.911
  275    HA   CYS  38           HA       CYS  38   6.099  -5.756  -2.815
  276    HB2  CYS  38           1HB      CYS  38   6.145  -2.785  -3.165
  277    HB3  CYS  38           2HB      CYS  38   5.462  -3.459  -1.689
  278    H    PHE  39           H        PHE  39   4.030  -3.821  -4.881
  279    HA   PHE  39           HA       PHE  39   1.672  -4.118  -3.310
  280    HB2  PHE  39           1HB      PHE  39   1.710  -2.280  -4.809
  281    HB3  PHE  39           2HB      PHE  39   2.162  -3.301  -6.170
  282    HD1  PHE  39           HD1      PHE  39  -0.588  -3.078  -3.653
  283    HD2  PHE  39           HD2      PHE  39   0.525  -3.726  -7.710
  284    HE1  PHE  39           HE1      PHE  39  -2.960  -3.302  -4.264
  285    HE2  PHE  39           HE2      PHE  39  -1.846  -3.951  -8.328
  286    HZ   PHE  39           HZ       PHE  39  -3.592  -3.738  -6.604
  287    H    ARG  40           H        ARG  40   3.207  -5.993  -5.821
  288    HA   ARG  40           HA       ARG  40   1.077  -7.593  -6.637
  289    HB2  ARG  40           1HB      ARG  40   4.012  -8.271  -6.390
  290    HB3  ARG  40           2HB      ARG  40   2.832  -9.271  -7.226
  291    HG2  ARG  40           1HG      ARG  40   2.355  -7.093  -8.574
  292    HG3  ARG  40           2HG      ARG  40   3.954  -6.620  -7.996
  293    HD2  ARG  40           1HD      ARG  40   4.307  -7.647 -10.089
  294    HD3  ARG  40           2HD      ARG  40   4.782  -8.842  -8.882
  295    HE   ARG  40           HE       ARG  40   2.062  -9.004  -9.910
  296   HH11  ARG  40          2HH1      ARG  40   5.332 -10.198  -9.967
  297   HH12  ARG  40          1HH1      ARG  40   4.907 -11.702 -10.717
  298   HH21  ARG  40          2HH2      ARG  40   1.491 -10.979 -10.897
  299   HH22  ARG  40          1HH2      ARG  40   2.723 -12.145 -11.246
  300    H    LYS  41           H        LYS  41   3.632  -8.619  -4.369
  301    HA   LYS  41           HA       LYS  41   2.435 -10.895  -3.411
  302    HB2  LYS  41           1HB      LYS  41   4.084  -8.961  -1.773
  303    HB3  LYS  41           2HB      LYS  41   3.835 -10.667  -1.429
  304    HG2  LYS  41           1HG      LYS  41   5.210 -11.351  -3.158
  305    HG3  LYS  41           2HG      LYS  41   5.056  -9.820  -4.021
  306    HD2  LYS  41           1HD      LYS  41   6.235  -8.833  -1.917
  307    HD3  LYS  41           2HD      LYS  41   6.746 -10.501  -1.649
  308    HE2  LYS  41           1HE      LYS  41   7.109  -9.312  -4.355
  309    HE3  LYS  41           2HE      LYS  41   8.207  -8.821  -3.065
  310    HZ1  LYS  41           3HZ      LYS  41   8.275 -11.444  -2.749
  311    HZ2  LYS  41           1HZ      LYS  41   9.326 -10.624  -3.791
  312    HZ3  LYS  41           2HZ      LYS  41   7.951 -11.391  -4.409
  313    H    HIS  42           H        HIS  42   1.682  -7.585  -2.660
  314    HA   HIS  42           HA       HIS  42   0.173  -8.102  -0.298
  315    HB2  HIS  42           1HB      HIS  42   0.798  -5.891  -0.371
  316    HB3  HIS  42           2HB      HIS  42   0.576  -5.774  -2.115
  317    HD1  HIS  42           HD1      HIS  42  -1.550  -6.010   1.026
  318    HD2  HIS  42           HD2      HIS  42  -1.716  -4.524  -2.851
  319    HE1  HIS  42           HE1      HIS  42  -3.722  -4.749   0.881
  320    H    LYS  43           H        LYS  43  -0.904  -7.102  -3.551
  321    HA   LYS  43           HA       LYS  43  -3.574  -7.306  -3.368
  322    HB2  LYS  43           1HB      LYS  43  -2.187  -6.858  -5.448
  323    HB3  LYS  43           2HB      LYS  43  -2.092  -8.602  -5.655
  324    HG2  LYS  43           1HG      LYS  43  -3.841  -7.857  -7.046
  325    HG3  LYS  43           2HG      LYS  43  -4.609  -8.627  -5.656
  326    HD2  LYS  43           1HD      LYS  43  -5.227  -6.562  -4.718
  327    HD3  LYS  43           2HD      LYS  43  -4.117  -5.664  -5.756
  328    HE2  LYS  43           1HE      LYS  43  -5.514  -5.776  -7.574
  329    HE3  LYS  43           2HE      LYS  43  -6.283  -7.265  -7.027
  330    HZ1  LYS  43           3HZ      LYS  43  -6.677  -4.808  -5.470
  331    HZ2  LYS  43           1HZ      LYS  43  -7.705  -6.138  -5.657
  332    HZ3  LYS  43           2HZ      LYS  43  -7.546  -5.011  -6.907
  333    H    GLU  44           H        GLU  44  -1.348 -10.037  -3.552
  334    HA   GLU  44           HA       GLU  44  -2.973 -12.165  -3.985
  335    HB2  GLU  44           1HB      GLU  44  -0.752 -11.923  -1.953
  336    HB3  GLU  44           2HB      GLU  44  -1.498 -13.450  -2.403
  337    HG2  GLU  44           1HG      GLU  44  -0.303 -11.663  -4.480
  338    HG3  GLU  44           2HG      GLU  44   0.706 -12.753  -3.531
  339    H    GLN  45           H        GLN  45  -2.553 -10.487  -0.886
  340    HA   GLN  45           HA       GLN  45  -5.043 -11.762   0.035
  341    HB2  GLN  45           1HB      GLN  45  -4.175 -11.855   2.281
  342    HB3  GLN  45           2HB      GLN  45  -3.035 -12.652   1.204
  343    HG2  GLN  45           1HG      GLN  45  -1.694 -10.561   1.177
  344    HG3  GLN  45           2HG      GLN  45  -2.789  -9.899   2.390
  345   HE21  GLN  45          1HE2      GLN  45  -0.014 -10.234   2.729
  346   HE22  GLN  45          2HE2      GLN  45   0.236 -11.385   3.993
  347    H    CYS  46           H        CYS  46  -4.524  -9.171  -1.309
  348    HA   CYS  46           HA       CYS  46  -4.668  -7.037   0.511
  349    HB2  CYS  46           1HB      CYS  46  -4.146  -6.409  -1.676
  350    HB3  CYS  46           2HB      CYS  46  -5.442  -7.378  -2.368
  351    H    ASN  47           H        ASN  47  -6.133  -7.297   2.141
  352    HA   ASN  47           HA       ASN  47  -8.945  -7.714   1.398
  353    HB2  ASN  47           1HB      ASN  47  -8.136  -9.304   3.037
  354    HB3  ASN  47           2HB      ASN  47  -7.536  -8.002   4.060
  355   HD21  ASN  47          1HD2      ASN  47  -9.702 -10.213   4.178
  356   HD22  ASN  47          2HD2      ASN  47 -11.054  -9.384   4.863
  357    HA   PRO  48           HA       PRO  48  -9.104  -3.251   2.146
  358    HB2  PRO  48           1HB      PRO  48 -11.475  -2.911   0.866
  359    HB3  PRO  48           2HB      PRO  48  -9.929  -3.015   0.015
  360    HG2  PRO  48           1HG      PRO  48 -12.003  -5.132   0.442
  361    HG3  PRO  48           2HG      PRO  48 -11.082  -4.747  -1.024
  362    HD2  PRO  48           1HD      PRO  48 -10.432  -6.810   0.607
  363    HD3  PRO  48           2HD      PRO  48  -9.215  -5.890  -0.302
  364    H    GLU  49           H        GLU  49 -11.212  -1.906   2.796
  365    HA   GLU  49           HA       GLU  49 -12.557  -3.417   4.939
  366    HB2  GLU  49           1HB      GLU  49 -11.515  -0.586   4.934
  367    HB3  GLU  49           2HB      GLU  49 -12.655  -1.177   6.136
  368    HG2  GLU  49           1HG      GLU  49 -10.310  -1.206   6.900
  369    HG3  GLU  49           2HG      GLU  49 -11.078  -2.792   6.931
  370    H    THR  50           H        THR  50 -14.726  -3.257   5.098
  371    HA   THR  50           HA       THR  50 -16.347  -2.622   3.015
  372    HB   THR  50           HB       THR  50 -18.218  -2.409   4.607
  373    HG1  THR  50           HG1      THR  50 -17.526  -1.390   6.378
  374   HG21  THR  50          3HG2      THR  50 -17.520  -4.585   5.979
  375   HG22  THR  50          1HG2      THR  50 -16.217  -4.595   4.791
  376   HG23  THR  50          2HG2      THR  50 -17.898  -4.641   4.258
  377    H    SER  51           H        SER  51 -17.708  -0.870   2.461
  378    HA   SER  51           HA       SER  51 -16.818   1.737   3.510
  379    HB2  SER  51           1HB      SER  51 -17.264   0.815   0.696
  380    HB3  SER  51           2HB      SER  51 -17.563   2.505   1.101
  381    HG   SER  51           HG       SER  51 -15.293   2.057   2.187
  382    H    GLY  52           H        GLY  52 -18.495   3.502   2.800
  383    HA2  GLY  52           1HA      GLY  52 -21.066   3.361   2.254
  384    HA3  GLY  52           2HA      GLY  52 -21.074   2.574   3.825
  385    HA   PRO  53           HA       PRO  53 -21.198   6.407   5.940
  386    HB2  PRO  53           1HB      PRO  53 -19.317   6.184   7.885
  387    HB3  PRO  53           2HB      PRO  53 -20.839   5.286   7.913
  388    HG2  PRO  53           1HG      PRO  53 -18.119   4.377   7.055
  389    HG3  PRO  53           2HG      PRO  53 -19.326   3.524   8.034
  390    HD2  PRO  53           1HD      PRO  53 -18.962   3.014   5.399
  391    HD3  PRO  53           2HD      PRO  53 -20.546   2.873   6.189
  392    H    SER  54           H        SER  54 -17.938   5.422   5.000
  393    HA   SER  54           HA       SER  54 -17.316   8.247   4.462
  394    HB2  SER  54           1HB      SER  54 -16.176   7.131   6.545
  395    HB3  SER  54           2HB      SER  54 -15.153   6.361   5.333
  396    HG   SER  54           HG       SER  54 -15.386   9.071   6.013
  397    H    SER  55           H        SER  55 -15.431   8.470   2.936
  398    HA   SER  55           HA       SER  55 -15.861   6.667   0.697
  399    HB2  SER  55           1HB      SER  55 -14.766   8.316  -0.650
  400    HB3  SER  55           2HB      SER  55 -15.827   9.187   0.457
  401    HG   SER  55           HG       SER  55 -14.144  10.106   1.309
  402    H    GLY  56           H        GLY  56 -13.172   7.808   2.713
  403    HA2  GLY  56           1HA      GLY  56 -11.283   6.611   3.357
  404    HA3  GLY  56           2HA      GLY  56 -11.787   5.300   2.300
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -11.604  15.298  26.064
    2    HA2  GLY   1           1HA      GLY   1 -10.890  17.956  27.112
    3    HA3  GLY   1           2HA      GLY   1  -9.793  16.862  26.281
    4    H    SER   2           H        SER   2 -10.818  19.734  25.855
    5    HA   SER   2           HA       SER   2 -11.969  19.510  23.189
    6    HB2  SER   2           1HB      SER   2 -11.344  21.913  24.919
    7    HB3  SER   2           2HB      SER   2 -12.069  22.008  23.314
    8    HG   SER   2           HG       SER   2 -13.888  21.072  24.064
    9    H    SER   3           H        SER   3 -11.046  20.763  21.398
   10    HA   SER   3           HA       SER   3  -8.288  21.548  21.510
   11    HB2  SER   3           1HB      SER   3  -7.497  19.884  19.840
   12    HB3  SER   3           2HB      SER   3  -7.960  19.140  21.371
   13    HG   SER   3           HG       SER   3 -10.086  18.840  20.263
   14    H    GLY   4           H        GLY   4  -8.489  23.403  20.430
   15    HA2  GLY   4           1HA      GLY   4  -9.528  23.291  17.691
   16    HA3  GLY   4           2HA      GLY   4 -10.244  24.454  18.797
   17    H    SER   5           H        SER   5  -8.109  25.429  20.158
   18    HA   SER   5           HA       SER   5  -6.697  26.878  18.044
   19    HB2  SER   5           1HB      SER   5  -7.995  28.014  19.974
   20    HB3  SER   5           2HB      SER   5  -6.610  27.572  20.972
   21    HG   SER   5           HG       SER   5  -6.452  29.068  18.565
   22    H    SER   6           H        SER   6  -5.813  24.281  18.437
   23    HA   SER   6           HA       SER   6  -3.122  24.774  19.504
   24    HB2  SER   6           1HB      SER   6  -4.549  23.439  21.121
   25    HB3  SER   6           2HB      SER   6  -4.583  22.160  19.908
   26    HG   SER   6           HG       SER   6  -2.877  22.070  21.585
   27    H    GLY   7           H        GLY   7  -1.469  23.948  18.311
   28    HA2  GLY   7           1HA      GLY   7  -2.245  22.569  15.822
   29    HA3  GLY   7           2HA      GLY   7  -0.832  23.598  15.999
   30    H    LEU   8           H        LEU   8  -2.142  20.430  16.430
   31    HA   LEU   8           HA       LEU   8   0.560  19.415  16.904
   32    HB2  LEU   8           1HB      LEU   8  -1.861  18.589  18.498
   33    HB3  LEU   8           2HB      LEU   8  -0.272  17.832  18.586
   34    HG   LEU   8           HG       LEU   8  -0.550  20.743  19.198
   35   HD11  LEU   8          1HD1      LEU   8  -1.568  20.470  21.170
   36   HD12  LEU   8          2HD1      LEU   8  -0.716  18.965  21.513
   37   HD13  LEU   8          3HD1      LEU   8  -2.152  18.951  20.490
   38   HD21  LEU   8          3HD2      LEU   8   1.321  18.509  19.898
   39   HD22  LEU   8          1HD2      LEU   8   1.256  19.981  20.869
   40   HD23  LEU   8          2HD2      LEU   8   1.677  20.071  19.158
   41    H    LYS   9           H        LYS   9   0.995  18.012  15.350
   42    HA   LYS   9           HA       LYS   9  -0.759  15.845  14.723
   43    HB2  LYS   9           1HB      LYS   9  -1.889  17.483  13.370
   44    HB3  LYS   9           2HB      LYS   9  -0.368  18.040  12.684
   45    HG2  LYS   9           1HG      LYS   9  -0.100  15.733  11.707
   46    HG3  LYS   9           2HG      LYS   9  -1.767  15.425  12.198
   47    HD2  LYS   9           1HD      LYS   9  -2.631  16.939  10.683
   48    HD3  LYS   9           2HD      LYS   9  -1.129  17.863  10.592
   49    HE2  LYS   9           1HE      LYS   9  -1.211  16.753   8.547
   50    HE3  LYS   9           2HE      LYS   9  -0.141  15.744   9.519
   51    HZ1  LYS   9           3HZ      LYS   9  -1.494  14.044   9.185
   52    HZ2  LYS   9           1HZ      LYS   9  -2.512  15.009   8.240
   53    HZ3  LYS   9           2HZ      LYS   9  -2.777  14.878   9.905
   54    H    CYS  10           H        CYS  10   0.490  14.156  14.275
   55    HA   CYS  10           HA       CYS  10   2.842  14.412  12.623
   56    HB2  CYS  10           1HB      CYS  10   3.498  14.989  15.052
   57    HB3  CYS  10           2HB      CYS  10   3.262  13.277  15.378
   58    HG   CYS  10           HG       CYS  10   5.207  13.771  12.731
   59    H    SER  11           H        SER  11   3.064  12.636  11.425
   60    HA   SER  11           HA       SER  11   2.657   9.999  12.363
   61    HB2  SER  11           1HB      SER  11   0.318  10.392  12.309
   62    HB3  SER  11           2HB      SER  11   0.421  11.257  10.775
   63    HG   SER  11           HG       SER  11   1.362   8.666  10.716
   64    H    THR  12           H        THR  12   3.270   8.433  10.848
   65    HA   THR  12           HA       THR  12   3.810   9.154   8.113
   66    HB   THR  12           HB       THR  12   5.796  10.121   9.054
   67    HG1  THR  12           HG1      THR  12   7.276   8.967   7.873
   68   HG21  THR  12          3HG2      THR  12   5.668   7.793  10.815
   69   HG22  THR  12          1HG2      THR  12   6.414   9.369  11.076
   70   HG23  THR  12          2HG2      THR  12   7.288   8.115  10.196
   71    H    VAL  13           H        VAL  13   3.798   7.397   6.820
   72    HA   VAL  13           HA       VAL  13   3.942   4.753   8.117
   73    HB   VAL  13           HB       VAL  13   1.634   5.498   7.317
   74   HG11  VAL  13          1HG1      VAL  13   2.227   4.607   4.598
   75   HG12  VAL  13          2HG1      VAL  13   1.220   5.942   5.162
   76   HG13  VAL  13          3HG1      VAL  13   2.966   6.152   5.019
   77   HG21  VAL  13          3HG2      VAL  13   1.842   3.238   7.833
   78   HG22  VAL  13          1HG2      VAL  13   1.266   3.217   6.166
   79   HG23  VAL  13          2HG2      VAL  13   2.973   2.940   6.513
   80    H    VAL  14           H        VAL  14   4.907   3.072   6.959
   81    HA   VAL  14           HA       VAL  14   6.350   3.863   4.516
   82    HB   VAL  14           HB       VAL  14   8.261   2.483   5.247
   83   HG11  VAL  14          1HG1      VAL  14   7.993   4.988   5.719
   84   HG12  VAL  14          2HG1      VAL  14   7.701   4.505   7.391
   85   HG13  VAL  14          3HG1      VAL  14   9.234   4.110   6.613
   86   HG21  VAL  14          3HG2      VAL  14   6.538   1.354   7.014
   87   HG22  VAL  14          1HG2      VAL  14   8.295   1.243   7.123
   88   HG23  VAL  14          2HG2      VAL  14   7.428   2.456   8.064
   89    H    CYS  15           H        CYS  15   6.836   2.166   3.043
   90    HA   CYS  15           HA       CYS  15   4.870   0.472   2.334
   91    HB2  CYS  15           1HB      CYS  15   7.063   0.918   1.121
   92    HB3  CYS  15           2HB      CYS  15   7.762  -0.360   2.109
   93    H    VAL  16           H        VAL  16   3.852  -1.181   3.236
   94    HA   VAL  16           HA       VAL  16   4.780  -2.382   5.655
   95    HB   VAL  16           HB       VAL  16   2.781  -3.771   5.538
   96   HG11  VAL  16          1HG1      VAL  16   1.524  -2.069   6.239
   97   HG12  VAL  16          2HG1      VAL  16   2.852  -1.014   5.750
   98   HG13  VAL  16          3HG1      VAL  16   1.514  -1.320   4.642
   99   HG21  VAL  16          3HG2      VAL  16   2.988  -4.003   2.982
  100   HG22  VAL  16          1HG2      VAL  16   1.373  -3.930   3.687
  101   HG23  VAL  16          2HG2      VAL  16   2.064  -2.502   2.917
  102    H    ILE  17           H        ILE  17   6.032  -2.780   2.768
  103    HA   ILE  17           HA       ILE  17   6.361  -5.697   3.029
  104    HB   ILE  17           HB       ILE  17   6.806  -4.063   0.532
  105   HG12  ILE  17          1HG1      ILE  17   4.443  -4.003   1.102
  106   HG13  ILE  17          2HG1      ILE  17   4.689  -5.077  -0.271
  107   HG21  ILE  17          1HG2      ILE  17   6.764  -6.286  -0.563
  108   HG22  ILE  17          2HG2      ILE  17   8.107  -6.084   0.561
  109   HG23  ILE  17          3HG2      ILE  17   6.698  -7.032   1.034
  110   HD11  ILE  17          3HD1      ILE  17   3.247  -6.308   0.998
  111   HD12  ILE  17          1HD1      ILE  17   4.794  -6.918   1.583
  112   HD13  ILE  17          2HD1      ILE  17   3.907  -5.717   2.523
  113    H    CYS  18           H        CYS  18   8.113  -2.839   1.800
  114    HA   CYS  18           HA       CYS  18  10.611  -4.072   2.751
  115    HB2  CYS  18           1HB      CYS  18  11.778  -2.709   1.117
  116    HB3  CYS  18           2HB      CYS  18  10.492  -3.607   0.318
  117    H    LEU  19           H        LEU  19   8.399  -1.612   3.376
  118    HA   LEU  19           HA       LEU  19   8.354   0.106   4.865
  119    HB2  LEU  19           1HB      LEU  19  10.928  -1.154   5.799
  120    HB3  LEU  19           2HB      LEU  19  10.080   0.139   6.646
  121    HG   LEU  19           HG       LEU  19   8.096  -1.537   6.689
  122   HD11  LEU  19          1HD1      LEU  19   9.245  -3.130   5.139
  123   HD12  LEU  19          2HD1      LEU  19   8.668  -3.847   6.643
  124   HD13  LEU  19          3HD1      LEU  19  10.381  -3.481   6.441
  125   HD21  LEU  19          3HD2      LEU  19  10.360  -2.372   8.440
  126   HD22  LEU  19          1HD2      LEU  19   8.668  -2.082   8.844
  127   HD23  LEU  19          2HD2      LEU  19   9.750  -0.720   8.550
  128    H    GLU  20           H        GLU  20   9.031   0.959   2.486
  129    HA   GLU  20           HA       GLU  20  11.188   2.890   2.998
  130    HB2  GLU  20           1HB      GLU  20  10.698   1.409   0.408
  131    HB3  GLU  20           2HB      GLU  20  11.832   2.738   0.606
  132    HG2  GLU  20           1HG      GLU  20  12.769   1.179   2.521
  133    HG3  GLU  20           2HG      GLU  20  12.015  -0.072   1.534
  134    H    LYS  21           H        LYS  21  11.019   4.867   1.737
  135    HA   LYS  21           HA       LYS  21   8.675   6.198   1.922
  136    HB2  LYS  21           1HB      LYS  21  10.959   6.507   0.004
  137    HB3  LYS  21           2HB      LYS  21   9.552   7.554  -0.133
  138    HG2  LYS  21           1HG      LYS  21   9.957   8.586   1.894
  139    HG3  LYS  21           2HG      LYS  21  10.942   7.250   2.494
  140    HD2  LYS  21           1HD      LYS  21  12.526   8.877   2.019
  141    HD3  LYS  21           2HD      LYS  21  12.544   7.885   0.558
  142    HE2  LYS  21           1HE      LYS  21  12.403   9.947  -0.400
  143    HE3  LYS  21           2HE      LYS  21  10.684   9.614  -0.192
  144    HZ1  LYS  21           3HZ      LYS  21  10.957  11.747   0.646
  145    HZ2  LYS  21           1HZ      LYS  21  12.422  11.384   1.409
  146    HZ3  LYS  21           2HZ      LYS  21  10.970  10.790   2.040
  147    HA   PRO  22           HA       PRO  22   6.260   3.806  -1.065
  148    HB2  PRO  22           1HB      PRO  22   3.860   4.655  -0.121
  149    HB3  PRO  22           2HB      PRO  22   4.783   3.351   0.635
  150    HG2  PRO  22           1HG      PRO  22   4.590   6.234   1.416
  151    HG3  PRO  22           2HG      PRO  22   4.558   4.791   2.446
  152    HD2  PRO  22           1HD      PRO  22   6.777   6.311   2.137
  153    HD3  PRO  22           2HD      PRO  22   6.851   4.558   2.407
  154    H    LYS  23           H        LYS  23   6.155   4.599  -3.065
  155    HA   LYS  23           HA       LYS  23   5.799   7.398  -3.590
  156    HB2  LYS  23           1HB      LYS  23   6.027   4.980  -5.381
  157    HB3  LYS  23           2HB      LYS  23   5.793   6.607  -6.006
  158    HG2  LYS  23           1HG      LYS  23   8.075   6.362  -6.139
  159    HG3  LYS  23           2HG      LYS  23   7.887   7.181  -4.587
  160    HD2  LYS  23           1HD      LYS  23   8.462   5.322  -3.381
  161    HD3  LYS  23           2HD      LYS  23   7.870   4.206  -4.614
  162    HE2  LYS  23           1HE      LYS  23   9.813   4.290  -5.818
  163    HE3  LYS  23           2HE      LYS  23  10.204   5.923  -5.279
  164    HZ1  LYS  23           3HZ      LYS  23  11.547   3.908  -4.391
  165    HZ2  LYS  23           1HZ      LYS  23  10.238   3.718  -3.336
  166    HZ3  LYS  23           2HZ      LYS  23  11.122   5.160  -3.337
  167    H    TYR  24           H        TYR  24   3.819   4.495  -3.846
  168    HA   TYR  24           HA       TYR  24   1.466   6.212  -4.195
  169    HB2  TYR  24           1HB      TYR  24   1.550   3.602  -5.647
  170    HB3  TYR  24           2HB      TYR  24   0.630   5.057  -6.014
  171    HD1  TYR  24           HD1      TYR  24   3.992   3.525  -6.181
  172    HD2  TYR  24           HD2      TYR  24   1.494   6.717  -7.474
  173    HE1  TYR  24           HE1      TYR  24   5.682   4.163  -7.851
  174    HE2  TYR  24           HE2      TYR  24   3.176   7.363  -9.148
  175    HH   TYR  24           HH       TYR  24   6.086   6.791  -9.146
  176    H    ARG  25           H        ARG  25  -0.594   4.836  -3.889
  177    HA   ARG  25           HA       ARG  25  -0.170   2.765  -1.851
  178    HB2  ARG  25           1HB      ARG  25  -1.841   5.253  -1.614
  179    HB3  ARG  25           2HB      ARG  25  -2.224   3.813  -0.680
  180    HG2  ARG  25           1HG      ARG  25   0.142   3.889   0.186
  181    HG3  ARG  25           2HG      ARG  25   0.268   5.484  -0.559
  182    HD2  ARG  25           1HD      ARG  25  -0.405   6.109   1.525
  183    HD3  ARG  25           2HD      ARG  25  -1.985   5.875   0.778
  184    HE   ARG  25           HE       ARG  25  -1.524   3.456   1.805
  185   HH11  ARG  25          2HH1      ARG  25  -1.175   6.634   3.183
  186   HH12  ARG  25          1HH1      ARG  25  -1.512   6.112   4.800
  187   HH21  ARG  25          2HH2      ARG  25  -1.969   2.756   3.930
  188   HH22  ARG  25          1HH2      ARG  25  -1.963   3.906   5.224
  189    H    CYS  26           H        CYS  26  -1.701   1.144  -1.789
  190    HA   CYS  26           HA       CYS  26  -2.962   0.383  -4.110
  191    HB2  CYS  26           1HB      CYS  26  -2.531  -1.085  -2.141
  192    HB3  CYS  26           2HB      CYS  26  -3.883  -0.316  -1.315
  193    HA   PRO  27           HA       PRO  27  -6.361   3.239  -4.346
  194    HB2  PRO  27           1HB      PRO  27  -7.515   2.136  -6.542
  195    HB3  PRO  27           2HB      PRO  27  -6.069   3.149  -6.623
  196    HG2  PRO  27           1HG      PRO  27  -6.296   0.164  -6.667
  197    HG3  PRO  27           2HG      PRO  27  -5.274   1.223  -7.656
  198    HD2  PRO  27           1HD      PRO  27  -4.326  -0.124  -5.507
  199    HD3  PRO  27           2HD      PRO  27  -3.695   1.463  -5.993
  200    H    ALA  28           H        ALA  28  -6.396   0.256  -3.113
  201    HA   ALA  28           HA       ALA  28  -9.339   0.113  -3.001
  202    HB1  ALA  28           3HB      ALA  28  -8.884  -2.332  -2.360
  203    HB2  ALA  28           1HB      ALA  28  -8.684  -1.862  -4.049
  204    HB3  ALA  28           2HB      ALA  28  -7.269  -2.055  -3.012
  205    H    CYS  29           H        CYS  29  -6.582  -1.091  -1.079
  206    HA   CYS  29           HA       CYS  29  -8.070  -0.511   1.362
  207    HB2  CYS  29           1HB      CYS  29  -6.135  -1.704   2.462
  208    HB3  CYS  29           2HB      CYS  29  -7.071  -2.678   1.332
  209    H    ARG  30           H        ARG  30  -5.600   0.837  -0.568
  210    HA   ARG  30           HA       ARG  30  -4.445   2.795  -0.383
  211    HB2  ARG  30           1HB      ARG  30  -5.719   3.171   2.326
  212    HB3  ARG  30           2HB      ARG  30  -5.030   4.406   1.281
  213    HG2  ARG  30           1HG      ARG  30  -7.428   2.767   0.515
  214    HG3  ARG  30           2HG      ARG  30  -7.539   4.308   1.367
  215    HD2  ARG  30           1HD      ARG  30  -6.083   5.222  -0.552
  216    HD3  ARG  30           2HD      ARG  30  -6.547   3.752  -1.407
  217    HE   ARG  30           HE       ARG  30  -8.768   5.225  -0.323
  218   HH11  ARG  30          2HH1      ARG  30  -6.623   4.847  -3.039
  219   HH12  ARG  30          1HH1      ARG  30  -7.726   5.552  -4.174
  220   HH21  ARG  30          2HH2      ARG  30 -10.228   6.156  -1.808
  221   HH22  ARG  30          1HH2      ARG  30  -9.775   6.298  -3.472
  222    H    VAL  31           H        VAL  31  -3.140   0.494   0.205
  223    HA   VAL  31           HA       VAL  31  -1.695   0.886   2.711
  224    HB   VAL  31           HB       VAL  31  -0.545  -1.250   2.086
  225   HG11  VAL  31          1HG1      VAL  31  -3.434  -0.940   2.620
  226   HG12  VAL  31          2HG1      VAL  31  -2.886  -2.553   2.156
  227   HG13  VAL  31          3HG1      VAL  31  -2.184  -1.753   3.563
  228   HG21  VAL  31          3HG2      VAL  31  -1.487  -2.596   0.279
  229   HG22  VAL  31          1HG2      VAL  31  -2.567  -1.270  -0.153
  230   HG23  VAL  31          2HG2      VAL  31  -0.823  -1.084  -0.339
  231    HA   PRO  32           HA       PRO  32   1.741   2.909   0.851
  232    HB2  PRO  32           1HB      PRO  32   3.681   2.210   2.617
  233    HB3  PRO  32           2HB      PRO  32   2.424   3.396   2.990
  234    HG2  PRO  32           1HG      PRO  32   2.581   0.502   3.740
  235    HG3  PRO  32           2HG      PRO  32   2.089   1.890   4.729
  236    HD2  PRO  32           1HD      PRO  32   0.300   0.212   3.581
  237    HD3  PRO  32           2HD      PRO  32  -0.033   1.938   3.832
  238    H    TYR  33           H        TYR  33   2.640   2.216  -0.982
  239    HA   TYR  33           HA       TYR  33   4.412  -0.101  -0.906
  240    HB2  TYR  33           1HB      TYR  33   3.330  -1.361  -2.480
  241    HB3  TYR  33           2HB      TYR  33   1.930  -0.582  -1.752
  242    HD1  TYR  33           HD2      TYR  33   4.417   0.042  -4.476
  243    HD2  TYR  33           HD1      TYR  33   0.380   0.365  -3.172
  244    HE1  TYR  33           HE2      TYR  33   3.786   0.948  -6.673
  245    HE2  TYR  33           HE1      TYR  33  -0.263   1.271  -5.367
  246    HH   TYR  33           HH       TYR  33   2.141   2.046  -7.809
  247    H    CYS  34           H        CYS  34   6.253   0.322  -1.929
  248    HA   CYS  34           HA       CYS  34   6.737   2.810  -3.169
  249    HB2  CYS  34           1HB      CYS  34   8.900   1.576  -3.928
  250    HB3  CYS  34           2HB      CYS  34   8.635   1.864  -2.211
  251    H    SER  35           H        SER  35   7.131  -0.390  -4.687
  252    HA   SER  35           HA       SER  35   6.127   0.790  -7.195
  253    HB2  SER  35           1HB      SER  35   8.628  -0.058  -6.910
  254    HB3  SER  35           2HB      SER  35   7.886  -1.623  -7.240
  255    HG   SER  35           HG       SER  35   8.599   0.157  -8.997
  256    H    VAL  36           H        VAL  36   5.528  -1.165  -8.760
  257    HA   VAL  36           HA       VAL  36   3.178  -2.303  -7.736
  258    HB   VAL  36           HB       VAL  36   4.765  -3.135 -10.169
  259   HG11  VAL  36          1HG1      VAL  36   3.313  -4.796 -10.409
  260   HG12  VAL  36          2HG1      VAL  36   2.462  -4.303  -8.944
  261   HG13  VAL  36          3HG1      VAL  36   2.008  -3.614 -10.503
  262   HG21  VAL  36          3HG2      VAL  36   3.674  -0.715  -9.766
  263   HG22  VAL  36          1HG2      VAL  36   3.757  -1.489 -11.349
  264   HG23  VAL  36          2HG2      VAL  36   2.270  -1.570 -10.404
  265    H    VAL  37           H        VAL  37   6.456  -3.516  -7.940
  266    HA   VAL  37           HA       VAL  37   6.108  -6.227  -7.616
  267    HB   VAL  37           HB       VAL  37   8.220  -4.505  -6.310
  268   HG11  VAL  37          1HG1      VAL  37   9.487  -6.426  -5.917
  269   HG12  VAL  37          2HG1      VAL  37   7.854  -6.891  -5.435
  270   HG13  VAL  37          3HG1      VAL  37   8.497  -7.412  -6.993
  271   HG21  VAL  37          3HG2      VAL  37   8.585  -4.104  -8.529
  272   HG22  VAL  37          1HG2      VAL  37   9.501  -5.600  -8.349
  273   HG23  VAL  37          2HG2      VAL  37   7.877  -5.637  -9.037
  274    H    CYS  38           H        CYS  38   6.736  -3.981  -4.913
  275    HA   CYS  38           HA       CYS  38   6.155  -5.745  -2.855
  276    HB2  CYS  38           1HB      CYS  38   6.143  -2.766  -3.101
  277    HB3  CYS  38           2HB      CYS  38   5.484  -3.497  -1.641
  278    H    PHE  39           H        PHE  39   4.008  -3.904  -4.891
  279    HA   PHE  39           HA       PHE  39   1.683  -4.256  -3.260
  280    HB2  PHE  39           1HB      PHE  39   1.746  -2.381  -4.768
  281    HB3  PHE  39           2HB      PHE  39   2.027  -3.437  -6.148
  282    HD1  PHE  39           HD1      PHE  39  -0.448  -3.452  -3.354
  283    HD2  PHE  39           HD2      PHE  39   0.222  -3.428  -7.557
  284    HE1  PHE  39           HE1      PHE  39  -2.875  -3.586  -3.738
  285    HE2  PHE  39           HE2      PHE  39  -2.204  -3.561  -7.948
  286    HZ   PHE  39           HZ       PHE  39  -3.756  -3.639  -6.037
  287    H    ARG  40           H        ARG  40   3.172  -5.989  -5.918
  288    HA   ARG  40           HA       ARG  40   1.136  -7.624  -6.773
  289    HB2  ARG  40           1HB      ARG  40   4.072  -8.213  -6.405
  290    HB3  ARG  40           2HB      ARG  40   2.966  -9.341  -7.178
  291    HG2  ARG  40           1HG      ARG  40   2.386  -7.365  -8.728
  292    HG3  ARG  40           2HG      ARG  40   3.886  -6.658  -8.123
  293    HD2  ARG  40           1HD      ARG  40   5.090  -8.696  -8.826
  294    HD3  ARG  40           2HD      ARG  40   3.586  -9.328  -9.493
  295    HE   ARG  40           HE       ARG  40   5.262  -7.257 -10.620
  296   HH11  ARG  40          2HH1      ARG  40   2.145  -8.808 -10.621
  297   HH12  ARG  40          1HH1      ARG  40   1.735  -8.275 -12.217
  298   HH21  ARG  40          2HH2      ARG  40   4.734  -6.549 -12.723
  299   HH22  ARG  40          1HH2      ARG  40   3.209  -6.991 -13.413
  300    H    LYS  41           H        LYS  41   3.528  -8.584  -4.302
  301    HA   LYS  41           HA       LYS  41   2.337 -10.902  -3.442
  302    HB2  LYS  41           1HB      LYS  41   3.743  -8.898  -1.667
  303    HB3  LYS  41           2HB      LYS  41   3.539 -10.615  -1.344
  304    HG2  LYS  41           1HG      LYS  41   5.151 -11.233  -2.838
  305    HG3  LYS  41           2HG      LYS  41   4.917  -9.806  -3.850
  306    HD2  LYS  41           1HD      LYS  41   6.936  -9.313  -2.869
  307    HD3  LYS  41           2HD      LYS  41   5.823  -8.544  -1.735
  308    HE2  LYS  41           1HE      LYS  41   5.889 -10.768  -0.464
  309    HE3  LYS  41           2HE      LYS  41   7.303 -11.141  -1.449
  310    HZ1  LYS  41           3HZ      LYS  41   7.454  -9.902   0.883
  311    HZ2  LYS  41           1HZ      LYS  41   7.295  -8.551  -0.122
  312    HZ3  LYS  41           2HZ      LYS  41   8.567  -9.640  -0.364
  313    H    HIS  42           H        HIS  42   1.912  -7.705  -1.911
  314    HA   HIS  42           HA       HIS  42   0.013  -8.350  -0.041
  315    HB2  HIS  42           1HB      HIS  42   0.628  -6.166   0.201
  316    HB3  HIS  42           2HB      HIS  42   0.702  -5.883  -1.535
  317    HD1  HIS  42           HD1      HIS  42  -1.667  -5.836   1.363
  318    HD2  HIS  42           HD2      HIS  42  -1.654  -4.936  -2.693
  319    HE1  HIS  42           HE1      HIS  42  -3.810  -4.589   0.944
  320    H    LYS  43           H        LYS  43  -0.553  -7.425  -3.424
  321    HA   LYS  43           HA       LYS  43  -3.284  -7.362  -3.516
  322    HB2  LYS  43           1HB      LYS  43  -1.793  -6.896  -5.435
  323    HB3  LYS  43           2HB      LYS  43  -1.484  -8.620  -5.596
  324    HG2  LYS  43           1HG      LYS  43  -3.095  -8.109  -7.222
  325    HG3  LYS  43           2HG      LYS  43  -3.980  -8.899  -5.915
  326    HD2  LYS  43           1HD      LYS  43  -4.877  -6.853  -5.153
  327    HD3  LYS  43           2HD      LYS  43  -3.738  -5.907  -6.114
  328    HE2  LYS  43           1HE      LYS  43  -4.864  -7.109  -8.130
  329    HE3  LYS  43           2HE      LYS  43  -6.173  -7.409  -6.988
  330    HZ1  LYS  43           3HZ      LYS  43  -5.074  -4.702  -7.470
  331    HZ2  LYS  43           1HZ      LYS  43  -6.523  -5.117  -6.701
  332    HZ3  LYS  43           2HZ      LYS  43  -6.359  -5.333  -8.371
  333    H    GLU  44           H        GLU  44  -1.209 -10.187  -3.340
  334    HA   GLU  44           HA       GLU  44  -2.988 -12.197  -4.012
  335    HB2  GLU  44           1HB      GLU  44  -1.446 -13.649  -3.165
  336    HB3  GLU  44           2HB      GLU  44  -0.444 -12.205  -3.220
  337    HG2  GLU  44           1HG      GLU  44  -0.771 -11.808  -0.887
  338    HG3  GLU  44           2HG      GLU  44  -1.965 -13.100  -0.785
  339    H    GLN  45           H        GLN  45  -2.628 -10.462  -0.966
  340    HA   GLN  45           HA       GLN  45  -5.151 -11.677  -0.065
  341    HB2  GLN  45           1HB      GLN  45  -4.346 -11.808   2.192
  342    HB3  GLN  45           2HB      GLN  45  -3.184 -12.620   1.151
  343    HG2  GLN  45           1HG      GLN  45  -2.713  -9.758   1.736
  344    HG3  GLN  45           2HG      GLN  45  -2.465 -10.909   3.048
  345   HE21  GLN  45          1HE2      GLN  45  -1.220 -12.937   2.256
  346   HE22  GLN  45          2HE2      GLN  45   0.209 -12.603   1.344
  347    H    CYS  46           H        CYS  46  -4.502  -9.120  -1.419
  348    HA   CYS  46           HA       CYS  46  -4.518  -6.926   0.270
  349    HB2  CYS  46           1HB      CYS  46  -4.224  -6.447  -2.002
  350    HB3  CYS  46           2HB      CYS  46  -5.634  -7.388  -2.479
  351    H    ASN  47           H        ASN  47  -5.901  -6.226   1.748
  352    HA   ASN  47           HA       ASN  47  -8.716  -7.076   1.549
  353    HB2  ASN  47           1HB      ASN  47  -7.285  -6.393   4.117
  354    HB3  ASN  47           2HB      ASN  47  -8.842  -7.194   3.926
  355   HD21  ASN  47          1HD2      ASN  47  -8.677  -9.255   2.547
  356   HD22  ASN  47          2HD2      ASN  47  -7.381 -10.320   2.961
  357    HA   PRO  48           HA       PRO  48  -9.054  -2.584   1.096
  358    HB2  PRO  48           1HB      PRO  48 -11.558  -2.669   0.052
  359    HB3  PRO  48           2HB      PRO  48 -10.105  -2.958  -0.912
  360    HG2  PRO  48           1HG      PRO  48 -12.000  -4.934   0.298
  361    HG3  PRO  48           2HG      PRO  48 -11.258  -4.937  -1.313
  362    HD2  PRO  48           1HD      PRO  48 -10.328  -6.462   0.722
  363    HD3  PRO  48           2HD      PRO  48  -9.265  -5.790  -0.531
  364    H    GLU  49           H        GLU  49 -11.108  -1.147   1.628
  365    HA   GLU  49           HA       GLU  49 -11.849  -1.844   4.368
  366    HB2  GLU  49           1HB      GLU  49 -11.703   0.709   2.814
  367    HB3  GLU  49           2HB      GLU  49 -12.747   0.623   4.226
  368    HG2  GLU  49           1HG      GLU  49 -10.816   1.424   5.149
  369    HG3  GLU  49           2HG      GLU  49 -10.616  -0.309   5.398
  370    H    THR  50           H        THR  50 -13.443  -3.411   3.792
  371    HA   THR  50           HA       THR  50 -15.801  -2.475   2.361
  372    HB   THR  50           HB       THR  50 -16.624  -4.805   2.650
  373    HG1  THR  50           HG1      THR  50 -14.045  -5.436   3.643
  374   HG21  THR  50          3HG2      THR  50 -15.155  -5.795   1.050
  375   HG22  THR  50          1HG2      THR  50 -13.819  -4.755   1.542
  376   HG23  THR  50          2HG2      THR  50 -15.210  -4.067   0.703
  377    H    SER  51           H        SER  51 -14.994  -3.816   5.557
  378    HA   SER  51           HA       SER  51 -17.603  -3.470   6.625
  379    HB2  SER  51           1HB      SER  51 -14.910  -3.906   7.922
  380    HB3  SER  51           2HB      SER  51 -16.409  -3.787   8.845
  381    HG   SER  51           HG       SER  51 -17.072  -5.508   7.162
  382    H    GLY  52           H        GLY  52 -14.623  -1.557   6.805
  383    HA2  GLY  52           1HA      GLY  52 -15.522   0.942   6.707
  384    HA3  GLY  52           2HA      GLY  52 -15.980   0.510   8.348
  385    HA   PRO  53           HA       PRO  53 -11.797   2.337   8.699
  386    HB2  PRO  53           1HB      PRO  53 -12.261   3.449  11.132
  387    HB3  PRO  53           2HB      PRO  53 -12.719   4.232   9.615
  388    HG2  PRO  53           1HG      PRO  53 -14.407   2.651  11.515
  389    HG3  PRO  53           2HG      PRO  53 -14.786   4.167  10.678
  390    HD2  PRO  53           1HD      PRO  53 -15.697   1.764   9.824
  391    HD3  PRO  53           2HD      PRO  53 -15.319   3.093   8.709
  392    H    SER  54           H        SER  54 -10.211   1.034   9.339
  393    HA   SER  54           HA       SER  54 -10.323  -0.224  11.959
  394    HB2  SER  54           1HB      SER  54 -10.163  -1.765   9.372
  395    HB3  SER  54           2HB      SER  54  -9.564  -2.429  10.891
  396    HG   SER  54           HG       SER  54 -11.898  -2.777  10.157
  397    H    SER  55           H        SER  55  -8.452   0.170  12.916
  398    HA   SER  55           HA       SER  55  -6.288   1.455  11.974
  399    HB2  SER  55           1HB      SER  55  -6.113  -0.860  13.917
  400    HB3  SER  55           2HB      SER  55  -4.966   0.472  13.770
  401    HG   SER  55           HG       SER  55  -6.611   1.884  14.439
  402    H    GLY  56           H        GLY  56  -6.412  -2.112  12.146
  403    HA2  GLY  56           1HA      GLY  56  -4.994  -3.651  11.121
  404    HA3  GLY  56           2HA      GLY  56  -5.687  -2.885   9.699
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1 -17.034  20.433  28.773
    2    HA2  GLY   1           1HA      GLY   1 -15.488  22.793  29.001
    3    HA3  GLY   1           2HA      GLY   1 -14.869  21.575  30.106
    4    H    SER   2           H        SER   2 -16.165  21.416  26.791
    5    HA   SER   2           HA       SER   2 -14.106  19.557  26.025
    6    HB2  SER   2           1HB      SER   2 -15.207  19.729  23.762
    7    HB3  SER   2           2HB      SER   2 -16.282  19.226  25.067
    8    HG   SER   2           HG       SER   2 -16.050  21.944  24.368
    9    H    SER   3           H        SER   3 -12.223  20.839  26.368
   10    HA   SER   3           HA       SER   3 -11.657  22.621  24.108
   11    HB2  SER   3           1HB      SER   3 -11.196  23.232  27.028
   12    HB3  SER   3           2HB      SER   3 -10.328  24.068  25.740
   13    HG   SER   3           HG       SER   3 -12.043  25.326  25.936
   14    H    GLY   4           H        GLY   4  -9.650  22.405  23.243
   15    HA2  GLY   4           1HA      GLY   4  -7.259  21.762  24.207
   16    HA3  GLY   4           2HA      GLY   4  -8.044  20.190  24.248
   17    H    SER   5           H        SER   5  -7.590  22.913  21.990
   18    HA   SER   5           HA       SER   5  -7.785  21.200  19.698
   19    HB2  SER   5           1HB      SER   5  -7.112  24.108  20.093
   20    HB3  SER   5           2HB      SER   5  -6.949  23.341  18.513
   21    HG   SER   5           HG       SER   5  -9.012  23.604  18.305
   22    H    SER   6           H        SER   6  -5.146  22.923  21.331
   23    HA   SER   6           HA       SER   6  -3.080  22.213  19.594
   24    HB2  SER   6           1HB      SER   6  -2.972  22.710  22.579
   25    HB3  SER   6           2HB      SER   6  -1.568  22.661  21.512
   26    HG   SER   6           HG       SER   6  -1.962  24.673  21.107
   27    H    GLY   7           H        GLY   7  -2.800  20.158  18.951
   28    HA2  GLY   7           1HA      GLY   7  -1.452  18.252  20.288
   29    HA3  GLY   7           2HA      GLY   7  -3.104  17.954  20.809
   30    H    LEU   8           H        LEU   8  -1.036  18.205  17.948
   31    HA   LEU   8           HA       LEU   8  -2.997  16.908  16.269
   32    HB2  LEU   8           1HB      LEU   8  -0.267  18.037  15.887
   33    HB3  LEU   8           2HB      LEU   8  -0.884  16.887  14.702
   34    HG   LEU   8           HG       LEU   8  -2.830  18.398  14.341
   35   HD11  LEU   8          1HD1      LEU   8  -2.730  19.536  16.523
   36   HD12  LEU   8          2HD1      LEU   8  -2.752  20.665  15.169
   37   HD13  LEU   8          3HD1      LEU   8  -1.242  20.336  16.017
   38   HD21  LEU   8          3HD2      LEU   8  -0.056  19.467  13.858
   39   HD22  LEU   8          1HD2      LEU   8  -1.510  20.149  13.131
   40   HD23  LEU   8          2HD2      LEU   8  -1.041  18.488  12.770
   41    H    LYS   9           H        LYS   9  -2.983  14.825  15.557
   42    HA   LYS   9           HA       LYS   9  -1.043  13.025  16.847
   43    HB2  LYS   9           1HB      LYS   9  -2.744  11.266  16.601
   44    HB3  LYS   9           2HB      LYS   9  -3.342  12.624  17.545
   45    HG2  LYS   9           1HG      LYS   9  -4.332  13.455  15.317
   46    HG3  LYS   9           2HG      LYS   9  -4.067  11.800  14.762
   47    HD2  LYS   9           1HD      LYS   9  -5.290  11.222  17.034
   48    HD3  LYS   9           2HD      LYS   9  -5.952  12.844  16.817
   49    HE2  LYS   9           1HE      LYS   9  -6.947  12.269  14.758
   50    HE3  LYS   9           2HE      LYS   9  -6.011  10.780  14.633
   51    HZ1  LYS   9           3HZ      LYS   9  -7.347  10.450  16.955
   52    HZ2  LYS   9           1HZ      LYS   9  -7.832   9.823  15.460
   53    HZ3  LYS   9           2HZ      LYS   9  -8.484  11.281  16.017
   54    H    CYS  10           H        CYS  10  -0.230  14.308  14.544
   55    HA   CYS  10           HA       CYS  10  -0.752  12.855  12.173
   56    HB2  CYS  10           1HB      CYS  10   1.419  14.759  13.013
   57    HB3  CYS  10           2HB      CYS  10   1.487  13.942  11.456
   58    HG   CYS  10           HG       CYS  10   0.539  16.545  11.070
   59    H    SER  11           H        SER  11   0.598  11.384  11.047
   60    HA   SER  11           HA       SER  11   2.852  10.182  12.381
   61    HB2  SER  11           1HB      SER  11   1.215   8.933  13.561
   62    HB3  SER  11           2HB      SER  11   0.229   8.714  12.116
   63    HG   SER  11           HG       SER  11   2.034   7.075  13.043
   64    H    THR  12           H        THR  12   3.953   8.615  11.049
   65    HA   THR  12           HA       THR  12   3.290   8.920   8.193
   66    HB   THR  12           HB       THR  12   5.676   8.591   7.712
   67    HG1  THR  12           HG1      THR  12   6.992   8.903   9.821
   68   HG21  THR  12          3HG2      THR  12   4.772  10.809   9.489
   69   HG22  THR  12          1HG2      THR  12   5.259  10.851   7.795
   70   HG23  THR  12          2HG2      THR  12   6.480  10.708   9.060
   71    H    VAL  13           H        VAL  13   3.378   7.139   6.844
   72    HA   VAL  13           HA       VAL  13   3.629   4.530   8.196
   73    HB   VAL  13           HB       VAL  13   1.302   5.174   7.432
   74   HG11  VAL  13          1HG1      VAL  13   0.764   5.077   5.103
   75   HG12  VAL  13          2HG1      VAL  13   2.075   6.240   5.309
   76   HG13  VAL  13          3HG1      VAL  13   2.416   4.625   4.686
   77   HG21  VAL  13          3HG2      VAL  13   2.680   2.683   6.472
   78   HG22  VAL  13          1HG2      VAL  13   1.669   2.904   7.901
   79   HG23  VAL  13          2HG2      VAL  13   0.941   2.917   6.294
   80    H    VAL  14           H        VAL  14   4.579   2.821   7.046
   81    HA   VAL  14           HA       VAL  14   6.092   3.629   4.647
   82    HB   VAL  14           HB       VAL  14   7.882   2.083   5.360
   83   HG11  VAL  14          1HG1      VAL  14   8.615   3.478   7.383
   84   HG12  VAL  14          2HG1      VAL  14   8.327   4.323   5.861
   85   HG13  VAL  14          3HG1      VAL  14   7.115   4.372   7.142
   86   HG21  VAL  14          3HG2      VAL  14   7.358   1.852   8.120
   87   HG22  VAL  14          1HG2      VAL  14   5.914   1.294   7.275
   88   HG23  VAL  14          2HG2      VAL  14   7.479   0.560   6.925
   89    H    CYS  15           H        CYS  15   6.784   1.766   3.287
   90    HA   CYS  15           HA       CYS  15   4.649   0.298   2.356
   91    HB2  CYS  15           1HB      CYS  15   6.880   0.695   1.215
   92    HB3  CYS  15           2HB      CYS  15   7.514  -0.637   2.177
   93    H    VAL  16           H        VAL  16   3.550  -1.384   3.102
   94    HA   VAL  16           HA       VAL  16   4.322  -2.719   5.508
   95    HB   VAL  16           HB       VAL  16   2.296  -4.101   5.138
   96   HG11  VAL  16          1HG1      VAL  16   1.784  -1.158   4.728
   97   HG12  VAL  16          2HG1      VAL  16   0.705  -2.332   5.483
   98   HG13  VAL  16          3HG1      VAL  16   2.221  -1.891   6.271
   99   HG21  VAL  16          3HG2      VAL  16   1.913  -2.435   2.654
  100   HG22  VAL  16          1HG2      VAL  16   2.442  -4.118   2.659
  101   HG23  VAL  16          2HG2      VAL  16   0.841  -3.695   3.266
  102    H    ILE  17           H        ILE  17   5.719  -3.023   2.689
  103    HA   ILE  17           HA       ILE  17   5.940  -5.960   2.823
  104    HB   ILE  17           HB       ILE  17   6.508  -4.214   0.425
  105   HG12  ILE  17          1HG1      ILE  17   4.126  -4.195   0.886
  106   HG13  ILE  17          2HG1      ILE  17   4.436  -5.217  -0.513
  107   HG21  ILE  17          1HG2      ILE  17   6.383  -7.209   0.753
  108   HG22  ILE  17          2HG2      ILE  17   6.558  -6.364  -0.784
  109   HG23  ILE  17          3HG2      ILE  17   7.823  -6.242   0.438
  110   HD11  ILE  17          3HD1      ILE  17   4.473  -7.127   1.265
  111   HD12  ILE  17          1HD1      ILE  17   3.556  -5.967   2.227
  112   HD13  ILE  17          2HD1      ILE  17   2.944  -6.492   0.658
  113    H    CYS  18           H        CYS  18   7.838  -3.133   1.744
  114    HA   CYS  18           HA       CYS  18  10.245  -4.465   2.790
  115    HB2  CYS  18           1HB      CYS  18  11.534  -3.137   1.231
  116    HB3  CYS  18           2HB      CYS  18  10.238  -3.947   0.357
  117    H    LEU  19           H        LEU  19   8.082  -1.969   3.388
  118    HA   LEU  19           HA       LEU  19   8.027  -0.270   4.898
  119    HB2  LEU  19           1HB      LEU  19  10.500  -1.664   5.905
  120    HB3  LEU  19           2HB      LEU  19   9.722  -0.317   6.733
  121    HG   LEU  19           HG       LEU  19   7.628  -1.839   6.736
  122   HD11  LEU  19          1HD1      LEU  19   9.516  -3.541   5.458
  123   HD12  LEU  19          2HD1      LEU  19   7.827  -3.859   5.851
  124   HD13  LEU  19          3HD1      LEU  19   9.091  -4.241   7.020
  125   HD21  LEU  19          3HD2      LEU  19   9.492  -1.245   8.587
  126   HD22  LEU  19          1HD2      LEU  19   9.654  -3.001   8.533
  127   HD23  LEU  19          2HD2      LEU  19   8.091  -2.270   8.900
  128    H    GLU  20           H        GLU  20   8.828   0.605   2.566
  129    HA   GLU  20           HA       GLU  20  11.032   2.448   3.199
  130    HB2  GLU  20           1HB      GLU  20  10.556   1.059   0.556
  131    HB3  GLU  20           2HB      GLU  20  11.730   2.341   0.818
  132    HG2  GLU  20           1HG      GLU  20  12.728   0.823   2.608
  133    HG3  GLU  20           2HG      GLU  20  11.745  -0.454   1.894
  134    H    LYS  21           H        LYS  21  10.967   4.471   2.013
  135    HA   LYS  21           HA       LYS  21   8.666   5.879   2.170
  136    HB2  LYS  21           1HB      LYS  21  10.684   7.051   1.727
  137    HB3  LYS  21           2HB      LYS  21  10.942   6.186   0.217
  138    HG2  LYS  21           1HG      LYS  21   9.184   7.360  -0.857
  139    HG3  LYS  21           2HG      LYS  21   8.625   8.047   0.670
  140    HD2  LYS  21           1HD      LYS  21  10.995   9.080   0.796
  141    HD3  LYS  21           2HD      LYS  21  11.064   8.730  -0.933
  142    HE2  LYS  21           1HE      LYS  21   8.711  10.179   0.209
  143    HE3  LYS  21           2HE      LYS  21  10.212  11.050  -0.104
  144    HZ1  LYS  21           3HZ      LYS  21   9.038   9.366  -2.212
  145    HZ2  LYS  21           1HZ      LYS  21  10.034  10.726  -2.359
  146    HZ3  LYS  21           2HZ      LYS  21   8.408  10.911  -1.931
  147    HA   PRO  22           HA       PRO  22   6.265   3.679  -0.972
  148    HB2  PRO  22           1HB      PRO  22   3.868   4.586  -0.075
  149    HB3  PRO  22           2HB      PRO  22   4.717   3.224   0.665
  150    HG2  PRO  22           1HG      PRO  22   4.604   6.085   1.537
  151    HG3  PRO  22           2HG      PRO  22   4.486   4.612   2.516
  152    HD2  PRO  22           1HD      PRO  22   6.768   6.057   2.328
  153    HD3  PRO  22           2HD      PRO  22   6.769   4.295   2.541
  154    H    LYS  23           H        LYS  23   5.965   4.452  -2.957
  155    HA   LYS  23           HA       LYS  23   5.791   7.317  -3.389
  156    HB2  LYS  23           1HB      LYS  23   6.207   4.936  -5.169
  157    HB3  LYS  23           2HB      LYS  23   5.782   6.497  -5.858
  158    HG2  LYS  23           1HG      LYS  23   7.793   7.439  -5.322
  159    HG3  LYS  23           2HG      LYS  23   8.054   6.366  -3.945
  160    HD2  LYS  23           1HD      LYS  23   9.613   5.704  -5.595
  161    HD3  LYS  23           2HD      LYS  23   8.329   4.493  -5.626
  162    HE2  LYS  23           1HE      LYS  23   7.333   5.563  -7.562
  163    HE3  LYS  23           2HE      LYS  23   8.541   6.846  -7.504
  164    HZ1  LYS  23           3HZ      LYS  23   8.955   3.991  -8.172
  165    HZ2  LYS  23           1HZ      LYS  23  10.237   5.031  -7.803
  166    HZ3  LYS  23           2HZ      LYS  23   9.254   5.342  -9.143
  167    H    TYR  24           H        TYR  24   3.766   4.480  -3.615
  168    HA   TYR  24           HA       TYR  24   1.461   6.216  -4.095
  169    HB2  TYR  24           1HB      TYR  24   1.562   3.615  -5.563
  170    HB3  TYR  24           2HB      TYR  24   0.668   5.082  -5.947
  171    HD1  TYR  24           HD1      TYR  24   3.981   3.466  -6.082
  172    HD2  TYR  24           HD2      TYR  24   1.630   6.795  -7.306
  173    HE1  TYR  24           HE1      TYR  24   5.728   4.100  -7.693
  174    HE2  TYR  24           HE2      TYR  24   3.371   7.438  -8.921
  175    HH   TYR  24           HH       TYR  24   6.289   6.707  -8.866
  176    H    ARG  25           H        ARG  25  -0.624   4.822  -3.902
  177    HA   ARG  25           HA       ARG  25  -0.278   2.809  -1.786
  178    HB2  ARG  25           1HB      ARG  25  -1.992   5.264  -1.775
  179    HB3  ARG  25           2HB      ARG  25  -2.528   3.832  -0.906
  180    HG2  ARG  25           1HG      ARG  25  -0.351   3.858   0.318
  181    HG3  ARG  25           2HG      ARG  25  -0.010   5.411  -0.449
  182    HD2  ARG  25           1HD      ARG  25  -2.464   4.859   1.209
  183    HD3  ARG  25           2HD      ARG  25  -0.980   5.557   1.858
  184    HE   ARG  25           HE       ARG  25  -1.933   7.013  -0.396
  185   HH11  ARG  25          2HH1      ARG  25  -2.426   6.508   3.013
  186   HH12  ARG  25          1HH1      ARG  25  -3.103   8.080   3.281
  187   HH21  ARG  25          2HH2      ARG  25  -2.823   9.086  -0.056
  188   HH22  ARG  25          1HH2      ARG  25  -3.330   9.545   1.534
  189    H    CYS  26           H        CYS  26  -2.218   1.437  -1.484
  190    HA   CYS  26           HA       CYS  26  -3.160   0.508  -4.025
  191    HB2  CYS  26           1HB      CYS  26  -2.637  -1.075  -2.241
  192    HB3  CYS  26           2HB      CYS  26  -3.874  -0.356  -1.215
  193    HA   PRO  27           HA       PRO  27  -6.784   3.060  -4.171
  194    HB2  PRO  27           1HB      PRO  27  -7.934   1.847  -6.310
  195    HB3  PRO  27           2HB      PRO  27  -6.566   2.957  -6.456
  196    HG2  PRO  27           1HG      PRO  27  -6.585  -0.037  -6.453
  197    HG3  PRO  27           2HG      PRO  27  -5.674   1.075  -7.492
  198    HD2  PRO  27           1HD      PRO  27  -4.561  -0.171  -5.361
  199    HD3  PRO  27           2HD      PRO  27  -4.060   1.448  -5.889
  200    H    ALA  28           H        ALA  28  -6.570   0.143  -2.851
  201    HA   ALA  28           HA       ALA  28  -9.490  -0.204  -2.636
  202    HB1  ALA  28           3HB      ALA  28  -9.272  -2.513  -2.551
  203    HB2  ALA  28           1HB      ALA  28  -8.083  -2.050  -3.768
  204    HB3  ALA  28           2HB      ALA  28  -7.561  -2.436  -2.128
  205    H    CYS  29           H        CYS  29  -6.574  -1.211  -0.838
  206    HA   CYS  29           HA       CYS  29  -7.984  -0.660   1.663
  207    HB2  CYS  29           1HB      CYS  29  -6.013  -1.828   2.701
  208    HB3  CYS  29           2HB      CYS  29  -6.955  -2.821   1.595
  209    H    ARG  30           H        ARG  30  -5.796   0.815  -0.422
  210    HA   ARG  30           HA       ARG  30  -4.572   2.728  -0.300
  211    HB2  ARG  30           1HB      ARG  30  -6.015   3.069   2.336
  212    HB3  ARG  30           2HB      ARG  30  -5.066   4.314   1.534
  213    HG2  ARG  30           1HG      ARG  30  -7.337   4.761   1.058
  214    HG3  ARG  30           2HG      ARG  30  -6.627   4.107  -0.419
  215    HD2  ARG  30           1HD      ARG  30  -7.813   2.163  -0.291
  216    HD3  ARG  30           2HD      ARG  30  -7.882   2.195   1.470
  217    HE   ARG  30           HE       ARG  30  -9.762   3.378  -0.368
  218   HH11  ARG  30          2HH1      ARG  30  -8.509   3.374   2.880
  219   HH12  ARG  30          1HH1      ARG  30  -9.936   4.074   3.570
  220   HH21  ARG  30          2HH2      ARG  30 -11.646   4.300   0.529
  221   HH22  ARG  30          1HH2      ARG  30 -11.720   4.599   2.232
  222    H    VAL  31           H        VAL  31  -3.253   0.435   0.382
  223    HA   VAL  31           HA       VAL  31  -1.759   0.961   2.832
  224    HB   VAL  31           HB       VAL  31  -0.633  -1.196   2.350
  225   HG11  VAL  31          1HG1      VAL  31  -2.408  -1.487   3.791
  226   HG12  VAL  31          2HG1      VAL  31  -3.603  -0.992   2.591
  227   HG13  VAL  31          3HG1      VAL  31  -2.842  -2.580   2.478
  228   HG21  VAL  31          3HG2      VAL  31  -2.508  -1.258  -0.012
  229   HG22  VAL  31          1HG2      VAL  31  -0.746  -1.199  -0.062
  230   HG23  VAL  31          2HG2      VAL  31  -1.563  -2.632   0.563
  231    HA   PRO  32           HA       PRO  32   1.658   2.881   0.842
  232    HB2  PRO  32           1HB      PRO  32   3.651   2.177   2.545
  233    HB3  PRO  32           2HB      PRO  32   2.424   3.383   2.949
  234    HG2  PRO  32           1HG      PRO  32   2.570   0.496   3.726
  235    HG3  PRO  32           2HG      PRO  32   2.132   1.900   4.716
  236    HD2  PRO  32           1HD      PRO  32   0.282   0.234   3.652
  237    HD3  PRO  32           2HD      PRO  32  -0.020   1.967   3.894
  238    H    TYR  33           H        TYR  33   2.647   2.237  -0.957
  239    HA   TYR  33           HA       TYR  33   4.291  -0.166  -0.930
  240    HB2  TYR  33           1HB      TYR  33   3.163  -1.350  -2.528
  241    HB3  TYR  33           2HB      TYR  33   1.793  -0.516  -1.803
  242    HD1  TYR  33           HD2      TYR  33   4.321  -0.039  -4.515
  243    HD2  TYR  33           HD1      TYR  33   0.324   0.593  -3.200
  244    HE1  TYR  33           HE2      TYR  33   3.760   0.928  -6.705
  245    HE2  TYR  33           HE1      TYR  33  -0.248   1.561  -5.388
  246    HH   TYR  33           HH       TYR  33   1.086   2.741  -7.285
  247    H    CYS  34           H        CYS  34   6.170   0.252  -1.873
  248    HA   CYS  34           HA       CYS  34   6.739   2.727  -3.097
  249    HB2  CYS  34           1HB      CYS  34   8.887   1.437  -3.815
  250    HB3  CYS  34           2HB      CYS  34   8.595   1.739  -2.106
  251    H    SER  35           H        SER  35   7.154  -0.458  -4.635
  252    HA   SER  35           HA       SER  35   6.187   0.742  -7.148
  253    HB2  SER  35           1HB      SER  35   8.275  -1.411  -6.737
  254    HB3  SER  35           2HB      SER  35   7.648  -0.916  -8.310
  255    HG   SER  35           HG       SER  35   8.545   1.093  -8.024
  256    H    VAL  36           H        VAL  36   5.641  -1.213  -8.743
  257    HA   VAL  36           HA       VAL  36   3.261  -2.347  -7.822
  258    HB   VAL  36           HB       VAL  36   4.968  -3.296 -10.129
  259   HG11  VAL  36          1HG1      VAL  36   2.100  -3.575 -10.409
  260   HG12  VAL  36          2HG1      VAL  36   3.377  -4.773 -10.627
  261   HG13  VAL  36          3HG1      VAL  36   2.712  -4.473  -9.020
  262   HG21  VAL  36          3HG2      VAL  36   4.340  -0.873 -10.170
  263   HG22  VAL  36          1HG2      VAL  36   3.710  -1.817 -11.520
  264   HG23  VAL  36          2HG2      VAL  36   2.649  -1.371 -10.185
  265    H    VAL  37           H        VAL  37   6.500  -3.751  -8.130
  266    HA   VAL  37           HA       VAL  37   6.122  -6.381  -7.654
  267    HB   VAL  37           HB       VAL  37   8.207  -4.645  -6.326
  268   HG11  VAL  37          1HG1      VAL  37   9.512  -6.731  -6.126
  269   HG12  VAL  37          2HG1      VAL  37   8.038  -6.755  -5.157
  270   HG13  VAL  37          3HG1      VAL  37   8.106  -7.638  -6.682
  271   HG21  VAL  37          3HG2      VAL  37   8.533  -6.371  -8.766
  272   HG22  VAL  37          1HG2      VAL  37   8.034  -4.682  -8.864
  273   HG23  VAL  37          2HG2      VAL  37   9.600  -5.100  -8.169
  274    H    CYS  38           H        CYS  38   6.789  -4.183  -4.926
  275    HA   CYS  38           HA       CYS  38   6.070  -5.883  -2.885
  276    HB2  CYS  38           1HB      CYS  38   6.108  -2.907  -3.161
  277    HB3  CYS  38           2HB      CYS  38   5.395  -3.613  -1.715
  278    H    PHE  39           H        PHE  39   4.004  -3.817  -4.850
  279    HA   PHE  39           HA       PHE  39   1.637  -4.163  -3.346
  280    HB2  PHE  39           1HB      PHE  39   1.733  -2.341  -4.886
  281    HB3  PHE  39           2HB      PHE  39   2.116  -3.412  -6.229
  282    HD1  PHE  39           HD1      PHE  39  -0.559  -2.902  -3.680
  283    HD2  PHE  39           HD2      PHE  39   0.428  -3.961  -7.683
  284    HE1  PHE  39           HE1      PHE  39  -2.953  -3.067  -4.223
  285    HE2  PHE  39           HE2      PHE  39  -1.964  -4.127  -8.232
  286    HZ   PHE  39           HZ       PHE  39  -3.658  -3.680  -6.502
  287    H    ARG  40           H        ARG  40   3.218  -6.091  -5.775
  288    HA   ARG  40           HA       ARG  40   1.070  -7.701  -6.579
  289    HB2  ARG  40           1HB      ARG  40   3.992  -8.448  -6.353
  290    HB3  ARG  40           2HB      ARG  40   2.779  -9.317  -7.284
  291    HG2  ARG  40           1HG      ARG  40   2.477  -6.920  -8.391
  292    HG3  ARG  40           2HG      ARG  40   4.156  -6.765  -7.869
  293    HD2  ARG  40           1HD      ARG  40   4.796  -8.697  -9.121
  294    HD3  ARG  40           2HD      ARG  40   3.115  -9.089  -9.477
  295    HE   ARG  40           HE       ARG  40   3.102  -7.463 -11.123
  296   HH11  ARG  40          2HH1      ARG  40   6.059  -7.321  -9.293
  297   HH12  ARG  40          1HH1      ARG  40   6.854  -6.263 -10.411
  298   HH21  ARG  40          2HH2      ARG  40   4.137  -6.070 -12.604
  299   HH22  ARG  40          1HH2      ARG  40   5.759  -5.552 -12.294
  300    H    LYS  41           H        LYS  41   3.656  -8.583  -4.282
  301    HA   LYS  41           HA       LYS  41   2.536 -10.905  -3.306
  302    HB2  LYS  41           1HB      LYS  41   4.185  -8.883  -1.778
  303    HB3  LYS  41           2HB      LYS  41   3.910 -10.549  -1.286
  304    HG2  LYS  41           1HG      LYS  41   5.168 -11.391  -3.102
  305    HG3  LYS  41           2HG      LYS  41   5.213  -9.813  -3.892
  306    HD2  LYS  41           1HD      LYS  41   6.765  -8.964  -2.386
  307    HD3  LYS  41           2HD      LYS  41   6.383 -10.174  -1.159
  308    HE2  LYS  41           1HE      LYS  41   7.302 -11.871  -2.868
  309    HE3  LYS  41           2HE      LYS  41   8.018 -10.466  -3.657
  310    HZ1  LYS  41           3HZ      LYS  41   8.446 -11.126  -0.797
  311    HZ2  LYS  41           1HZ      LYS  41   9.271  -9.975  -1.723
  312    HZ3  LYS  41           2HZ      LYS  41   9.488 -11.623  -2.034
  313    H    HIS  42           H        HIS  42   1.705  -7.605  -2.585
  314    HA   HIS  42           HA       HIS  42   0.180  -8.192  -0.232
  315    HB2  HIS  42           1HB      HIS  42   0.788  -5.991  -0.160
  316    HB3  HIS  42           2HB      HIS  42   0.712  -5.801  -1.909
  317    HD1  HIS  42           HD1      HIS  42  -1.645  -6.067   1.055
  318    HD2  HIS  42           HD2      HIS  42  -1.512  -4.515  -2.797
  319    HE1  HIS  42           HE1      HIS  42  -3.778  -4.764   0.781
  320    H    LYS  43           H        LYS  43  -0.832  -7.004  -3.443
  321    HA   LYS  43           HA       LYS  43  -3.493  -7.160  -3.349
  322    HB2  LYS  43           1HB      LYS  43  -2.261  -6.631  -5.398
  323    HB3  LYS  43           2HB      LYS  43  -1.808  -8.321  -5.575
  324    HG2  LYS  43           1HG      LYS  43  -3.568  -8.246  -7.008
  325    HG3  LYS  43           2HG      LYS  43  -4.424  -8.665  -5.522
  326    HD2  LYS  43           1HD      LYS  43  -5.174  -6.452  -5.210
  327    HD3  LYS  43           2HD      LYS  43  -4.035  -5.815  -6.399
  328    HE2  LYS  43           1HE      LYS  43  -5.243  -6.852  -8.195
  329    HE3  LYS  43           2HE      LYS  43  -6.294  -7.698  -7.060
  330    HZ1  LYS  43           3HZ      LYS  43  -6.614  -5.111  -6.357
  331    HZ2  LYS  43           1HZ      LYS  43  -7.656  -5.977  -7.371
  332    HZ3  LYS  43           2HZ      LYS  43  -6.449  -4.997  -8.037
  333    H    GLU  44           H        GLU  44  -1.379  -9.984  -3.695
  334    HA   GLU  44           HA       GLU  44  -3.119 -12.014  -4.123
  335    HB2  GLU  44           1HB      GLU  44  -0.679 -11.830  -2.398
  336    HB3  GLU  44           2HB      GLU  44  -1.621 -13.314  -2.406
  337    HG2  GLU  44           1HG      GLU  44  -1.389 -13.222  -4.953
  338    HG3  GLU  44           2HG      GLU  44  -0.118 -12.037  -4.657
  339    H    GLN  45           H        GLN  45  -2.437 -10.553  -0.954
  340    HA   GLN  45           HA       GLN  45  -4.916 -11.793   0.048
  341    HB2  GLN  45           1HB      GLN  45  -3.942 -11.823   2.262
  342    HB3  GLN  45           2HB      GLN  45  -2.864 -12.644   1.141
  343    HG2  GLN  45           1HG      GLN  45  -1.636 -10.407   0.975
  344    HG3  GLN  45           2HG      GLN  45  -2.545  -9.953   2.416
  345   HE21  GLN  45          1HE2      GLN  45  -0.505  -9.767   3.478
  346   HE22  GLN  45          2HE2      GLN  45   0.300 -11.175   4.073
  347    H    CYS  46           H        CYS  46  -4.511  -9.200  -1.335
  348    HA   CYS  46           HA       CYS  46  -4.688  -7.092   0.550
  349    HB2  CYS  46           1HB      CYS  46  -4.058  -6.404  -1.591
  350    HB3  CYS  46           2HB      CYS  46  -5.316  -7.356  -2.373
  351    H    ASN  47           H        ASN  47  -6.235  -7.320   2.086
  352    HA   ASN  47           HA       ASN  47  -9.011  -7.678   1.168
  353    HB2  ASN  47           1HB      ASN  47  -8.172  -8.054   4.023
  354    HB3  ASN  47           2HB      ASN  47  -9.531  -8.769   3.161
  355   HD21  ASN  47          1HD2      ASN  47  -6.595  -9.395   4.456
  356   HD22  ASN  47          2HD2      ASN  47  -6.161 -10.796   3.542
  357    HA   PRO  48           HA       PRO  48  -9.100  -3.320   2.387
  358    HB2  PRO  48           1HB      PRO  48 -11.398  -2.776   1.046
  359    HB3  PRO  48           2HB      PRO  48  -9.817  -2.835   0.259
  360    HG2  PRO  48           1HG      PRO  48 -11.960  -4.923   0.363
  361    HG3  PRO  48           2HG      PRO  48 -10.961  -4.412  -1.010
  362    HD2  PRO  48           1HD      PRO  48 -10.440  -6.654   0.416
  363    HD3  PRO  48           2HD      PRO  48  -9.159  -5.680  -0.333
  364    H    GLU  49           H        GLU  49 -11.262  -2.002   3.027
  365    HA   GLU  49           HA       GLU  49 -12.089  -3.052   5.491
  366    HB2  GLU  49           1HB      GLU  49 -13.319  -0.858   3.815
  367    HB3  GLU  49           2HB      GLU  49 -13.746  -1.192   5.487
  368    HG2  GLU  49           1HG      GLU  49 -12.249   0.520   5.734
  369    HG3  GLU  49           2HG      GLU  49 -11.199  -0.885   5.914
  370    H    THR  50           H        THR  50 -13.407  -4.697   5.852
  371    HA   THR  50           HA       THR  50 -14.967  -6.011   3.986
  372    HB   THR  50           HB       THR  50 -15.506  -5.888   6.960
  373    HG1  THR  50           HG1      THR  50 -13.377  -6.791   5.664
  374   HG21  THR  50          3HG2      THR  50 -16.046  -8.220   5.154
  375   HG22  THR  50          1HG2      THR  50 -17.226  -6.920   5.319
  376   HG23  THR  50          2HG2      THR  50 -16.737  -7.852   6.735
  377    H    SER  51           H        SER  51 -17.134  -5.998   3.435
  378    HA   SER  51           HA       SER  51 -18.470  -3.445   3.786
  379    HB2  SER  51           1HB      SER  51 -19.179  -5.879   2.132
  380    HB3  SER  51           2HB      SER  51 -20.110  -4.381   2.148
  381    HG   SER  51           HG       SER  51 -18.772  -3.736   0.673
  382    H    GLY  52           H        GLY  52 -19.101  -6.871   4.475
  383    HA2  GLY  52           1HA      GLY  52 -21.654  -6.650   5.544
  384    HA3  GLY  52           2HA      GLY  52 -20.478  -7.867   6.018
  385    HA   PRO  53           HA       PRO  53 -20.610  -6.070  10.038
  386    HB2  PRO  53           1HB      PRO  53 -18.389  -7.252  11.058
  387    HB3  PRO  53           2HB      PRO  53 -19.908  -8.119  10.804
  388    HG2  PRO  53           1HG      PRO  53 -17.450  -8.062   9.095
  389    HG3  PRO  53           2HG      PRO  53 -18.470  -9.442   9.543
  390    HD2  PRO  53           1HD      PRO  53 -18.659  -8.212   7.139
  391    HD3  PRO  53           2HD      PRO  53 -20.057  -8.949   7.946
  392    H    SER  54           H        SER  54 -20.172  -3.898   9.293
  393    HA   SER  54           HA       SER  54 -17.474  -3.004   8.926
  394    HB2  SER  54           1HB      SER  54 -18.488  -0.740   8.867
  395    HB3  SER  54           2HB      SER  54 -19.298  -1.865   7.779
  396    HG   SER  54           HG       SER  54 -20.198  -0.737  10.177
  397    H    SER  55           H        SER  55 -16.058  -2.624  10.482
  398    HA   SER  55           HA       SER  55 -16.933  -2.423  13.239
  399    HB2  SER  55           1HB      SER  55 -14.883  -3.747  12.327
  400    HB3  SER  55           2HB      SER  55 -14.073  -2.181  12.352
  401    HG   SER  55           HG       SER  55 -13.715  -2.714  14.362
  402    H    GLY  56           H        GLY  56 -14.992  -0.466  10.981
  403    HA2  GLY  56           1HA      GLY  56 -15.962   1.946  12.316
  404    HA3  GLY  56           2HA      GLY  56 -14.224   1.687  12.305
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1  -1.583  39.186  21.891
    2    HA2  GLY   1           1HA      GLY   1   0.273  38.228  23.653
    3    HA3  GLY   1           2HA      GLY   1  -1.194  37.355  23.236
    4    H    SER   2           H        SER   2   0.911  35.874  23.955
    5    HA   SER   2           HA       SER   2   2.787  35.150  22.050
    6    HB2  SER   2           1HB      SER   2   2.388  34.339  24.531
    7    HB3  SER   2           2HB      SER   2   1.533  33.018  23.735
    8    HG   SER   2           HG       SER   2   3.492  32.723  22.478
    9    H    SER   3           H        SER   3   2.810  33.875  20.274
   10    HA   SER   3           HA       SER   3   0.395  32.370  19.578
   11    HB2  SER   3           1HB      SER   3   1.764  34.250  17.642
   12    HB3  SER   3           2HB      SER   3   0.318  33.287  17.338
   13    HG   SER   3           HG       SER   3  -0.632  34.523  19.129
   14    H    GLY   4           H        GLY   4   1.138  30.351  19.446
   15    HA2  GLY   4           1HA      GLY   4   3.127  29.695  17.469
   16    HA3  GLY   4           2HA      GLY   4   3.677  29.431  19.117
   17    H    SER   5           H        SER   5   0.722  28.798  17.219
   18    HA   SER   5           HA       SER   5   0.510  26.195  18.548
   19    HB2  SER   5           1HB      SER   5  -1.460  27.869  16.992
   20    HB3  SER   5           2HB      SER   5  -1.788  26.190  17.423
   21    HG   SER   5           HG       SER   5  -2.543  27.877  18.929
   22    H    SER   6           H        SER   6   2.554  26.397  16.687
   23    HA   SER   6           HA       SER   6   1.569  25.176  14.226
   24    HB2  SER   6           1HB      SER   6   3.895  25.405  13.435
   25    HB3  SER   6           2HB      SER   6   3.257  26.942  14.019
   26    HG   SER   6           HG       SER   6   5.348  25.454  14.950
   27    H    GLY   7           H        GLY   7   1.013  23.095  14.675
   28    HA2  GLY   7           1HA      GLY   7   3.189  21.246  15.139
   29    HA3  GLY   7           2HA      GLY   7   1.997  21.294  16.430
   30    H    LEU   8           H        LEU   8   2.580  19.012  14.866
   31    HA   LEU   8           HA       LEU   8  -0.078  18.528  13.759
   32    HB2  LEU   8           1HB      LEU   8   2.503  18.046  12.286
   33    HB3  LEU   8           2HB      LEU   8   0.968  17.311  11.827
   34    HG   LEU   8           HG       LEU   8   1.171  20.285  12.023
   35   HD11  LEU   8          1HD1      LEU   8   1.924  18.765   9.542
   36   HD12  LEU   8          2HD1      LEU   8   3.115  19.401  10.675
   37   HD13  LEU   8          3HD1      LEU   8   2.024  20.502   9.833
   38   HD21  LEU   8          3HD2      LEU   8  -0.294  19.498   9.805
   39   HD22  LEU   8          1HD2      LEU   8  -0.937  20.017  11.363
   40   HD23  LEU   8          2HD2      LEU   8  -0.692  18.301  11.038
   41    H    LYS   9           H        LYS   9  -0.807  16.455  14.024
   42    HA   LYS   9           HA       LYS   9   0.978  14.651  15.518
   43    HB2  LYS   9           1HB      LYS   9  -0.927  13.771  16.637
   44    HB3  LYS   9           2HB      LYS   9  -1.086  15.521  16.683
   45    HG2  LYS   9           1HG      LYS   9  -2.482  15.087  14.478
   46    HG3  LYS   9           2HG      LYS   9  -2.698  13.503  15.228
   47    HD2  LYS   9           1HD      LYS   9  -4.520  14.826  15.952
   48    HD3  LYS   9           2HD      LYS   9  -3.408  14.738  17.320
   49    HE2  LYS   9           1HE      LYS   9  -2.578  16.937  16.866
   50    HE3  LYS   9           2HE      LYS   9  -3.473  17.017  15.349
   51    HZ1  LYS   9           3HZ      LYS   9  -4.668  16.894  18.066
   52    HZ2  LYS   9           1HZ      LYS   9  -5.537  16.944  16.615
   53    HZ3  LYS   9           2HZ      LYS   9  -4.588  18.265  17.079
   54    H    CYS  10           H        CYS  10   1.155  14.685  12.747
   55    HA   CYS  10           HA       CYS  10  -0.311  12.289  11.891
   56    HB2  CYS  10           1HB      CYS  10   0.327  12.934   9.602
   57    HB3  CYS  10           2HB      CYS  10  -0.547  14.224  10.420
   58    HG   CYS  10           HG       CYS  10   1.179  15.912   9.511
   59    H    SER  11           H        SER  11   0.743  10.484  11.111
   60    HA   SER  11           HA       SER  11   3.654  10.416  11.572
   61    HB2  SER  11           1HB      SER  11   3.410   8.062  12.212
   62    HB3  SER  11           2HB      SER  11   2.404   9.089  13.234
   63    HG   SER  11           HG       SER  11   0.787   8.519  11.391
   64    H    THR  12           H        THR  12   4.936   9.614   9.999
   65    HA   THR  12           HA       THR  12   3.723   9.120   7.413
   66    HB   THR  12           HB       THR  12   5.718  10.559   7.575
   67    HG1  THR  12           HG1      THR  12   6.877   8.581   6.135
   68   HG21  THR  12          3HG2      THR  12   6.671   8.750   9.364
   69   HG22  THR  12          1HG2      THR  12   7.666   9.946   8.535
   70   HG23  THR  12          2HG2      THR  12   7.568   8.298   7.916
   71    H    VAL  13           H        VAL  13   3.109   7.150   6.833
   72    HA   VAL  13           HA       VAL  13   4.150   4.804   8.166
   73    HB   VAL  13           HB       VAL  13   1.733   5.059   7.543
   74   HG11  VAL  13          1HG1      VAL  13   1.967   4.093   4.855
   75   HG12  VAL  13          2HG1      VAL  13   1.115   5.515   5.459
   76   HG13  VAL  13          3HG1      VAL  13   2.818   5.629   5.014
   77   HG21  VAL  13          3HG2      VAL  13   3.063   2.652   6.308
   78   HG22  VAL  13          1HG2      VAL  13   2.828   2.877   8.041
   79   HG23  VAL  13          2HG2      VAL  13   1.432   2.750   6.971
   80    H    VAL  14           H        VAL  14   5.058   2.985   7.051
   81    HA   VAL  14           HA       VAL  14   6.477   3.725   4.574
   82    HB   VAL  14           HB       VAL  14   8.324   2.271   5.281
   83   HG11  VAL  14          1HG1      VAL  14   9.138   3.693   7.176
   84   HG12  VAL  14          2HG1      VAL  14   8.564   4.594   5.771
   85   HG13  VAL  14          3HG1      VAL  14   7.548   4.454   7.206
   86   HG21  VAL  14          3HG2      VAL  14   8.288   1.697   7.816
   87   HG22  VAL  14          1HG2      VAL  14   6.538   1.818   7.635
   88   HG23  VAL  14          2HG2      VAL  14   7.446   0.648   6.677
   89    H    CYS  15           H        CYS  15   7.009   1.955   3.137
   90    HA   CYS  15           HA       CYS  15   4.939   0.399   2.336
   91    HB2  CYS  15           1HB      CYS  15   7.173   0.752   1.174
   92    HB3  CYS  15           2HB      CYS  15   7.794  -0.565   2.163
   93    H    VAL  16           H        VAL  16   3.863  -1.294   3.099
   94    HA   VAL  16           HA       VAL  16   4.643  -2.541   5.557
   95    HB   VAL  16           HB       VAL  16   2.611  -3.924   5.255
   96   HG11  VAL  16          1HG1      VAL  16   2.791  -1.162   5.702
   97   HG12  VAL  16          2HG1      VAL  16   1.381  -1.397   4.667
   98   HG13  VAL  16          3HG1      VAL  16   1.500  -2.252   6.206
   99   HG21  VAL  16          3HG2      VAL  16   2.938  -3.127   2.534
  100   HG22  VAL  16          1HG2      VAL  16   1.794  -4.280   3.221
  101   HG23  VAL  16          2HG2      VAL  16   1.365  -2.573   3.108
  102    H    ILE  17           H        ILE  17   6.082  -2.922   2.802
  103    HA   ILE  17           HA       ILE  17   6.310  -5.852   3.034
  104    HB   ILE  17           HB       ILE  17   6.814  -4.273   0.515
  105   HG12  ILE  17          1HG1      ILE  17   4.421  -4.176   1.235
  106   HG13  ILE  17          2HG1      ILE  17   4.665  -5.011  -0.296
  107   HG21  ILE  17          1HG2      ILE  17   7.783  -6.678   1.120
  108   HG22  ILE  17          2HG2      ILE  17   6.198  -7.169   0.526
  109   HG23  ILE  17          3HG2      ILE  17   7.280  -6.244  -0.514
  110   HD11  ILE  17          3HD1      ILE  17   3.283  -5.930   1.939
  111   HD12  ILE  17          1HD1      ILE  17   3.706  -6.841   0.489
  112   HD13  ILE  17          2HD1      ILE  17   4.776  -6.868   1.891
  113    H    CYS  18           H        CYS  18   8.073  -2.967   1.899
  114    HA   CYS  18           HA       CYS  18  10.567  -4.242   2.812
  115    HB2  CYS  18           1HB      CYS  18  11.746  -2.845   1.208
  116    HB3  CYS  18           2HB      CYS  18  10.475  -3.748   0.390
  117    H    LEU  19           H        LEU  19   8.357  -1.810   3.498
  118    HA   LEU  19           HA       LEU  19   8.315  -0.112   5.009
  119    HB2  LEU  19           1HB      LEU  19  10.844  -1.478   5.900
  120    HB3  LEU  19           2HB      LEU  19  10.147  -0.096   6.743
  121    HG   LEU  19           HG       LEU  19   8.029  -1.570   6.921
  122   HD11  LEU  19          1HD1      LEU  19   8.249  -3.874   6.735
  123   HD12  LEU  19          2HD1      LEU  19  10.011  -3.806   6.731
  124   HD13  LEU  19          3HD1      LEU  19   9.106  -3.270   5.316
  125   HD21  LEU  19          3HD2      LEU  19   8.690  -1.534   9.037
  126   HD22  LEU  19          1HD2      LEU  19  10.356  -1.256   8.531
  127   HD23  LEU  19          2HD2      LEU  19   9.756  -2.904   8.722
  128    H    GLU  20           H        GLU  20   8.986   0.781   2.641
  129    HA   GLU  20           HA       GLU  20  11.134   2.713   3.183
  130    HB2  GLU  20           1HB      GLU  20  10.650   1.318   0.544
  131    HB3  GLU  20           2HB      GLU  20  11.829   2.591   0.825
  132    HG2  GLU  20           1HG      GLU  20  12.898   1.084   2.525
  133    HG3  GLU  20           2HG      GLU  20  11.829  -0.194   1.950
  134    H    LYS  21           H        LYS  21  10.949   4.717   1.989
  135    HA   LYS  21           HA       LYS  21   8.570   6.001   2.166
  136    HB2  LYS  21           1HB      LYS  21  10.526   7.280   1.734
  137    HB3  LYS  21           2HB      LYS  21  10.827   6.442   0.217
  138    HG2  LYS  21           1HG      LYS  21   8.759   7.458  -0.697
  139    HG3  LYS  21           2HG      LYS  21   8.600   8.382   0.799
  140    HD2  LYS  21           1HD      LYS  21  10.567   9.606   0.374
  141    HD3  LYS  21           2HD      LYS  21  11.090   8.482  -0.882
  142    HE2  LYS  21           1HE      LYS  21  10.303  10.352  -2.051
  143    HE3  LYS  21           2HE      LYS  21   8.986   9.184  -2.143
  144    HZ1  LYS  21           3HZ      LYS  21   8.715  11.739  -1.352
  145    HZ2  LYS  21           1HZ      LYS  21   8.852  10.946   0.136
  146    HZ3  LYS  21           2HZ      LYS  21   7.642  10.494  -0.954
  147    HA   PRO  22           HA       PRO  22   6.289   3.700  -0.989
  148    HB2  PRO  22           1HB      PRO  22   3.849   4.503  -0.112
  149    HB3  PRO  22           2HB      PRO  22   4.752   3.182   0.639
  150    HG2  PRO  22           1HG      PRO  22   4.507   6.039   1.500
  151    HG3  PRO  22           2HG      PRO  22   4.447   4.565   2.484
  152    HD2  PRO  22           1HD      PRO  22   6.665   6.109   2.305
  153    HD3  PRO  22           2HD      PRO  22   6.742   4.349   2.525
  154    H    LYS  23           H        LYS  23   6.091   4.491  -2.978
  155    HA   LYS  23           HA       LYS  23   5.790   7.324  -3.434
  156    HB2  LYS  23           1HB      LYS  23   6.181   4.936  -5.219
  157    HB3  LYS  23           2HB      LYS  23   5.784   6.513  -5.889
  158    HG2  LYS  23           1HG      LYS  23   7.805   7.342  -4.502
  159    HG3  LYS  23           2HG      LYS  23   8.257   5.636  -4.462
  160    HD2  LYS  23           1HD      LYS  23   7.530   6.850  -7.081
  161    HD3  LYS  23           2HD      LYS  23   9.102   7.242  -6.381
  162    HE2  LYS  23           1HE      LYS  23   9.423   4.733  -6.104
  163    HE3  LYS  23           2HE      LYS  23   8.020   4.545  -7.155
  164    HZ1  LYS  23           3HZ      LYS  23   9.876   4.439  -8.555
  165    HZ2  LYS  23           1HZ      LYS  23  10.642   5.750  -7.808
  166    HZ3  LYS  23           2HZ      LYS  23   9.276   6.006  -8.770
  167    H    TYR  24           H        TYR  24   3.847   4.411  -3.846
  168    HA   TYR  24           HA       TYR  24   1.496   6.128  -4.253
  169    HB2  TYR  24           1HB      TYR  24   1.677   3.490  -5.661
  170    HB3  TYR  24           2HB      TYR  24   0.696   4.897  -6.055
  171    HD1  TYR  24           HD1      TYR  24   4.221   3.701  -5.990
  172    HD2  TYR  24           HD2      TYR  24   1.408   6.401  -7.692
  173    HE1  TYR  24           HE1      TYR  24   5.903   4.401  -7.642
  174    HE2  TYR  24           HE2      TYR  24   3.082   7.109  -9.350
  175    HH   TYR  24           HH       TYR  24   6.410   5.967  -9.204
  176    H    ARG  25           H        ARG  25  -0.572   4.756  -3.987
  177    HA   ARG  25           HA       ARG  25  -0.214   2.720  -1.902
  178    HB2  ARG  25           1HB      ARG  25  -1.924   5.194  -1.759
  179    HB3  ARG  25           2HB      ARG  25  -2.270   3.776  -0.779
  180    HG2  ARG  25           1HG      ARG  25   0.075   3.945   0.108
  181    HG3  ARG  25           2HG      ARG  25   0.186   5.505  -0.710
  182    HD2  ARG  25           1HD      ARG  25  -0.529   6.235   1.318
  183    HD3  ARG  25           2HD      ARG  25  -2.099   5.902   0.589
  184    HE   ARG  25           HE       ARG  25  -1.314   3.561   1.818
  185   HH11  ARG  25          2HH1      ARG  25  -1.969   6.843   2.777
  186   HH12  ARG  25          1HH1      ARG  25  -2.499   6.410   4.368
  187   HH21  ARG  25          2HH2      ARG  25  -2.010   2.978   3.910
  188   HH22  ARG  25          1HH2      ARG  25  -2.521   4.212   5.012
  189    H    CYS  26           H        CYS  26  -1.752   1.104  -1.857
  190    HA   CYS  26           HA       CYS  26  -2.944   0.306  -4.201
  191    HB2  CYS  26           1HB      CYS  26  -2.580  -1.127  -2.192
  192    HB3  CYS  26           2HB      CYS  26  -3.955  -0.339  -1.424
  193    HA   PRO  27           HA       PRO  27  -6.341   3.133  -4.620
  194    HB2  PRO  27           1HB      PRO  27  -7.481   1.922  -6.766
  195    HB3  PRO  27           2HB      PRO  27  -6.026   2.920  -6.886
  196    HG2  PRO  27           1HG      PRO  27  -6.275  -0.061  -6.773
  197    HG3  PRO  27           2HG      PRO  27  -5.235   0.936  -7.806
  198    HD2  PRO  27           1HD      PRO  27  -4.319  -0.301  -5.579
  199    HD3  PRO  27           2HD      PRO  27  -3.672   1.253  -6.142
  200    H    ALA  28           H        ALA  28  -6.411   0.204  -3.250
  201    HA   ALA  28           HA       ALA  28  -9.356   0.126  -3.119
  202    HB1  ALA  28           3HB      ALA  28  -8.615  -2.351  -2.280
  203    HB2  ALA  28           1HB      ALA  28  -9.087  -1.947  -3.931
  204    HB3  ALA  28           2HB      ALA  28  -7.379  -2.007  -3.491
  205    H    CYS  29           H        CYS  29  -6.697  -1.261  -1.193
  206    HA   CYS  29           HA       CYS  29  -8.108  -0.606   1.250
  207    HB2  CYS  29           1HB      CYS  29  -6.152  -1.761   2.337
  208    HB3  CYS  29           2HB      CYS  29  -7.056  -2.755   1.199
  209    H    ARG  30           H        ARG  30  -5.602   0.722  -0.687
  210    HA   ARG  30           HA       ARG  30  -4.478   2.702  -0.530
  211    HB2  ARG  30           1HB      ARG  30  -5.812   3.142   2.140
  212    HB3  ARG  30           2HB      ARG  30  -5.121   4.353   1.069
  213    HG2  ARG  30           1HG      ARG  30  -7.507   2.662   0.364
  214    HG3  ARG  30           2HG      ARG  30  -7.611   4.269   1.087
  215    HD2  ARG  30           1HD      ARG  30  -6.028   4.897  -0.927
  216    HD3  ARG  30           2HD      ARG  30  -6.754   3.460  -1.646
  217    HE   ARG  30           HE       ARG  30  -8.914   4.808  -0.824
  218   HH11  ARG  30          2HH1      ARG  30  -6.101   5.815  -2.612
  219   HH12  ARG  30          1HH1      ARG  30  -6.942   7.046  -3.495
  220   HH21  ARG  30          2HH2      ARG  30 -10.032   6.426  -1.980
  221   HH22  ARG  30          1HH2      ARG  30  -9.177   7.393  -3.134
  222    H    VAL  31           H        VAL  31  -3.115   0.485   0.096
  223    HA   VAL  31           HA       VAL  31  -1.754   0.932   2.646
  224    HB   VAL  31           HB       VAL  31  -0.570  -1.198   2.124
  225   HG11  VAL  31          1HG1      VAL  31  -3.485  -0.923   2.490
  226   HG12  VAL  31          2HG1      VAL  31  -2.900  -2.533   2.065
  227   HG13  VAL  31          3HG1      VAL  31  -2.283  -1.720   3.504
  228   HG21  VAL  31          3HG2      VAL  31  -0.546  -1.952   0.035
  229   HG22  VAL  31          1HG2      VAL  31  -2.275  -2.276   0.162
  230   HG23  VAL  31          2HG2      VAL  31  -1.712  -0.724  -0.458
  231    HA   PRO  32           HA       PRO  32   1.681   2.987   0.815
  232    HB2  PRO  32           1HB      PRO  32   3.583   2.392   2.659
  233    HB3  PRO  32           2HB      PRO  32   2.289   3.559   2.956
  234    HG2  PRO  32           1HG      PRO  32   2.489   0.696   3.805
  235    HG3  PRO  32           2HG      PRO  32   1.936   2.102   4.733
  236    HD2  PRO  32           1HD      PRO  32   0.221   0.346   3.590
  237    HD3  PRO  32           2HD      PRO  32  -0.159   2.071   3.773
  238    H    TYR  33           H        TYR  33   2.694   2.282  -0.950
  239    HA   TYR  33           HA       TYR  33   4.488  -0.008  -0.750
  240    HB2  TYR  33           1HB      TYR  33   3.504  -1.310  -2.363
  241    HB3  TYR  33           2HB      TYR  33   2.064  -0.570  -1.673
  242    HD1  TYR  33           HD2      TYR  33   4.602   0.160  -4.324
  243    HD2  TYR  33           HD1      TYR  33   0.513   0.276  -3.152
  244    HE1  TYR  33           HE2      TYR  33   3.997   1.034  -6.542
  245    HE2  TYR  33           HE1      TYR  33  -0.103   1.149  -5.367
  246    HH   TYR  33           HH       TYR  33   0.689   1.325  -7.562
  247    H    CYS  34           H        CYS  34   6.326   0.274  -1.870
  248    HA   CYS  34           HA       CYS  34   6.887   2.787  -3.053
  249    HB2  CYS  34           1HB      CYS  34   9.025   1.525  -3.805
  250    HB3  CYS  34           2HB      CYS  34   8.747   1.767  -2.084
  251    H    SER  35           H        SER  35   7.163  -0.419  -4.589
  252    HA   SER  35           HA       SER  35   6.227   0.817  -7.096
  253    HB2  SER  35           1HB      SER  35   8.254  -1.387  -6.674
  254    HB3  SER  35           2HB      SER  35   7.589  -0.961  -8.250
  255    HG   SER  35           HG       SER  35   9.346   0.465  -6.606
  256    H    VAL  36           H        VAL  36   5.655  -1.202  -8.670
  257    HA   VAL  36           HA       VAL  36   3.214  -2.209  -7.706
  258    HB   VAL  36           HB       VAL  36   4.844  -3.180 -10.058
  259   HG11  VAL  36          1HG1      VAL  36   3.101  -4.473 -10.722
  260   HG12  VAL  36          2HG1      VAL  36   2.814  -4.538  -8.982
  261   HG13  VAL  36          3HG1      VAL  36   1.894  -3.418  -9.988
  262   HG21  VAL  36          3HG2      VAL  36   3.506  -1.694 -11.402
  263   HG22  VAL  36          1HG2      VAL  36   2.561  -1.210  -9.994
  264   HG23  VAL  36          2HG2      VAL  36   4.265  -0.767 -10.108
  265    H    VAL  37           H        VAL  37   6.386  -3.742  -8.111
  266    HA   VAL  37           HA       VAL  37   5.899  -6.355  -7.614
  267    HB   VAL  37           HB       VAL  37   8.122  -4.746  -6.349
  268   HG11  VAL  37          1HG1      VAL  37   8.394  -6.697  -5.231
  269   HG12  VAL  37          2HG1      VAL  37   7.520  -7.641  -6.439
  270   HG13  VAL  37          3HG1      VAL  37   9.194  -7.167  -6.730
  271   HG21  VAL  37          3HG2      VAL  37   8.401  -4.392  -8.614
  272   HG22  VAL  37          1HG2      VAL  37   9.360  -5.849  -8.360
  273   HG23  VAL  37          2HG2      VAL  37   7.742  -5.968  -9.050
  274    H    CYS  38           H        CYS  38   6.797  -4.185  -4.930
  275    HA   CYS  38           HA       CYS  38   6.129  -5.817  -2.836
  276    HB2  CYS  38           1HB      CYS  38   6.195  -2.853  -3.181
  277    HB3  CYS  38           2HB      CYS  38   5.496  -3.504  -1.702
  278    H    PHE  39           H        PHE  39   3.989  -3.835  -4.794
  279    HA   PHE  39           HA       PHE  39   1.684  -4.188  -3.156
  280    HB2  PHE  39           1HB      PHE  39   1.672  -2.303  -4.595
  281    HB3  PHE  39           2HB      PHE  39   2.077  -3.279  -6.003
  282    HD1  PHE  39           HD1      PHE  39  -0.560  -3.471  -3.367
  283    HD2  PHE  39           HD2      PHE  39   0.364  -3.327  -7.519
  284    HE1  PHE  39           HE1      PHE  39  -2.953  -3.681  -3.904
  285    HE2  PHE  39           HE2      PHE  39  -2.026  -3.535  -8.062
  286    HZ   PHE  39           HZ       PHE  39  -3.688  -3.711  -6.254
  287    H    ARG  40           H        ARG  40   3.094  -5.935  -5.846
  288    HA   ARG  40           HA       ARG  40   0.958  -7.522  -6.624
  289    HB2  ARG  40           1HB      ARG  40   3.898  -8.210  -6.485
  290    HB3  ARG  40           2HB      ARG  40   2.693  -9.183  -7.317
  291    HG2  ARG  40           1HG      ARG  40   2.175  -7.174  -8.722
  292    HG3  ARG  40           2HG      ARG  40   3.573  -6.388  -7.987
  293    HD2  ARG  40           1HD      ARG  40   5.068  -7.966  -8.912
  294    HD3  ARG  40           2HD      ARG  40   3.756  -9.057  -9.356
  295    HE   ARG  40           HE       ARG  40   4.648  -6.718 -10.807
  296   HH11  ARG  40          2HH1      ARG  40   2.134  -9.081 -10.344
  297   HH12  ARG  40          1HH1      ARG  40   1.444  -8.847 -11.915
  298   HH21  ARG  40          2HH2      ARG  40   3.749  -6.400 -12.879
  299   HH22  ARG  40          1HH2      ARG  40   2.364  -7.322 -13.357
  300    H    LYS  41           H        LYS  41   3.558  -8.565  -4.412
  301    HA   LYS  41           HA       LYS  41   2.428 -10.902  -3.517
  302    HB2  LYS  41           1HB      LYS  41   4.038  -8.960  -1.848
  303    HB3  LYS  41           2HB      LYS  41   3.818 -10.674  -1.517
  304    HG2  LYS  41           1HG      LYS  41   5.194 -11.321  -3.263
  305    HG3  LYS  41           2HG      LYS  41   5.022  -9.778  -4.102
  306    HD2  LYS  41           1HD      LYS  41   7.208  -9.805  -3.184
  307    HD3  LYS  41           2HD      LYS  41   6.253  -8.725  -2.166
  308    HE2  LYS  41           1HE      LYS  41   6.201 -10.219  -0.405
  309    HE3  LYS  41           2HE      LYS  41   6.483 -11.614  -1.445
  310    HZ1  LYS  41           3HZ      LYS  41   8.767 -10.679  -1.811
  311    HZ2  LYS  41           1HZ      LYS  41   8.462 -11.251  -0.248
  312    HZ3  LYS  41           2HZ      LYS  41   8.453  -9.588  -0.558
  313    H    HIS  42           H        HIS  42   1.746  -7.616  -2.473
  314    HA   HIS  42           HA       HIS  42   0.163  -8.319  -0.222
  315    HB2  HIS  42           1HB      HIS  42   0.752  -6.131  -0.011
  316    HB3  HIS  42           2HB      HIS  42   0.753  -5.855  -1.750
  317    HD1  HIS  42           HD1      HIS  42  -1.441  -5.702   1.260
  318    HD2  HIS  42           HD2      HIS  42  -1.704  -5.018  -2.830
  319    HE1  HIS  42           HE1      HIS  42  -3.616  -4.486   0.920
  320    H    LYS  43           H        LYS  43  -0.637  -7.440  -3.567
  321    HA   LYS  43           HA       LYS  43  -3.368  -7.375  -3.473
  322    HB2  LYS  43           1HB      LYS  43  -1.718  -7.118  -5.475
  323    HB3  LYS  43           2HB      LYS  43  -2.005  -8.837  -5.711
  324    HG2  LYS  43           1HG      LYS  43  -4.184  -8.530  -6.343
  325    HG3  LYS  43           2HG      LYS  43  -4.346  -7.019  -5.445
  326    HD2  LYS  43           1HD      LYS  43  -3.311  -5.774  -7.099
  327    HD3  LYS  43           2HD      LYS  43  -2.474  -7.174  -7.772
  328    HE2  LYS  43           1HE      LYS  43  -4.379  -7.934  -8.876
  329    HE3  LYS  43           2HE      LYS  43  -5.463  -6.986  -7.859
  330    HZ1  LYS  43           3HZ      LYS  43  -3.558  -5.808  -9.807
  331    HZ2  LYS  43           1HZ      LYS  43  -4.755  -4.992  -8.933
  332    HZ3  LYS  43           2HZ      LYS  43  -5.192  -6.098 -10.135
  333    H    GLU  44           H        GLU  44  -1.297 -10.234  -3.592
  334    HA   GLU  44           HA       GLU  44  -3.124 -12.228  -4.041
  335    HB2  GLU  44           1HB      GLU  44  -1.509 -13.671  -3.350
  336    HB3  GLU  44           2HB      GLU  44  -0.518 -12.222  -3.429
  337    HG2  GLU  44           1HG      GLU  44  -0.740 -11.878  -1.060
  338    HG3  GLU  44           2HG      GLU  44  -1.869 -13.226  -0.936
  339    H    GLN  45           H        GLN  45  -2.569 -10.426  -1.077
  340    HA   GLN  45           HA       GLN  45  -4.957 -11.710   0.068
  341    HB2  GLN  45           1HB      GLN  45  -2.305 -11.146   1.347
  342    HB3  GLN  45           2HB      GLN  45  -3.766 -11.175   2.326
  343    HG2  GLN  45           1HG      GLN  45  -4.088 -13.484   1.034
  344    HG3  GLN  45           2HG      GLN  45  -2.329 -13.382   0.990
  345   HE21  GLN  45          1HE2      GLN  45  -5.113 -13.282   3.147
  346   HE22  GLN  45          2HE2      GLN  45  -4.289 -13.897   4.535
  347    H    CYS  46           H        CYS  46  -4.536  -9.185  -1.446
  348    HA   CYS  46           HA       CYS  46  -4.684  -6.982   0.322
  349    HB2  CYS  46           1HB      CYS  46  -4.093  -6.433  -1.876
  350    HB3  CYS  46           2HB      CYS  46  -5.394  -7.398  -2.567
  351    H    ASN  47           H        ASN  47  -6.210  -6.936   1.860
  352    HA   ASN  47           HA       ASN  47  -8.997  -7.453   1.054
  353    HB2  ASN  47           1HB      ASN  47  -7.570  -7.869   3.673
  354    HB3  ASN  47           2HB      ASN  47  -9.326  -7.764   3.591
  355   HD21  ASN  47          1HD2      ASN  47  -9.874  -9.808   4.061
  356   HD22  ASN  47          2HD2      ASN  47  -9.412 -11.187   3.128
  357    HA   PRO  48           HA       PRO  48  -9.113  -2.981   1.755
  358    HB2  PRO  48           1HB      PRO  48 -11.437  -2.619   0.399
  359    HB3  PRO  48           2HB      PRO  48  -9.867  -2.755  -0.403
  360    HG2  PRO  48           1HG      PRO  48 -11.985  -4.835  -0.020
  361    HG3  PRO  48           2HG      PRO  48 -11.014  -4.480  -1.460
  362    HD2  PRO  48           1HD      PRO  48 -10.446  -6.535   0.209
  363    HD3  PRO  48           2HD      PRO  48  -9.187  -5.643  -0.670
  364    H    GLU  49           H        GLU  49 -11.167  -1.584   2.371
  365    HA   GLU  49           HA       GLU  49 -12.830  -3.076   4.279
  366    HB2  GLU  49           1HB      GLU  49 -12.511  -1.349   5.971
  367    HB3  GLU  49           2HB      GLU  49 -10.970  -2.070   5.526
  368    HG2  GLU  49           1HG      GLU  49 -10.701  -0.100   3.933
  369    HG3  GLU  49           2HG      GLU  49 -12.041   0.636   4.811
  370    H    THR  50           H        THR  50 -14.923  -2.583   4.160
  371    HA   THR  50           HA       THR  50 -15.803  -0.575   2.291
  372    HB   THR  50           HB       THR  50 -18.088  -1.355   2.867
  373    HG1  THR  50           HG1      THR  50 -17.781  -1.976   5.017
  374   HG21  THR  50          3HG2      THR  50 -16.217  -3.663   2.343
  375   HG22  THR  50          1HG2      THR  50 -16.677  -2.473   1.126
  376   HG23  THR  50          2HG2      THR  50 -17.903  -3.517   1.847
  377    H    SER  51           H        SER  51 -15.324   1.431   3.136
  378    HA   SER  51           HA       SER  51 -16.079   2.146   5.822
  379    HB2  SER  51           1HB      SER  51 -14.792   3.570   3.521
  380    HB3  SER  51           2HB      SER  51 -15.458   4.512   4.854
  381    HG   SER  51           HG       SER  51 -13.235   2.874   4.776
  382    H    GLY  52           H        GLY  52 -18.293   1.943   5.999
  383    HA2  GLY  52           1HA      GLY  52 -20.388   2.951   6.062
  384    HA3  GLY  52           2HA      GLY  52 -19.822   4.139   4.898
  385    HA   PRO  53           HA       PRO  53 -22.807   1.304   2.760
  386    HB2  PRO  53           1HB      PRO  53 -24.215   3.298   1.573
  387    HB3  PRO  53           2HB      PRO  53 -24.573   2.706   3.199
  388    HG2  PRO  53           1HG      PRO  53 -23.028   5.130   2.363
  389    HG3  PRO  53           2HG      PRO  53 -24.231   4.961   3.654
  390    HD2  PRO  53           1HD      PRO  53 -21.566   4.960   4.137
  391    HD3  PRO  53           2HD      PRO  53 -22.714   4.026   5.117
  392    H    SER  54           H        SER  54 -23.279   1.213   0.392
  393    HA   SER  54           HA       SER  54 -20.855   1.695  -1.084
  394    HB2  SER  54           1HB      SER  54 -22.094  -0.394  -1.406
  395    HB3  SER  54           2HB      SER  54 -23.499   0.512  -1.968
  396    HG   SER  54           HG       SER  54 -21.726   1.377  -3.528
  397    H    SER  55           H        SER  55 -20.487   3.737  -1.699
  398    HA   SER  55           HA       SER  55 -22.329   4.972  -3.556
  399    HB2  SER  55           1HB      SER  55 -22.706   6.987  -2.365
  400    HB3  SER  55           2HB      SER  55 -23.017   5.699  -1.200
  401    HG   SER  55           HG       SER  55 -20.891   7.513  -1.336
  402    H    GLY  56           H        GLY  56 -21.281   6.143  -5.068
  403    HA2  GLY  56           1HA      GLY  56 -19.554   7.123  -6.221
  404    HA3  GLY  56           2HA      GLY  56 -18.881   7.565  -4.659
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1   9.811  26.666  29.415
    2    HA2  GLY   1           1HA      GLY   1   8.887  25.121  31.561
    3    HA3  GLY   1           2HA      GLY   1   8.169  24.480  30.090
    4    H    SER   2           H        SER   2  10.600  23.991  32.161
    5    HA   SER   2           HA       SER   2  12.501  23.123  30.089
    6    HB2  SER   2           1HB      SER   2  14.171  23.052  31.944
    7    HB3  SER   2           2HB      SER   2  13.502  24.661  31.674
    8    HG   SER   2           HG       SER   2  11.932  23.486  33.420
    9    H    SER   3           H        SER   3  11.574  21.154  29.569
   10    HA   SER   3           HA       SER   3  11.290  19.193  31.737
   11    HB2  SER   3           1HB      SER   3   9.406  19.673  30.035
   12    HB3  SER   3           2HB      SER   3  10.396  18.765  28.893
   13    HG   SER   3           HG       SER   3  10.194  16.964  30.150
   14    H    GLY   4           H        GLY   4  12.667  19.544  28.474
   15    HA2  GLY   4           1HA      GLY   4  15.091  18.291  29.074
   16    HA3  GLY   4           2HA      GLY   4  14.007  17.058  28.447
   17    H    SER   5           H        SER   5  15.420  16.781  26.656
   18    HA   SER   5           HA       SER   5  15.929  18.970  24.864
   19    HB2  SER   5           1HB      SER   5  16.424  15.997  24.679
   20    HB3  SER   5           2HB      SER   5  16.824  17.113  23.373
   21    HG   SER   5           HG       SER   5  18.443  17.889  24.511
   22    H    SER   6           H        SER   6  15.338  18.822  22.533
   23    HA   SER   6           HA       SER   6  12.500  18.133  22.309
   24    HB2  SER   6           1HB      SER   6  12.391  19.679  20.485
   25    HB3  SER   6           2HB      SER   6  13.332  20.460  21.756
   26    HG   SER   6           HG       SER   6  14.069  19.772  19.235
   27    H    GLY   7           H        GLY   7  11.839  16.434  21.170
   28    HA2  GLY   7           1HA      GLY   7  13.786  15.146  19.363
   29    HA3  GLY   7           2HA      GLY   7  12.534  14.289  20.249
   30    H    LEU   8           H        LEU   8  13.358  15.075  17.263
   31    HA   LEU   8           HA       LEU   8  10.912  16.162  16.237
   32    HB2  LEU   8           1HB      LEU   8  12.986  16.590  15.089
   33    HB3  LEU   8           2HB      LEU   8  13.266  14.863  14.878
   34    HG   LEU   8           HG       LEU   8  11.252  14.790  13.405
   35   HD11  LEU   8          1HD1      LEU   8  11.081  17.455  12.595
   36   HD12  LEU   8          2HD1      LEU   8  11.003  17.495  14.356
   37   HD13  LEU   8          3HD1      LEU   8   9.855  16.514  13.445
   38   HD21  LEU   8          3HD2      LEU   8  12.503  15.247  11.570
   39   HD22  LEU   8          1HD2      LEU   8  13.789  15.332  12.775
   40   HD23  LEU   8          2HD2      LEU   8  13.035  16.813  12.183
   41    H    LYS   9           H        LYS   9   9.097  15.098  15.840
   42    HA   LYS   9           HA       LYS   9   9.215  12.167  15.576
   43    HB2  LYS   9           1HB      LYS   9   7.257  14.015  16.854
   44    HB3  LYS   9           2HB      LYS   9   6.638  12.539  16.125
   45    HG2  LYS   9           1HG      LYS   9   7.003  11.813  18.251
   46    HG3  LYS   9           2HG      LYS   9   8.568  11.431  17.529
   47    HD2  LYS   9           1HD      LYS   9   9.419  13.614  18.359
   48    HD3  LYS   9           2HD      LYS   9   7.877  13.860  19.181
   49    HE2  LYS   9           1HE      LYS   9   8.243  11.982  20.597
   50    HE3  LYS   9           2HE      LYS   9   9.634  11.460  19.648
   51    HZ1  LYS   9           3HZ      LYS   9  10.596  12.496  21.453
   52    HZ2  LYS   9           1HZ      LYS   9   9.422  13.712  21.535
   53    HZ3  LYS   9           2HZ      LYS   9  10.587  13.742  20.309
   54    H    CYS  10           H        CYS  10   8.027  11.145  13.961
   55    HA   CYS  10           HA       CYS  10   6.783  12.879  11.943
   56    HB2  CYS  10           1HB      CYS  10   8.940  10.828  11.531
   57    HB3  CYS  10           2HB      CYS  10   7.814  11.216  10.236
   58    HG   CYS  10           HG       CYS  10  10.578  12.669  10.852
   59    H    SER  11           H        SER  11   4.716  12.264  12.467
   60    HA   SER  11           HA       SER  11   3.979   9.518  12.824
   61    HB2  SER  11           1HB      SER  11   2.226  11.949  12.390
   62    HB3  SER  11           2HB      SER  11   1.681  10.371  12.958
   63    HG   SER  11           HG       SER  11   3.413  12.189  14.272
   64    H    THR  12           H        THR  12   4.767   8.595  10.858
   65    HA   THR  12           HA       THR  12   2.819   8.801   8.689
   66    HB   THR  12           HB       THR  12   4.673   8.757   6.993
   67    HG1  THR  12           HG1      THR  12   6.643   9.873   8.113
   68   HG21  THR  12          3HG2      THR  12   3.371  10.843   7.921
   69   HG22  THR  12          1HG2      THR  12   4.735  11.053   6.824
   70   HG23  THR  12          2HG2      THR  12   4.955  11.282   8.559
   71    H    VAL  13           H        VAL  13   3.152   7.024   7.057
   72    HA   VAL  13           HA       VAL  13   4.055   4.583   8.440
   73    HB   VAL  13           HB       VAL  13   1.584   4.809   7.882
   74   HG11  VAL  13          1HG1      VAL  13   2.550   4.252   5.081
   75   HG12  VAL  13          2HG1      VAL  13   0.878   4.423   5.619
   76   HG13  VAL  13          3HG1      VAL  13   1.959   5.817   5.640
   77   HG21  VAL  13          3HG2      VAL  13   1.376   2.530   7.640
   78   HG22  VAL  13          1HG2      VAL  13   2.710   2.423   6.491
   79   HG23  VAL  13          2HG2      VAL  13   3.042   2.656   8.207
   80    H    VAL  14           H        VAL  14   4.794   2.819   6.991
   81    HA   VAL  14           HA       VAL  14   6.042   3.802   4.519
   82    HB   VAL  14           HB       VAL  14   8.104   2.549   5.052
   83   HG11  VAL  14          1HG1      VAL  14   8.980   4.135   6.726
   84   HG12  VAL  14          2HG1      VAL  14   8.041   4.933   5.463
   85   HG13  VAL  14          3HG1      VAL  14   7.331   4.667   7.056
   86   HG21  VAL  14          3HG2      VAL  14   7.894   2.369   7.871
   87   HG22  VAL  14          1HG2      VAL  14   6.500   1.541   7.176
   88   HG23  VAL  14          2HG2      VAL  14   8.132   1.066   6.706
   89    H    CYS  15           H        CYS  15   6.617   2.133   3.003
   90    HA   CYS  15           HA       CYS  15   4.759   0.373   2.273
   91    HB2  CYS  15           1HB      CYS  15   6.995   0.832   1.143
   92    HB3  CYS  15           2HB      CYS  15   7.664  -0.434   2.168
   93    H    VAL  16           H        VAL  16   3.780  -1.372   3.054
   94    HA   VAL  16           HA       VAL  16   4.682  -2.538   5.535
   95    HB   VAL  16           HB       VAL  16   2.635  -3.941   5.348
   96   HG11  VAL  16          1HG1      VAL  16   1.816  -2.238   6.518
   97   HG12  VAL  16          2HG1      VAL  16   2.794  -1.076   5.621
   98   HG13  VAL  16          3HG1      VAL  16   1.215  -1.564   5.004
   99   HG21  VAL  16          3HG2      VAL  16   1.045  -3.563   3.582
  100   HG22  VAL  16          1HG2      VAL  16   2.073  -2.319   2.869
  101   HG23  VAL  16          2HG2      VAL  16   2.594  -4.004   2.864
  102    H    ILE  17           H        ILE  17   6.099  -2.928   2.848
  103    HA   ILE  17           HA       ILE  17   6.252  -5.867   3.008
  104    HB   ILE  17           HB       ILE  17   6.733  -4.256   0.504
  105   HG12  ILE  17          1HG1      ILE  17   4.343  -4.202   1.318
  106   HG13  ILE  17          2HG1      ILE  17   4.571  -4.907  -0.278
  107   HG21  ILE  17          1HG2      ILE  17   6.912  -7.114   1.241
  108   HG22  ILE  17          2HG2      ILE  17   6.227  -6.741  -0.340
  109   HG23  ILE  17          3HG2      ILE  17   7.848  -6.181   0.073
  110   HD11  ILE  17          3HD1      ILE  17   4.754  -7.077   1.397
  111   HD12  ILE  17          1HD1      ILE  17   3.503  -6.085   2.146
  112   HD13  ILE  17          2HD1      ILE  17   3.337  -6.595   0.465
  113    H    CYS  18           H        CYS  18   8.038  -2.978   1.924
  114    HA   CYS  18           HA       CYS  18  10.533  -4.325   2.716
  115    HB2  CYS  18           1HB      CYS  18  11.685  -2.792   1.195
  116    HB3  CYS  18           2HB      CYS  18  10.429  -3.686   0.345
  117    H    LEU  19           H        LEU  19   8.423  -1.722   3.406
  118    HA   LEU  19           HA       LEU  19   8.414  -0.222   5.127
  119    HB2  LEU  19           1HB      LEU  19  11.153  -1.166   5.910
  120    HB3  LEU  19           2HB      LEU  19   9.924  -0.412   6.923
  121    HG   LEU  19           HG       LEU  19   9.518  -3.130   5.711
  122   HD11  LEU  19          1HD1      LEU  19  10.385  -2.931   8.525
  123   HD12  LEU  19          2HD1      LEU  19  11.630  -2.689   7.300
  124   HD13  LEU  19          3HD1      LEU  19  10.695  -4.184   7.323
  125   HD21  LEU  19          3HD2      LEU  19   7.777  -1.487   6.954
  126   HD22  LEU  19          1HD2      LEU  19   8.423  -2.372   8.337
  127   HD23  LEU  19          2HD2      LEU  19   7.675  -3.248   7.001
  128    H    GLU  20           H        GLU  20   9.121   0.634   2.643
  129    HA   GLU  20           HA       GLU  20  11.199   2.639   3.227
  130    HB2  GLU  20           1HB      GLU  20  10.647   1.234   0.610
  131    HB3  GLU  20           2HB      GLU  20  11.699   2.633   0.771
  132    HG2  GLU  20           1HG      GLU  20  12.237   0.296   2.512
  133    HG3  GLU  20           2HG      GLU  20  12.623   0.157   0.798
  134    H    LYS  21           H        LYS  21  10.980   4.628   1.874
  135    HA   LYS  21           HA       LYS  21   8.570   5.894   2.270
  136    HB2  LYS  21           1HB      LYS  21  10.952   6.764   1.497
  137    HB3  LYS  21           2HB      LYS  21  10.204   6.701  -0.094
  138    HG2  LYS  21           1HG      LYS  21   8.652   8.340   0.427
  139    HG3  LYS  21           2HG      LYS  21   8.840   8.104   2.167
  140    HD2  LYS  21           1HD      LYS  21  10.033  10.035   1.920
  141    HD3  LYS  21           2HD      LYS  21  11.321   8.863   1.629
  142    HE2  LYS  21           1HE      LYS  21  11.579  10.335  -0.138
  143    HE3  LYS  21           2HE      LYS  21  10.597   9.056  -0.851
  144    HZ1  LYS  21           3HZ      LYS  21   9.445  10.894  -1.506
  145    HZ2  LYS  21           1HZ      LYS  21   9.843  11.795  -0.130
  146    HZ3  LYS  21           2HZ      LYS  21   8.660  10.590  -0.039
  147    HA   PRO  22           HA       PRO  22   6.190   3.715  -0.877
  148    HB2  PRO  22           1HB      PRO  22   3.785   4.600   0.016
  149    HB3  PRO  22           2HB      PRO  22   4.652   3.254   0.766
  150    HG2  PRO  22           1HG      PRO  22   4.506   6.121   1.615
  151    HG3  PRO  22           2HG      PRO  22   4.407   4.655   2.606
  152    HD2  PRO  22           1HD      PRO  22   6.671   6.126   2.402
  153    HD3  PRO  22           2HD      PRO  22   6.694   4.365   2.629
  154    H    LYS  23           H        LYS  23   6.150   4.554  -2.860
  155    HA   LYS  23           HA       LYS  23   5.850   7.381  -3.309
  156    HB2  LYS  23           1HB      LYS  23   6.321   4.994  -5.064
  157    HB3  LYS  23           2HB      LYS  23   5.865   6.535  -5.778
  158    HG2  LYS  23           1HG      LYS  23   7.812   7.595  -4.792
  159    HG3  LYS  23           2HG      LYS  23   8.257   6.079  -4.005
  160    HD2  LYS  23           1HD      LYS  23   7.911   6.225  -6.979
  161    HD3  LYS  23           2HD      LYS  23   9.424   6.722  -6.219
  162    HE2  LYS  23           1HE      LYS  23   8.198   4.070  -5.569
  163    HE3  LYS  23           2HE      LYS  23   9.148   4.275  -7.040
  164    HZ1  LYS  23           3HZ      LYS  23  10.973   4.040  -5.836
  165    HZ2  LYS  23           1HZ      LYS  23  10.061   3.878  -4.420
  166    HZ3  LYS  23           2HZ      LYS  23  10.576   5.408  -4.924
  167    H    TYR  24           H        TYR  24   3.881   4.496  -3.701
  168    HA   TYR  24           HA       TYR  24   1.552   6.220  -4.148
  169    HB2  TYR  24           1HB      TYR  24   1.708   3.643  -5.652
  170    HB3  TYR  24           2HB      TYR  24   0.810   5.108  -6.033
  171    HD1  TYR  24           HD1      TYR  24   4.199   3.610  -6.016
  172    HD2  TYR  24           HD2      TYR  24   1.724   6.758  -7.456
  173    HE1  TYR  24           HE1      TYR  24   5.973   4.280  -7.583
  174    HE2  TYR  24           HE2      TYR  24   3.491   7.436  -9.027
  175    HH   TYR  24           HH       TYR  24   5.506   6.198 -10.178
  176    H    ARG  25           H        ARG  25  -0.514   4.763  -4.044
  177    HA   ARG  25           HA       ARG  25  -0.177   2.786  -1.889
  178    HB2  ARG  25           1HB      ARG  25  -1.945   5.181  -2.010
  179    HB3  ARG  25           2HB      ARG  25  -2.581   3.730  -1.246
  180    HG2  ARG  25           1HG      ARG  25  -0.592   3.709   0.240
  181    HG3  ARG  25           2HG      ARG  25  -0.106   5.252  -0.465
  182    HD2  ARG  25           1HD      ARG  25  -2.654   4.683   1.044
  183    HD3  ARG  25           2HD      ARG  25  -1.278   5.620   1.624
  184    HE   ARG  25           HE       ARG  25  -1.966   6.954  -0.598
  185   HH11  ARG  25          2HH1      ARG  25  -3.843   5.788   2.092
  186   HH12  ARG  25          1HH1      ARG  25  -5.024   7.051   1.984
  187   HH21  ARG  25          2HH2      ARG  25  -3.514   8.622  -0.750
  188   HH22  ARG  25          1HH2      ARG  25  -4.836   8.662   0.366
  189    H    CYS  26           H        CYS  26  -2.014   1.284  -1.682
  190    HA   CYS  26           HA       CYS  26  -2.724   0.210  -4.220
  191    HB2  CYS  26           1HB      CYS  26  -2.323  -1.201  -2.234
  192    HB3  CYS  26           2HB      CYS  26  -3.758  -0.521  -1.472
  193    HA   PRO  27           HA       PRO  27  -6.393   2.613  -4.879
  194    HB2  PRO  27           1HB      PRO  27  -7.286   1.234  -7.041
  195    HB3  PRO  27           2HB      PRO  27  -5.945   2.383  -7.121
  196    HG2  PRO  27           1HG      PRO  27  -5.871  -0.603  -6.934
  197    HG3  PRO  27           2HG      PRO  27  -4.896   0.479  -7.945
  198    HD2  PRO  27           1HD      PRO  27  -3.963  -0.597  -5.642
  199    HD3  PRO  27           2HD      PRO  27  -3.462   1.006  -6.219
  200    H    ALA  28           H        ALA  28  -6.223  -0.198  -3.353
  201    HA   ALA  28           HA       ALA  28  -9.133  -0.672  -3.434
  202    HB1  ALA  28           3HB      ALA  28  -7.877  -2.910  -2.279
  203    HB2  ALA  28           1HB      ALA  28  -8.688  -2.806  -3.842
  204    HB3  ALA  28           2HB      ALA  28  -6.954  -2.502  -3.726
  205    H    CYS  29           H        CYS  29  -6.474  -1.491  -1.203
  206    HA   CYS  29           HA       CYS  29  -8.181  -0.715   1.038
  207    HB2  CYS  29           1HB      CYS  29  -6.370  -1.787   2.417
  208    HB3  CYS  29           2HB      CYS  29  -7.174  -2.873   1.288
  209    H    ARG  30           H        ARG  30  -5.708   0.562  -0.860
  210    HA   ARG  30           HA       ARG  30  -4.538   2.513  -0.758
  211    HB2  ARG  30           1HB      ARG  30  -6.123   3.045   1.762
  212    HB3  ARG  30           2HB      ARG  30  -5.212   4.230   0.837
  213    HG2  ARG  30           1HG      ARG  30  -7.357   4.624   0.122
  214    HG3  ARG  30           2HG      ARG  30  -6.771   3.509  -1.115
  215    HD2  ARG  30           1HD      ARG  30  -7.958   1.703  -0.205
  216    HD3  ARG  30           2HD      ARG  30  -8.214   2.534   1.329
  217    HE   ARG  30           HE       ARG  30 -10.080   3.502   0.438
  218   HH11  ARG  30          2HH1      ARG  30  -8.082   2.319  -2.156
  219   HH12  ARG  30          1HH1      ARG  30  -9.249   2.667  -3.388
  220   HH21  ARG  30          2HH2      ARG  30 -11.625   3.964  -1.175
  221   HH22  ARG  30          1HH2      ARG  30 -11.264   3.603  -2.829
  222    H    VAL  31           H        VAL  31  -3.102   0.454  -0.016
  223    HA   VAL  31           HA       VAL  31  -1.893   1.041   2.591
  224    HB   VAL  31           HB       VAL  31  -0.653  -1.101   2.237
  225   HG11  VAL  31          1HG1      VAL  31  -2.889  -2.506   2.302
  226   HG12  VAL  31          2HG1      VAL  31  -2.431  -1.442   3.633
  227   HG13  VAL  31          3HG1      VAL  31  -3.613  -0.904   2.440
  228   HG21  VAL  31          3HG2      VAL  31  -1.715  -0.810  -0.392
  229   HG22  VAL  31          1HG2      VAL  31  -0.596  -2.028   0.221
  230   HG23  VAL  31          2HG2      VAL  31  -2.336  -2.305   0.308
  231    HA   PRO  32           HA       PRO  32   1.672   2.934   0.860
  232    HB2  PRO  32           1HB      PRO  32   3.562   2.195   2.663
  233    HB3  PRO  32           2HB      PRO  32   2.316   3.398   3.016
  234    HG2  PRO  32           1HG      PRO  32   2.411   0.497   3.750
  235    HG3  PRO  32           2HG      PRO  32   1.919   1.885   4.737
  236    HD2  PRO  32           1HD      PRO  32   0.131   0.243   3.539
  237    HD3  PRO  32           2HD      PRO  32  -0.182   1.972   3.793
  238    H    TYR  33           H        TYR  33   2.713   2.295  -0.912
  239    HA   TYR  33           HA       TYR  33   4.414  -0.060  -0.827
  240    HB2  TYR  33           1HB      TYR  33   3.355  -1.311  -2.420
  241    HB3  TYR  33           2HB      TYR  33   1.944  -0.511  -1.736
  242    HD1  TYR  33           HD2      TYR  33   4.528   0.113  -4.370
  243    HD2  TYR  33           HD1      TYR  33   0.442   0.410  -3.220
  244    HE1  TYR  33           HE2      TYR  33   3.975   1.020  -6.589
  245    HE2  TYR  33           HE1      TYR  33  -0.122   1.316  -5.436
  246    HH   TYR  33           HH       TYR  33   1.748   2.674  -7.398
  247    H    CYS  34           H        CYS  34   6.269   0.304  -1.862
  248    HA   CYS  34           HA       CYS  34   6.796   2.811  -3.073
  249    HB2  CYS  34           1HB      CYS  34   8.982   1.604  -3.751
  250    HB3  CYS  34           2HB      CYS  34   8.652   1.837  -2.037
  251    H    SER  35           H        SER  35   7.139  -0.422  -4.540
  252    HA   SER  35           HA       SER  35   6.268   0.760  -7.096
  253    HB2  SER  35           1HB      SER  35   8.310  -1.396  -6.544
  254    HB3  SER  35           2HB      SER  35   7.646  -1.097  -8.150
  255    HG   SER  35           HG       SER  35   8.363   1.169  -7.728
  256    H    VAL  36           H        VAL  36   5.623  -1.173  -8.654
  257    HA   VAL  36           HA       VAL  36   3.201  -2.201  -7.700
  258    HB   VAL  36           HB       VAL  36   4.843  -3.155 -10.051
  259   HG11  VAL  36          1HG1      VAL  36   3.350  -4.803 -10.183
  260   HG12  VAL  36          2HG1      VAL  36   2.345  -4.091  -8.919
  261   HG13  VAL  36          3HG1      VAL  36   2.159  -3.570 -10.594
  262   HG21  VAL  36          3HG2      VAL  36   2.605  -1.689 -10.891
  263   HG22  VAL  36          1HG2      VAL  36   3.335  -0.757  -9.584
  264   HG23  VAL  36          2HG2      VAL  36   4.301  -1.213 -10.987
  265    H    VAL  37           H        VAL  37   6.393  -3.693  -7.997
  266    HA   VAL  37           HA       VAL  37   5.891  -6.327  -7.540
  267    HB   VAL  37           HB       VAL  37   8.100  -4.696  -6.280
  268   HG11  VAL  37          1HG1      VAL  37   7.428  -7.534  -6.127
  269   HG12  VAL  37          2HG1      VAL  37   9.080  -7.224  -6.664
  270   HG13  VAL  37          3HG1      VAL  37   8.514  -6.569  -5.127
  271   HG21  VAL  37          3HG2      VAL  37   8.463  -6.450  -8.660
  272   HG22  VAL  37          1HG2      VAL  37   7.716  -4.867  -8.876
  273   HG23  VAL  37          2HG2      VAL  37   9.335  -4.991  -8.190
  274    H    CYS  38           H        CYS  38   6.721  -4.125  -4.858
  275    HA   CYS  38           HA       CYS  38   6.029  -5.771  -2.768
  276    HB2  CYS  38           1HB      CYS  38   6.075  -2.795  -3.094
  277    HB3  CYS  38           2HB      CYS  38   5.435  -3.486  -1.606
  278    H    PHE  39           H        PHE  39   3.939  -3.877  -4.831
  279    HA   PHE  39           HA       PHE  39   1.603  -4.183  -3.199
  280    HB2  PHE  39           1HB      PHE  39   1.473  -2.304  -4.562
  281    HB3  PHE  39           2HB      PHE  39   2.148  -3.143  -5.955
  282    HD1  PHE  39           HD1      PHE  39  -0.737  -3.942  -3.736
  283    HD2  PHE  39           HD2      PHE  39   0.616  -3.034  -7.668
  284    HE1  PHE  39           HE1      PHE  39  -3.009  -4.319  -4.601
  285    HE2  PHE  39           HE2      PHE  39  -1.653  -3.409  -8.539
  286    HZ   PHE  39           HZ       PHE  39  -3.470  -4.052  -7.006
  287    H    ARG  40           H        ARG  40   3.122  -5.979  -5.766
  288    HA   ARG  40           HA       ARG  40   0.958  -7.536  -6.618
  289    HB2  ARG  40           1HB      ARG  40   3.908  -8.180  -6.498
  290    HB3  ARG  40           2HB      ARG  40   2.717  -9.186  -7.312
  291    HG2  ARG  40           1HG      ARG  40   2.132  -7.074  -8.643
  292    HG3  ARG  40           2HG      ARG  40   3.662  -6.439  -8.034
  293    HD2  ARG  40           1HD      ARG  40   4.219  -7.386 -10.094
  294    HD3  ARG  40           2HD      ARG  40   4.696  -8.609  -8.916
  295    HE   ARG  40           HE       ARG  40   2.035  -8.937  -9.984
  296   HH11  ARG  40          2HH1      ARG  40   5.414  -9.695 -10.345
  297   HH12  ARG  40          1HH1      ARG  40   5.127 -11.122 -11.285
  298   HH21  ARG  40          2HH2      ARG  40   1.645 -10.813 -11.221
  299   HH22  ARG  40          1HH2      ARG  40   2.983 -11.757 -11.783
  300    H    LYS  41           H        LYS  41   3.570  -8.585  -4.424
  301    HA   LYS  41           HA       LYS  41   2.497 -10.942  -3.550
  302    HB2  LYS  41           1HB      LYS  41   4.002  -8.957  -1.836
  303    HB3  LYS  41           2HB      LYS  41   3.830 -10.677  -1.514
  304    HG2  LYS  41           1HG      LYS  41   5.148 -11.239  -3.423
  305    HG3  LYS  41           2HG      LYS  41   5.167  -9.560  -3.967
  306    HD2  LYS  41           1HD      LYS  41   7.221  -9.694  -2.953
  307    HD3  LYS  41           2HD      LYS  41   6.232  -9.145  -1.599
  308    HE2  LYS  41           1HE      LYS  41   5.928 -11.744  -1.232
  309    HE3  LYS  41           2HE      LYS  41   7.454 -11.810  -2.112
  310    HZ1  LYS  41           3HZ      LYS  41   7.445 -11.593   0.459
  311    HZ2  LYS  41           1HZ      LYS  41   7.177  -9.951   0.147
  312    HZ3  LYS  41           2HZ      LYS  41   8.564 -10.711  -0.453
  313    H    HIS  42           H        HIS  42   1.788  -7.694  -2.345
  314    HA   HIS  42           HA       HIS  42   0.104  -8.530  -0.221
  315    HB2  HIS  42           1HB      HIS  42   0.737  -6.369   0.150
  316    HB3  HIS  42           2HB      HIS  42   0.753  -5.967  -1.565
  317    HD1  HIS  42           HD1      HIS  42  -1.371  -5.851   1.459
  318    HD2  HIS  42           HD2      HIS  42  -1.784  -5.207  -2.624
  319    HE1  HIS  42           HE1      HIS  42  -3.559  -4.642   1.187
  320    H    LYS  43           H        LYS  43  -0.525  -7.498  -3.550
  321    HA   LYS  43           HA       LYS  43  -3.216  -7.279  -3.658
  322    HB2  LYS  43           1HB      LYS  43  -1.336  -7.400  -5.542
  323    HB3  LYS  43           2HB      LYS  43  -1.997  -9.017  -5.748
  324    HG2  LYS  43           1HG      LYS  43  -3.690  -6.534  -5.786
  325    HG3  LYS  43           2HG      LYS  43  -2.966  -7.240  -7.232
  326    HD2  LYS  43           1HD      LYS  43  -4.783  -8.742  -5.352
  327    HD3  LYS  43           2HD      LYS  43  -5.337  -7.923  -6.814
  328    HE2  LYS  43           1HE      LYS  43  -3.581  -9.326  -8.038
  329    HE3  LYS  43           2HE      LYS  43  -3.508 -10.293  -6.566
  330    HZ1  LYS  43           3HZ      LYS  43  -6.190 -10.002  -7.172
  331    HZ2  LYS  43           1HZ      LYS  43  -5.252 -11.402  -7.323
  332    HZ3  LYS  43           2HZ      LYS  43  -5.429 -10.357  -8.641
  333    H    GLU  44           H        GLU  44  -1.436 -10.358  -3.756
  334    HA   GLU  44           HA       GLU  44  -3.581 -12.089  -4.027
  335    HB2  GLU  44           1HB      GLU  44  -2.098 -13.761  -3.583
  336    HB3  GLU  44           2HB      GLU  44  -0.945 -12.457  -3.835
  337    HG2  GLU  44           1HG      GLU  44  -0.792 -12.104  -1.435
  338    HG3  GLU  44           2HG      GLU  44  -1.981 -13.377  -1.163
  339    H    GLN  45           H        GLN  45  -2.352 -10.479  -1.155
  340    HA   GLN  45           HA       GLN  45  -4.567 -11.653   0.392
  341    HB2  GLN  45           1HB      GLN  45  -3.259 -11.361   2.386
  342    HB3  GLN  45           2HB      GLN  45  -2.273 -12.207   1.201
  343    HG2  GLN  45           1HG      GLN  45  -1.410  -9.822   0.622
  344    HG3  GLN  45           2HG      GLN  45  -2.029  -9.418   2.223
  345   HE21  GLN  45          1HE2      GLN  45  -0.028  -9.026   3.102
  346   HE22  GLN  45          2HE2      GLN  45   1.127 -10.274   3.405
  347    H    CYS  46           H        CYS  46  -4.583  -9.268  -1.373
  348    HA   CYS  46           HA       CYS  46  -4.708  -6.971   0.343
  349    HB2  CYS  46           1HB      CYS  46  -4.118  -6.534  -1.912
  350    HB3  CYS  46           2HB      CYS  46  -5.478  -7.466  -2.529
  351    H    ASN  47           H        ASN  47  -6.208  -7.288   1.943
  352    HA   ASN  47           HA       ASN  47  -8.992  -7.702   1.071
  353    HB2  ASN  47           1HB      ASN  47  -7.677  -8.350   3.718
  354    HB3  ASN  47           2HB      ASN  47  -9.407  -8.481   3.413
  355   HD21  ASN  47          1HD2      ASN  47  -8.561 -10.712   4.210
  356   HD22  ASN  47          2HD2      ASN  47  -8.221 -11.844   2.950
  357    HA   PRO  48           HA       PRO  48  -9.125  -3.370   2.379
  358    HB2  PRO  48           1HB      PRO  48 -11.451  -2.834   1.087
  359    HB3  PRO  48           2HB      PRO  48  -9.882  -2.853   0.273
  360    HG2  PRO  48           1HG      PRO  48 -11.992  -4.974   0.368
  361    HG3  PRO  48           2HG      PRO  48 -11.023  -4.421  -1.010
  362    HD2  PRO  48           1HD      PRO  48 -10.447  -6.683   0.362
  363    HD3  PRO  48           2HD      PRO  48  -9.192  -5.675  -0.387
  364    H    GLU  49           H        GLU  49 -10.725  -6.045   3.372
  365    HA   GLU  49           HA       GLU  49 -13.056  -4.934   4.574
  366    HB2  GLU  49           1HB      GLU  49 -11.565  -7.521   4.865
  367    HB3  GLU  49           2HB      GLU  49 -12.857  -7.114   5.986
  368    HG2  GLU  49           1HG      GLU  49 -13.389  -6.920   3.068
  369    HG3  GLU  49           2HG      GLU  49 -13.320  -8.514   3.819
  370    H    THR  50           H        THR  50 -13.026  -3.504   6.167
  371    HA   THR  50           HA       THR  50 -11.100  -3.880   8.360
  372    HB   THR  50           HB       THR  50 -11.888  -1.184   7.242
  373    HG1  THR  50           HG1      THR  50  -9.426  -1.354   6.805
  374   HG21  THR  50          3HG2      THR  50 -11.332  -0.732   9.425
  375   HG22  THR  50          1HG2      THR  50  -9.739  -0.646   8.673
  376   HG23  THR  50          2HG2      THR  50 -10.227  -2.101   9.542
  377    H    SER  51           H        SER  51 -11.839  -3.409  10.411
  378    HA   SER  51           HA       SER  51 -14.660  -2.599  10.643
  379    HB2  SER  51           1HB      SER  51 -14.258  -5.098  10.954
  380    HB3  SER  51           2HB      SER  51 -13.378  -4.676  12.422
  381    HG   SER  51           HG       SER  51 -15.659  -5.173  12.708
  382    H    GLY  52           H        GLY  52 -12.837  -0.678  10.864
  383    HA2  GLY  52           1HA      GLY  52 -12.800  -0.146  13.758
  384    HA3  GLY  52           2HA      GLY  52 -11.336   0.092  12.816
  385    HA   PRO  53           HA       PRO  53 -12.955   4.263  12.679
  386    HB2  PRO  53           1HB      PRO  53 -10.724   5.352  11.581
  387    HB3  PRO  53           2HB      PRO  53 -10.854   4.956  13.298
  388    HG2  PRO  53           1HG      PRO  53  -9.550   3.409  11.092
  389    HG3  PRO  53           2HG      PRO  53  -8.968   3.716  12.738
  390    HD2  PRO  53           1HD      PRO  53 -10.123   1.376  12.013
  391    HD3  PRO  53           2HD      PRO  53 -10.281   2.053  13.647
  392    H    SER  54           H        SER  54 -14.438   4.620  11.144
  393    HA   SER  54           HA       SER  54 -14.004   3.868   8.398
  394    HB2  SER  54           1HB      SER  54 -16.279   5.023   9.961
  395    HB3  SER  54           2HB      SER  54 -16.296   5.165   8.203
  396    HG   SER  54           HG       SER  54 -15.701   2.727   8.501
  397    H    SER  55           H        SER  55 -12.413   5.107   7.501
  398    HA   SER  55           HA       SER  55 -12.542   8.007   7.733
  399    HB2  SER  55           1HB      SER  55 -10.357   6.858   7.932
  400    HB3  SER  55           2HB      SER  55 -10.531   6.272   6.278
  401    HG   SER  55           HG       SER  55  -9.380   8.442   6.914
  402    H    GLY  56           H        GLY  56 -14.726   6.923   6.392
  403    HA2  GLY  56           1HA      GLY  56 -15.966   7.555   4.540
  404    HA3  GLY  56           2HA      GLY  56 -14.533   8.338   3.890
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1  -5.849  22.203  36.723
    2    HA2  GLY   1           1HA      GLY   1  -3.095  22.726  35.841
    3    HA3  GLY   1           2HA      GLY   1  -3.697  21.076  35.807
    4    H    SER   2           H        SER   2  -3.622  24.110  34.216
    5    HA   SER   2           HA       SER   2  -5.827  23.719  32.465
    6    HB2  SER   2           1HB      SER   2  -3.388  25.496  32.291
    7    HB3  SER   2           2HB      SER   2  -4.685  25.516  31.096
    8    HG   SER   2           HG       SER   2  -6.073  25.839  33.074
    9    H    SER   3           H        SER   3  -5.989  22.274  30.899
   10    HA   SER   3           HA       SER   3  -3.711  21.711  29.182
   11    HB2  SER   3           1HB      SER   3  -3.793  19.318  29.464
   12    HB3  SER   3           2HB      SER   3  -3.601  20.046  31.058
   13    HG   SER   3           HG       SER   3  -5.803  19.725  31.422
   14    H    GLY   4           H        GLY   4  -4.402  21.803  27.155
   15    HA2  GLY   4           1HA      GLY   4  -7.260  21.525  26.612
   16    HA3  GLY   4           2HA      GLY   4  -6.055  22.190  25.520
   17    H    SER   5           H        SER   5  -5.890  20.995  23.754
   18    HA   SER   5           HA       SER   5  -5.209  18.231  23.876
   19    HB2  SER   5           1HB      SER   5  -7.768  18.305  24.210
   20    HB3  SER   5           2HB      SER   5  -7.840  18.763  22.508
   21    HG   SER   5           HG       SER   5  -6.858  16.370  23.649
   22    H    SER   6           H        SER   6  -4.070  17.683  22.113
   23    HA   SER   6           HA       SER   6  -4.406  19.268  19.664
   24    HB2  SER   6           1HB      SER   6  -2.442  20.042  21.144
   25    HB3  SER   6           2HB      SER   6  -1.666  18.529  20.677
   26    HG   SER   6           HG       SER   6  -2.494  19.508  18.443
   27    H    GLY   7           H        GLY   7  -3.871  18.205  17.738
   28    HA2  GLY   7           1HA      GLY   7  -2.734  15.585  17.696
   29    HA3  GLY   7           2HA      GLY   7  -4.482  15.526  17.532
   30    H    LEU   8           H        LEU   8  -1.773  17.432  16.204
   31    HA   LEU   8           HA       LEU   8  -3.071  17.248  13.569
   32    HB2  LEU   8           1HB      LEU   8  -1.433  19.324  14.910
   33    HB3  LEU   8           2HB      LEU   8  -1.234  19.139  13.169
   34    HG   LEU   8           HG       LEU   8  -2.836  20.918  13.812
   35   HD11  LEU   8          1HD1      LEU   8  -3.679  18.567  12.169
   36   HD12  LEU   8          2HD1      LEU   8  -3.161  20.170  11.648
   37   HD13  LEU   8          3HD1      LEU   8  -4.754  19.950  12.371
   38   HD21  LEU   8          3HD2      LEU   8  -4.104  18.624  15.203
   39   HD22  LEU   8          1HD2      LEU   8  -5.165  19.809  14.440
   40   HD23  LEU   8          2HD2      LEU   8  -4.009  20.323  15.669
   41    H    LYS   9           H        LYS   9   0.092  17.108  15.177
   42    HA   LYS   9           HA       LYS   9   1.449  16.156  12.841
   43    HB2  LYS   9           1HB      LYS   9   2.710  17.400  14.466
   44    HB3  LYS   9           2HB      LYS   9   2.251  16.288  15.750
   45    HG2  LYS   9           1HG      LYS   9   4.330  15.498  15.334
   46    HG3  LYS   9           2HG      LYS   9   3.443  14.545  14.141
   47    HD2  LYS   9           1HD      LYS   9   4.443  17.222  13.322
   48    HD3  LYS   9           2HD      LYS   9   5.621  15.920  13.504
   49    HE2  LYS   9           1HE      LYS   9   5.058  15.585  11.326
   50    HE3  LYS   9           2HE      LYS   9   3.806  14.602  12.083
   51    HZ1  LYS   9           3HZ      LYS   9   3.514  16.885  10.449
   52    HZ2  LYS   9           1HZ      LYS   9   2.821  17.188  11.963
   53    HZ3  LYS   9           2HZ      LYS   9   2.318  15.853  11.054
   54    H    CYS  10           H        CYS  10   0.538  14.277  12.103
   55    HA   CYS  10           HA       CYS  10   0.307  12.024  13.959
   56    HB2  CYS  10           1HB      CYS  10  -0.936  10.919  12.130
   57    HB3  CYS  10           2HB      CYS  10  -1.653  12.460  12.585
   58    HG   CYS  10           HG       CYS  10  -1.968  12.762   9.997
   59    H    SER  11           H        SER  11   1.157   9.939  13.374
   60    HA   SER  11           HA       SER  11   3.804  10.140  12.255
   61    HB2  SER  11           1HB      SER  11   2.929   8.671  14.264
   62    HB3  SER  11           2HB      SER  11   2.563   7.515  12.984
   63    HG   SER  11           HG       SER  11   4.620   7.134  12.749
   64    H    THR  12           H        THR  12   4.584   9.157  10.413
   65    HA   THR  12           HA       THR  12   2.572   8.568   8.386
   66    HB   THR  12           HB       THR  12   4.395  10.152   7.844
   67    HG1  THR  12           HG1      THR  12   3.436   8.285   6.356
   68   HG21  THR  12          3HG2      THR  12   6.159   9.037   9.182
   69   HG22  THR  12          1HG2      THR  12   6.662   9.370   7.526
   70   HG23  THR  12          2HG2      THR  12   6.198   7.734   7.995
   71    H    VAL  13           H        VAL  13   2.612   6.688   7.098
   72    HA   VAL  13           HA       VAL  13   3.812   4.372   8.451
   73    HB   VAL  13           HB       VAL  13   1.308   4.460   8.058
   74   HG11  VAL  13          1HG1      VAL  13   0.944   5.293   5.949
   75   HG12  VAL  13          2HG1      VAL  13   2.291   4.397   5.244
   76   HG13  VAL  13          3HG1      VAL  13   0.792   3.562   5.652
   77   HG21  VAL  13          3HG2      VAL  13   1.829   2.035   6.684
   78   HG22  VAL  13          1HG2      VAL  13   3.168   2.326   7.794
   79   HG23  VAL  13          2HG2      VAL  13   1.513   2.275   8.402
   80    H    VAL  14           H        VAL  14   4.914   2.777   7.274
   81    HA   VAL  14           HA       VAL  14   5.925   3.683   4.657
   82    HB   VAL  14           HB       VAL  14   7.960   2.368   5.130
   83   HG11  VAL  14          1HG1      VAL  14   7.664   4.821   5.733
   84   HG12  VAL  14          2HG1      VAL  14   7.474   4.276   7.401
   85   HG13  VAL  14          3HG1      VAL  14   8.977   3.958   6.534
   86   HG21  VAL  14          3HG2      VAL  14   8.183   1.871   7.716
   87   HG22  VAL  14          1HG2      VAL  14   6.432   1.704   7.592
   88   HG23  VAL  14          2HG2      VAL  14   7.486   0.689   6.608
   89    H    CYS  15           H        CYS  15   6.537   1.981   3.139
   90    HA   CYS  15           HA       CYS  15   4.590   0.304   2.368
   91    HB2  CYS  15           1HB      CYS  15   6.807   0.741   1.209
   92    HB3  CYS  15           2HB      CYS  15   7.484  -0.540   2.209
   93    H    VAL  16           H        VAL  16   3.566  -1.407   3.158
   94    HA   VAL  16           HA       VAL  16   4.438  -2.640   5.600
   95    HB   VAL  16           HB       VAL  16   2.404  -3.964   5.466
   96   HG11  VAL  16          1HG1      VAL  16   0.907  -1.747   4.786
   97   HG12  VAL  16          2HG1      VAL  16   1.565  -2.110   6.383
   98   HG13  VAL  16          3HG1      VAL  16   2.457  -1.065   5.277
   99   HG21  VAL  16          3HG2      VAL  16   0.937  -3.119   3.345
  100   HG22  VAL  16          1HG2      VAL  16   2.552  -3.188   2.638
  101   HG23  VAL  16          2HG2      VAL  16   1.855  -4.625   3.386
  102    H    ILE  17           H        ILE  17   5.794  -2.995   2.807
  103    HA   ILE  17           HA       ILE  17   5.991  -5.932   2.957
  104    HB   ILE  17           HB       ILE  17   6.543  -4.229   0.527
  105   HG12  ILE  17          1HG1      ILE  17   4.180  -4.119   0.974
  106   HG13  ILE  17          2HG1      ILE  17   4.428  -5.248  -0.354
  107   HG21  ILE  17          1HG2      ILE  17   7.031  -6.146  -0.616
  108   HG22  ILE  17          2HG2      ILE  17   7.607  -6.597   0.988
  109   HG23  ILE  17          3HG2      ILE  17   6.031  -7.155   0.428
  110   HD11  ILE  17          3HD1      ILE  17   4.454  -6.999   1.623
  111   HD12  ILE  17          1HD1      ILE  17   3.501  -5.743   2.413
  112   HD13  ILE  17          2HD1      ILE  17   2.953  -6.438   0.887
  113    H    CYS  18           H        CYS  18   7.882  -3.135   1.796
  114    HA   CYS  18           HA       CYS  18  10.311  -4.477   2.765
  115    HB2  CYS  18           1HB      CYS  18  11.553  -3.071   1.233
  116    HB3  CYS  18           2HB      CYS  18  10.241  -3.857   0.360
  117    H    LEU  19           H        LEU  19   8.216  -1.845   3.345
  118    HA   LEU  19           HA       LEU  19   8.177  -0.289   5.012
  119    HB2  LEU  19           1HB      LEU  19  10.846  -1.326   5.925
  120    HB3  LEU  19           2HB      LEU  19   9.638  -0.456   6.868
  121    HG   LEU  19           HG       LEU  19   9.109  -3.197   5.755
  122   HD11  LEU  19          1HD1      LEU  19  11.072  -2.569   7.668
  123   HD12  LEU  19          2HD1      LEU  19  10.442  -4.159   7.240
  124   HD13  LEU  19          3HD1      LEU  19   9.701  -3.240   8.551
  125   HD21  LEU  19          3HD2      LEU  19   7.602  -3.180   7.824
  126   HD22  LEU  19          1HD2      LEU  19   7.116  -2.189   6.448
  127   HD23  LEU  19          2HD2      LEU  19   7.876  -1.438   7.851
  128    H    GLU  20           H        GLU  20   8.838   0.678   2.669
  129    HA   GLU  20           HA       GLU  20  10.989   2.586   3.267
  130    HB2  GLU  20           1HB      GLU  20  10.547   1.213   0.610
  131    HB3  GLU  20           2HB      GLU  20  11.690   2.518   0.896
  132    HG2  GLU  20           1HG      GLU  20  12.681   0.956   2.690
  133    HG3  GLU  20           2HG      GLU  20  11.785  -0.311   1.854
  134    H    LYS  21           H        LYS  21  10.825   4.606   2.074
  135    HA   LYS  21           HA       LYS  21   8.468   5.913   2.267
  136    HB2  LYS  21           1HB      LYS  21  10.741   6.307   0.338
  137    HB3  LYS  21           2HB      LYS  21   9.348   7.382   0.329
  138    HG2  LYS  21           1HG      LYS  21   9.828   8.229   2.437
  139    HG3  LYS  21           2HG      LYS  21  10.858   6.860   2.858
  140    HD2  LYS  21           1HD      LYS  21  11.635   8.587   0.557
  141    HD3  LYS  21           2HD      LYS  21  11.892   9.190   2.196
  142    HE2  LYS  21           1HE      LYS  21  12.816   6.451   1.415
  143    HE3  LYS  21           2HE      LYS  21  13.785   7.869   1.017
  144    HZ1  LYS  21           3HZ      LYS  21  14.395   8.145   3.139
  145    HZ2  LYS  21           1HZ      LYS  21  13.943   6.525   3.329
  146    HZ3  LYS  21           2HZ      LYS  21  12.867   7.759   3.755
  147    HA   PRO  22           HA       PRO  22   6.114   3.610  -0.835
  148    HB2  PRO  22           1HB      PRO  22   3.695   4.417   0.097
  149    HB3  PRO  22           2HB      PRO  22   4.612   3.094   0.825
  150    HG2  PRO  22           1HG      PRO  22   4.392   5.949   1.696
  151    HG3  PRO  22           2HG      PRO  22   4.351   4.474   2.678
  152    HD2  PRO  22           1HD      PRO  22   6.567   6.014   2.454
  153    HD3  PRO  22           2HD      PRO  22   6.645   4.253   2.668
  154    H    LYS  23           H        LYS  23   6.198   4.538  -2.790
  155    HA   LYS  23           HA       LYS  23   5.784   7.324  -3.232
  156    HB2  LYS  23           1HB      LYS  23   6.050   4.973  -5.105
  157    HB3  LYS  23           2HB      LYS  23   5.837   6.624  -5.672
  158    HG2  LYS  23           1HG      LYS  23   7.897   7.223  -4.356
  159    HG3  LYS  23           2HG      LYS  23   8.143   5.492  -4.113
  160    HD2  LYS  23           1HD      LYS  23   7.687   6.455  -6.887
  161    HD3  LYS  23           2HD      LYS  23   9.249   6.801  -6.140
  162    HE2  LYS  23           1HE      LYS  23   9.750   4.528  -5.874
  163    HE3  LYS  23           2HE      LYS  23   8.072   4.041  -6.111
  164    HZ1  LYS  23           3HZ      LYS  23   9.412   5.418  -8.315
  165    HZ2  LYS  23           1HZ      LYS  23   8.246   4.192  -8.355
  166    HZ3  LYS  23           2HZ      LYS  23   9.858   3.815  -8.009
  167    H    TYR  24           H        TYR  24   3.834   4.420  -3.750
  168    HA   TYR  24           HA       TYR  24   1.482   6.155  -4.068
  169    HB2  TYR  24           1HB      TYR  24   1.611   3.576  -5.575
  170    HB3  TYR  24           2HB      TYR  24   0.696   5.036  -5.934
  171    HD1  TYR  24           HD1      TYR  24   4.115   3.595  -5.960
  172    HD2  TYR  24           HD2      TYR  24   1.544   6.656  -7.416
  173    HE1  TYR  24           HE1      TYR  24   5.847   4.276  -7.568
  174    HE2  TYR  24           HE2      TYR  24   3.268   7.345  -9.029
  175    HH   TYR  24           HH       TYR  24   6.382   6.596  -8.822
  176    H    ARG  25           H        ARG  25  -0.587   4.765  -3.862
  177    HA   ARG  25           HA       ARG  25  -0.221   2.666  -1.839
  178    HB2  ARG  25           1HB      ARG  25  -1.785   5.198  -1.610
  179    HB3  ARG  25           2HB      ARG  25  -2.428   3.747  -0.851
  180    HG2  ARG  25           1HG      ARG  25  -0.261   3.503   0.355
  181    HG3  ARG  25           2HG      ARG  25   0.218   5.069  -0.303
  182    HD2  ARG  25           1HD      ARG  25  -2.309   4.673   1.280
  183    HD3  ARG  25           2HD      ARG  25  -0.766   5.067   2.037
  184    HE   ARG  25           HE       ARG  25  -1.542   6.860  -0.082
  185   HH11  ARG  25          2HH1      ARG  25  -1.734   6.164   3.324
  186   HH12  ARG  25          1HH1      ARG  25  -2.065   7.804   3.773
  187   HH21  ARG  25          2HH2      ARG  25  -1.977   9.023   0.496
  188   HH22  ARG  25          1HH2      ARG  25  -2.204   9.429   2.164
  189    H    CYS  26           H        CYS  26  -2.177   1.332  -1.527
  190    HA   CYS  26           HA       CYS  26  -3.251   0.546  -4.053
  191    HB2  CYS  26           1HB      CYS  26  -2.727  -1.045  -2.206
  192    HB3  CYS  26           2HB      CYS  26  -4.072  -0.372  -1.291
  193    HA   PRO  27           HA       PRO  27  -6.712   3.341  -3.974
  194    HB2  PRO  27           1HB      PRO  27  -7.875   2.416  -6.246
  195    HB3  PRO  27           2HB      PRO  27  -6.457   3.471  -6.253
  196    HG2  PRO  27           1HG      PRO  27  -6.608   0.499  -6.571
  197    HG3  PRO  27           2HG      PRO  27  -5.630   1.672  -7.472
  198    HD2  PRO  27           1HD      PRO  27  -4.612   0.157  -5.472
  199    HD3  PRO  27           2HD      PRO  27  -4.031   1.798  -5.817
  200    H    ALA  28           H        ALA  28  -6.651   0.252  -3.033
  201    HA   ALA  28           HA       ALA  28  -9.586   0.002  -2.916
  202    HB1  ALA  28           3HB      ALA  28  -9.099  -2.452  -2.497
  203    HB2  ALA  28           1HB      ALA  28  -8.775  -1.850  -4.123
  204    HB3  ALA  28           2HB      ALA  28  -7.443  -2.104  -2.995
  205    H    CYS  29           H        CYS  29  -6.697  -1.019  -1.080
  206    HA   CYS  29           HA       CYS  29  -8.235  -0.695   1.397
  207    HB2  CYS  29           1HB      CYS  29  -6.259  -1.930   2.413
  208    HB3  CYS  29           2HB      CYS  29  -7.251  -2.851   1.287
  209    H    ARG  30           H        ARG  30  -5.855   0.824  -0.477
  210    HA   ARG  30           HA       ARG  30  -4.655   2.736  -0.178
  211    HB2  ARG  30           1HB      ARG  30  -6.108   2.926   2.467
  212    HB3  ARG  30           2HB      ARG  30  -5.207   4.219   1.685
  213    HG2  ARG  30           1HG      ARG  30  -7.506   2.911   0.291
  214    HG3  ARG  30           2HG      ARG  30  -7.776   4.177   1.489
  215    HD2  ARG  30           1HD      ARG  30  -5.917   5.406   0.051
  216    HD3  ARG  30           2HD      ARG  30  -6.534   4.333  -1.205
  217    HE   ARG  30           HE       ARG  30  -7.931   6.550   0.046
  218   HH11  ARG  30          2HH1      ARG  30  -8.107   3.735  -1.994
  219   HH12  ARG  30          1HH1      ARG  30  -9.590   4.215  -2.751
  220   HH21  ARG  30          2HH2      ARG  30  -9.883   7.193  -0.943
  221   HH22  ARG  30          1HH2      ARG  30 -10.599   6.183  -2.153
  222    H    VAL  31           H        VAL  31  -3.218   0.577   0.201
  223    HA   VAL  31           HA       VAL  31  -1.825   0.860   2.774
  224    HB   VAL  31           HB       VAL  31  -0.737  -1.303   2.190
  225   HG11  VAL  31          1HG1      VAL  31  -3.591  -0.895   2.724
  226   HG12  VAL  31          2HG1      VAL  31  -3.175  -2.508   2.143
  227   HG13  VAL  31          3HG1      VAL  31  -2.400  -1.863   3.591
  228   HG21  VAL  31          3HG2      VAL  31  -2.498  -2.340   0.284
  229   HG22  VAL  31          1HG2      VAL  31  -2.003  -0.767  -0.341
  230   HG23  VAL  31          2HG2      VAL  31  -0.786  -1.976   0.069
  231    HA   PRO  32           HA       PRO  32   1.643   2.786   0.876
  232    HB2  PRO  32           1HB      PRO  32   3.598   2.009   2.592
  233    HB3  PRO  32           2HB      PRO  32   2.384   3.225   3.006
  234    HG2  PRO  32           1HG      PRO  32   2.471   0.319   3.716
  235    HG3  PRO  32           2HG      PRO  32   2.041   1.706   4.732
  236    HD2  PRO  32           1HD      PRO  32   0.180   0.097   3.601
  237    HD3  PRO  32           2HD      PRO  32  -0.097   1.828   3.879
  238    H    TYR  33           H        TYR  33   2.627   2.158  -0.931
  239    HA   TYR  33           HA       TYR  33   4.265  -0.246  -0.935
  240    HB2  TYR  33           1HB      TYR  33   3.136  -1.421  -2.541
  241    HB3  TYR  33           2HB      TYR  33   1.767  -0.607  -1.792
  242    HD1  TYR  33           HD2      TYR  33   4.143  -0.397  -4.638
  243    HD2  TYR  33           HD1      TYR  33   0.391   0.825  -3.047
  244    HE1  TYR  33           HE2      TYR  33   3.550   0.590  -6.811
  245    HE2  TYR  33           HE1      TYR  33  -0.214   1.814  -5.216
  246    HH   TYR  33           HH       TYR  33   1.579   2.730  -7.384
  247    H    CYS  34           H        CYS  34   6.157   0.293  -1.773
  248    HA   CYS  34           HA       CYS  34   6.683   2.742  -3.034
  249    HB2  CYS  34           1HB      CYS  34   8.862   1.489  -3.731
  250    HB3  CYS  34           2HB      CYS  34   8.550   1.794  -2.025
  251    H    SER  35           H        SER  35   7.231  -0.417  -4.573
  252    HA   SER  35           HA       SER  35   6.211   0.740  -7.086
  253    HB2  SER  35           1HB      SER  35   8.402  -1.310  -6.686
  254    HB3  SER  35           2HB      SER  35   7.764  -0.818  -8.255
  255    HG   SER  35           HG       SER  35   9.593   0.409  -6.688
  256    H    VAL  36           H        VAL  36   5.456  -0.965  -8.663
  257    HA   VAL  36           HA       VAL  36   3.252  -2.301  -7.757
  258    HB   VAL  36           HB       VAL  36   4.990  -3.152 -10.078
  259   HG11  VAL  36          1HG1      VAL  36   3.477  -4.704 -10.595
  260   HG12  VAL  36          2HG1      VAL  36   2.826  -4.478  -8.971
  261   HG13  VAL  36          3HG1      VAL  36   2.136  -3.591 -10.330
  262   HG21  VAL  36          3HG2      VAL  36   4.018  -0.730  -9.891
  263   HG22  VAL  36          1HG2      VAL  36   3.906  -1.619 -11.410
  264   HG23  VAL  36          2HG2      VAL  36   2.506  -1.518 -10.342
  265    H    VAL  37           H        VAL  37   6.505  -3.664  -8.200
  266    HA   VAL  37           HA       VAL  37   6.219  -6.281  -7.702
  267    HB   VAL  37           HB       VAL  37   8.264  -4.524  -6.339
  268   HG11  VAL  37          1HG1      VAL  37   8.510  -6.515  -5.217
  269   HG12  VAL  37          2HG1      VAL  37   7.972  -7.482  -6.592
  270   HG13  VAL  37          3HG1      VAL  37   9.587  -6.770  -6.590
  271   HG21  VAL  37          3HG2      VAL  37   8.435  -6.039  -8.943
  272   HG22  VAL  37          1HG2      VAL  37   8.198  -4.298  -8.793
  273   HG23  VAL  37          2HG2      VAL  37   9.696  -5.036  -8.226
  274    H    CYS  38           H        CYS  38   6.818  -4.071  -4.966
  275    HA   CYS  38           HA       CYS  38   6.177  -5.819  -2.932
  276    HB2  CYS  38           1HB      CYS  38   6.215  -2.857  -3.200
  277    HB3  CYS  38           2HB      CYS  38   5.399  -3.526  -1.792
  278    H    PHE  39           H        PHE  39   4.035  -3.780  -4.848
  279    HA   PHE  39           HA       PHE  39   1.691  -4.169  -3.344
  280    HB2  PHE  39           1HB      PHE  39   1.963  -2.421  -5.085
  281    HB3  PHE  39           2HB      PHE  39   1.926  -3.676  -6.320
  282    HD1  PHE  39           HD2      PHE  39  -0.194  -5.292  -6.105
  283    HD2  PHE  39           HD1      PHE  39   0.020  -1.285  -4.683
  284    HE1  PHE  39           HE2      PHE  39  -2.647  -5.134  -6.190
  285    HE2  PHE  39           HE1      PHE  39  -2.434  -1.122  -4.765
  286    HZ   PHE  39           HZ       PHE  39  -3.771  -3.047  -5.521
  287    H    ARG  40           H        ARG  40   3.066  -5.965  -6.065
  288    HA   ARG  40           HA       ARG  40   1.039  -7.693  -6.683
  289    HB2  ARG  40           1HB      ARG  40   3.958  -8.443  -6.435
  290    HB3  ARG  40           2HB      ARG  40   2.747  -9.287  -7.391
  291    HG2  ARG  40           1HG      ARG  40   2.453  -7.056  -8.624
  292    HG3  ARG  40           2HG      ARG  40   3.986  -6.605  -7.875
  293    HD2  ARG  40           1HD      ARG  40   4.587  -7.484  -9.960
  294    HD3  ARG  40           2HD      ARG  40   4.892  -8.795  -8.821
  295    HE   ARG  40           HE       ARG  40   2.393  -9.329  -9.646
  296   HH11  ARG  40          2HH1      ARG  40   5.319  -8.587 -11.379
  297   HH12  ARG  40          1HH1      ARG  40   4.886  -9.523 -12.771
  298   HH21  ARG  40          2HH2      ARG  40   1.812 -10.565 -11.472
  299   HH22  ARG  40          1HH2      ARG  40   2.891 -10.647 -12.824
  300    H    LYS  41           H        LYS  41   3.619  -8.452  -4.335
  301    HA   LYS  41           HA       LYS  41   2.578 -10.791  -3.324
  302    HB2  LYS  41           1HB      LYS  41   4.058  -8.668  -1.758
  303    HB3  LYS  41           2HB      LYS  41   3.899 -10.360  -1.307
  304    HG2  LYS  41           1HG      LYS  41   5.339 -11.075  -2.978
  305    HG3  LYS  41           2HG      LYS  41   5.140  -9.594  -3.918
  306    HD2  LYS  41           1HD      LYS  41   6.385  -8.340  -2.252
  307    HD3  LYS  41           2HD      LYS  41   6.524  -9.780  -1.241
  308    HE2  LYS  41           1HE      LYS  41   7.609 -10.804  -3.399
  309    HE3  LYS  41           2HE      LYS  41   7.894  -9.113  -3.807
  310    HZ1  LYS  41           3HZ      LYS  41   9.674  -9.203  -2.515
  311    HZ2  LYS  41           1HZ      LYS  41   9.291 -10.761  -1.979
  312    HZ3  LYS  41           2HZ      LYS  41   8.667  -9.412  -1.172
  313    H    HIS  42           H        HIS  42   1.675  -7.487  -2.581
  314    HA   HIS  42           HA       HIS  42   0.084  -8.102  -0.301
  315    HB2  HIS  42           1HB      HIS  42   0.587  -5.875  -0.261
  316    HB3  HIS  42           2HB      HIS  42   0.557  -5.727  -2.015
  317    HD1  HIS  42           HD1      HIS  42  -1.858  -5.991   0.898
  318    HD2  HIS  42           HD2      HIS  42  -1.709  -4.594  -3.012
  319    HE1  HIS  42           HE1      HIS  42  -4.039  -4.796   0.528
  320    H    LYS  43           H        LYS  43  -0.804  -7.219  -3.642
  321    HA   LYS  43           HA       LYS  43  -3.475  -7.372  -3.648
  322    HB2  LYS  43           1HB      LYS  43  -2.181  -7.034  -5.686
  323    HB3  LYS  43           2HB      LYS  43  -1.661  -8.714  -5.661
  324    HG2  LYS  43           1HG      LYS  43  -3.350  -8.781  -7.208
  325    HG3  LYS  43           2HG      LYS  43  -4.217  -9.216  -5.733
  326    HD2  LYS  43           1HD      LYS  43  -5.631  -7.613  -6.526
  327    HD3  LYS  43           2HD      LYS  43  -4.537  -6.584  -5.598
  328    HE2  LYS  43           1HE      LYS  43  -4.811  -5.541  -7.705
  329    HE3  LYS  43           2HE      LYS  43  -3.212  -6.283  -7.723
  330    HZ1  LYS  43           3HZ      LYS  43  -4.373  -8.234  -8.838
  331    HZ2  LYS  43           1HZ      LYS  43  -4.148  -6.838  -9.766
  332    HZ3  LYS  43           2HZ      LYS  43  -5.667  -7.178  -9.104
  333    H    GLU  44           H        GLU  44  -1.316 -10.155  -3.445
  334    HA   GLU  44           HA       GLU  44  -3.021 -12.258  -3.797
  335    HB2  GLU  44           1HB      GLU  44  -0.624 -11.824  -2.094
  336    HB3  GLU  44           2HB      GLU  44  -1.591 -13.255  -1.768
  337    HG2  GLU  44           1HG      GLU  44  -1.207 -14.140  -3.902
  338    HG3  GLU  44           2HG      GLU  44  -0.624 -12.598  -4.528
  339    H    GLN  45           H        GLN  45  -2.538 -10.423  -0.793
  340    HA   GLN  45           HA       GLN  45  -5.079 -11.547   0.190
  341    HB2  GLN  45           1HB      GLN  45  -2.629 -10.770   1.780
  342    HB3  GLN  45           2HB      GLN  45  -4.170 -11.233   2.488
  343    HG2  GLN  45           1HG      GLN  45  -3.918 -13.413   1.195
  344    HG3  GLN  45           2HG      GLN  45  -2.242 -12.927   0.943
  345   HE21  GLN  45          1HE2      GLN  45  -2.239 -15.128   2.152
  346   HE22  GLN  45          2HE2      GLN  45  -2.059 -15.014   3.866
  347    H    CYS  46           H        CYS  46  -4.543  -9.101  -1.381
  348    HA   CYS  46           HA       CYS  46  -4.624  -6.787   0.175
  349    HB2  CYS  46           1HB      CYS  46  -4.252  -6.403  -2.091
  350    HB3  CYS  46           2HB      CYS  46  -5.568  -7.462  -2.589
  351    H    ASN  47           H        ASN  47  -6.018  -6.386   1.760
  352    HA   ASN  47           HA       ASN  47  -8.837  -7.148   1.386
  353    HB2  ASN  47           1HB      ASN  47  -7.355  -7.992   3.391
  354    HB3  ASN  47           2HB      ASN  47  -7.709  -6.401   4.058
  355   HD21  ASN  47          1HD2      ASN  47  -8.682  -7.908   5.697
  356   HD22  ASN  47          2HD2      ASN  47 -10.342  -8.332   5.478
  357    HA   PRO  48           HA       PRO  48  -9.240  -2.670   0.958
  358    HB2  PRO  48           1HB      PRO  48 -11.756  -2.779  -0.055
  359    HB3  PRO  48           2HB      PRO  48 -10.313  -3.064  -1.035
  360    HG2  PRO  48           1HG      PRO  48 -12.178  -5.047   0.209
  361    HG3  PRO  48           2HG      PRO  48 -11.456  -5.054  -1.410
  362    HD2  PRO  48           1HD      PRO  48 -10.490  -6.559   0.623
  363    HD3  PRO  48           2HD      PRO  48  -9.447  -5.888  -0.648
  364    H    GLU  49           H        GLU  49 -11.142  -1.181   1.596
  365    HA   GLU  49           HA       GLU  49 -12.232  -2.126   4.165
  366    HB2  GLU  49           1HB      GLU  49 -11.055   0.487   3.329
  367    HB3  GLU  49           2HB      GLU  49 -12.318   0.489   4.551
  368    HG2  GLU  49           1HG      GLU  49 -10.866  -1.294   5.722
  369    HG3  GLU  49           2HG      GLU  49  -9.580  -0.699   4.673
  370    H    THR  50           H        THR  50 -14.184  -2.868   3.327
  371    HA   THR  50           HA       THR  50 -16.134  -0.782   2.803
  372    HB   THR  50           HB       THR  50 -15.809  -3.062   0.843
  373    HG1  THR  50           HG1      THR  50 -14.767  -0.496   0.916
  374   HG21  THR  50          3HG2      THR  50 -17.472  -0.648   0.329
  375   HG22  THR  50          1HG2      THR  50 -18.111  -1.880   1.416
  376   HG23  THR  50          2HG2      THR  50 -17.679  -2.304  -0.241
  377    H    SER  51           H        SER  51 -18.112  -1.275   3.591
  378    HA   SER  51           HA       SER  51 -18.571  -4.049   4.473
  379    HB2  SER  51           1HB      SER  51 -18.044  -2.230   6.276
  380    HB3  SER  51           2HB      SER  51 -19.704  -1.715   5.983
  381    HG   SER  51           HG       SER  51 -18.814  -4.263   6.851
  382    H    GLY  52           H        GLY  52 -20.100  -4.842   3.176
  383    HA2  GLY  52           1HA      GLY  52 -21.898  -3.509   1.597
  384    HA3  GLY  52           2HA      GLY  52 -22.189  -5.115   2.248
  385    HA   PRO  53           HA       PRO  53 -24.958  -1.671   4.152
  386    HB2  PRO  53           1HB      PRO  53 -27.079  -1.727   2.458
  387    HB3  PRO  53           2HB      PRO  53 -25.715  -0.622   2.253
  388    HG2  PRO  53           1HG      PRO  53 -26.269  -3.223   0.878
  389    HG3  PRO  53           2HG      PRO  53 -25.679  -1.698   0.192
  390    HD2  PRO  53           1HD      PRO  53 -24.035  -3.775   0.757
  391    HD3  PRO  53           2HD      PRO  53 -23.512  -2.082   0.879
  392    H    SER  54           H        SER  54 -24.893  -4.889   3.446
  393    HA   SER  54           HA       SER  54 -27.515  -5.709   4.170
  394    HB2  SER  54           1HB      SER  54 -26.015  -7.165   2.885
  395    HB3  SER  54           2HB      SER  54 -24.910  -7.252   4.257
  396    HG   SER  54           HG       SER  54 -27.231  -7.936   5.212
  397    H    SER  55           H        SER  55 -24.437  -5.713   5.964
  398    HA   SER  55           HA       SER  55 -26.007  -5.716   8.459
  399    HB2  SER  55           1HB      SER  55 -23.514  -7.204   7.713
  400    HB3  SER  55           2HB      SER  55 -23.784  -6.756   9.397
  401    HG   SER  55           HG       SER  55 -25.563  -8.256   7.767
  402    H    GLY  56           H        GLY  56 -26.006  -3.563   8.916
  403    HA2  GLY  56           1HA      GLY  56 -23.451  -2.425   9.726
  404    HA3  GLY  56           2HA      GLY  56 -24.309  -1.563   8.458
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1  -5.360  25.585  39.026
    2    HA2  GLY   1           1HA      GLY   1  -3.812  25.644  37.260
    3    HA3  GLY   1           2HA      GLY   1  -2.990  24.615  38.424
    4    H    SER   2           H        SER   2  -4.970  24.658  35.525
    5    HA   SER   2           HA       SER   2  -4.445  21.807  35.099
    6    HB2  SER   2           1HB      SER   2  -6.738  22.311  34.760
    7    HB3  SER   2           2HB      SER   2  -6.361  23.755  33.820
    8    HG   SER   2           HG       SER   2  -6.981  22.009  32.483
    9    H    SER   3           H        SER   3  -2.334  21.753  34.422
   10    HA   SER   3           HA       SER   3  -1.042  23.505  32.716
   11    HB2  SER   3           1HB      SER   3   0.121  21.746  33.980
   12    HB3  SER   3           2HB      SER   3  -0.609  20.516  32.949
   13    HG   SER   3           HG       SER   3   0.622  21.166  31.275
   14    H    GLY   4           H        GLY   4  -2.744  20.493  31.862
   15    HA2  GLY   4           1HA      GLY   4  -3.773  19.858  29.907
   16    HA3  GLY   4           2HA      GLY   4  -3.753  21.550  29.434
   17    H    SER   5           H        SER   5  -1.346  18.959  29.921
   18    HA   SER   5           HA       SER   5   0.434  19.953  27.968
   19    HB2  SER   5           1HB      SER   5   0.160  17.347  29.429
   20    HB3  SER   5           2HB      SER   5   1.308  17.488  28.099
   21    HG   SER   5           HG       SER   5   1.219  19.159  30.393
   22    H    SER   6           H        SER   6  -0.692  20.330  26.060
   23    HA   SER   6           HA       SER   6  -2.377  18.513  24.759
   24    HB2  SER   6           1HB      SER   6  -2.321  20.865  24.134
   25    HB3  SER   6           2HB      SER   6  -0.650  20.711  23.594
   26    HG   SER   6           HG       SER   6  -1.292  19.659  21.836
   27    H    GLY   7           H        GLY   7  -2.015  16.712  23.631
   28    HA2  GLY   7           1HA      GLY   7   0.753  15.871  23.222
   29    HA3  GLY   7           2HA      GLY   7  -0.671  14.849  23.109
   30    H    LEU   8           H        LEU   8   1.008  14.413  21.173
   31    HA   LEU   8           HA       LEU   8  -0.391  15.257  18.826
   32    HB2  LEU   8           1HB      LEU   8   1.281  16.486  17.733
   33    HB3  LEU   8           2HB      LEU   8   1.167  17.176  19.351
   34    HG   LEU   8           HG       LEU   8   3.284  15.196  18.525
   35   HD11  LEU   8          1HD1      LEU   8   3.090  18.108  18.132
   36   HD12  LEU   8          2HD1      LEU   8   4.037  16.902  17.262
   37   HD13  LEU   8          3HD1      LEU   8   4.607  17.521  18.812
   38   HD21  LEU   8          3HD2      LEU   8   2.472  16.357  21.025
   39   HD22  LEU   8          1HD2      LEU   8   4.119  16.846  20.626
   40   HD23  LEU   8          2HD2      LEU   8   3.702  15.134  20.705
   41    H    LYS   9           H        LYS   9  -0.038  13.899  17.106
   42    HA   LYS   9           HA       LYS   9   2.027  11.828  17.448
   43    HB2  LYS   9           1HB      LYS   9  -0.861  11.461  16.652
   44    HB3  LYS   9           2HB      LYS   9   0.368  10.228  16.401
   45    HG2  LYS   9           1HG      LYS   9   0.782  10.630  18.981
   46    HG3  LYS   9           2HG      LYS   9  -0.898  11.169  18.913
   47    HD2  LYS   9           1HD      LYS   9  -1.236   8.946  19.306
   48    HD3  LYS   9           2HD      LYS   9  -1.176   8.918  17.542
   49    HE2  LYS   9           1HE      LYS   9   1.365   8.539  17.886
   50    HE3  LYS   9           2HE      LYS   9   0.905   8.074  19.523
   51    HZ1  LYS   9           3HZ      LYS   9   0.858   6.489  17.265
   52    HZ2  LYS   9           1HZ      LYS   9  -0.766   6.801  17.623
   53    HZ3  LYS   9           2HZ      LYS   9   0.240   6.107  18.793
   54    H    CYS  10           H        CYS  10   3.377  12.882  15.967
   55    HA   CYS  10           HA       CYS  10   2.368  13.134  13.222
   56    HB2  CYS  10           1HB      CYS  10   4.726  14.337  14.657
   57    HB3  CYS  10           2HB      CYS  10   4.614  14.351  12.901
   58    HG   CYS  10           HG       CYS  10   2.339  15.906  12.780
   59    H    SER  11           H        SER  11   2.678  11.399  12.001
   60    HA   SER  11           HA       SER  11   5.309  10.269  11.715
   61    HB2  SER  11           1HB      SER  11   4.709   7.978  12.292
   62    HB3  SER  11           2HB      SER  11   4.434   9.030  13.681
   63    HG   SER  11           HG       SER  11   2.650   7.714  13.436
   64    H    THR  12           H        THR  12   5.207   8.370  10.104
   65    HA   THR  12           HA       THR  12   2.978   8.607   8.230
   66    HB   THR  12           HB       THR  12   4.604  10.263   7.442
   67    HG1  THR  12           HG1      THR  12   4.886   8.120   5.642
   68   HG21  THR  12          3HG2      THR  12   6.536   7.992   7.017
   69   HG22  THR  12          1HG2      THR  12   6.594   9.040   8.434
   70   HG23  THR  12          2HG2      THR  12   6.826   9.720   6.823
   71    H    VAL  13           H        VAL  13   2.407   6.686   7.433
   72    HA   VAL  13           HA       VAL  13   3.710   4.309   8.240
   73    HB   VAL  13           HB       VAL  13   1.269   4.499   7.722
   74   HG11  VAL  13          1HG1      VAL  13   0.720   5.428   5.771
   75   HG12  VAL  13          2HG1      VAL  13   2.344   5.199   5.120
   76   HG13  VAL  13          3HG1      VAL  13   1.161   3.893   5.024
   77   HG21  VAL  13          3HG2      VAL  13   1.999   2.309   7.986
   78   HG22  VAL  13          1HG2      VAL  13   1.231   2.278   6.399
   79   HG23  VAL  13          2HG2      VAL  13   2.988   2.357   6.527
   80    H    VAL  14           H        VAL  14   4.790   2.739   6.992
   81    HA   VAL  14           HA       VAL  14   5.975   3.760   4.493
   82    HB   VAL  14           HB       VAL  14   8.006   2.438   5.049
   83   HG11  VAL  14          1HG1      VAL  14   8.949   4.056   6.506
   84   HG12  VAL  14          2HG1      VAL  14   7.729   4.893   5.544
   85   HG13  VAL  14          3HG1      VAL  14   7.378   4.435   7.211
   86   HG21  VAL  14          3HG2      VAL  14   8.173   1.972   7.617
   87   HG22  VAL  14          1HG2      VAL  14   6.414   1.886   7.513
   88   HG23  VAL  14          2HG2      VAL  14   7.409   0.793   6.550
   89    H    CYS  15           H        CYS  15   6.733   2.072   3.002
   90    HA   CYS  15           HA       CYS  15   4.837   0.361   2.131
   91    HB2  CYS  15           1HB      CYS  15   7.120   0.915   1.090
   92    HB3  CYS  15           2HB      CYS  15   7.737  -0.446   2.020
   93    H    VAL  16           H        VAL  16   3.905  -1.467   2.781
   94    HA   VAL  16           HA       VAL  16   4.733  -2.693   5.252
   95    HB   VAL  16           HB       VAL  16   2.773  -4.125   4.993
   96   HG11  VAL  16          1HG1      VAL  16   1.335  -2.507   5.618
   97   HG12  VAL  16          2HG1      VAL  16   2.761  -1.473   5.509
   98   HG13  VAL  16          3HG1      VAL  16   1.620  -1.547   4.166
   99   HG21  VAL  16          3HG2      VAL  16   3.131  -3.592   2.248
  100   HG22  VAL  16          1HG2      VAL  16   1.921  -4.627   3.005
  101   HG23  VAL  16          2HG2      VAL  16   1.560  -2.929   2.697
  102    H    ILE  17           H        ILE  17   6.385  -2.900   2.717
  103    HA   ILE  17           HA       ILE  17   6.711  -5.824   2.799
  104    HB   ILE  17           HB       ILE  17   7.175  -4.187   0.312
  105   HG12  ILE  17          1HG1      ILE  17   4.770  -4.158   1.003
  106   HG13  ILE  17          2HG1      ILE  17   5.056  -4.959  -0.538
  107   HG21  ILE  17          1HG2      ILE  17   8.321  -6.068  -0.150
  108   HG22  ILE  17          2HG2      ILE  17   7.480  -7.008   1.081
  109   HG23  ILE  17          3HG2      ILE  17   6.721  -6.729  -0.486
  110   HD11  ILE  17          3HD1      ILE  17   5.201  -7.065   1.128
  111   HD12  ILE  17          1HD1      ILE  17   4.063  -6.041   2.004
  112   HD13  ILE  17          2HD1      ILE  17   3.717  -6.525   0.344
  113    H    CYS  18           H        CYS  18   8.314  -2.837   1.684
  114    HA   CYS  18           HA       CYS  18  10.876  -3.975   2.577
  115    HB2  CYS  18           1HB      CYS  18  11.941  -2.344   1.078
  116    HB3  CYS  18           2HB      CYS  18  10.808  -3.371   0.205
  117    H    LEU  19           H        LEU  19   8.509  -1.825   3.494
  118    HA   LEU  19           HA       LEU  19   8.362  -0.238   5.115
  119    HB2  LEU  19           1HB      LEU  19  10.937  -1.585   5.800
  120    HB3  LEU  19           2HB      LEU  19  10.456  -0.130   6.670
  121    HG   LEU  19           HG       LEU  19   8.242  -1.451   7.086
  122   HD11  LEU  19          1HD1      LEU  19   9.402  -3.314   5.530
  123   HD12  LEU  19          2HD1      LEU  19   8.211  -3.682   6.776
  124   HD13  LEU  19          3HD1      LEU  19   9.931  -3.865   7.120
  125   HD21  LEU  19          3HD2      LEU  19   9.054  -2.097   9.184
  126   HD22  LEU  19          1HD2      LEU  19  10.088  -0.749   8.710
  127   HD23  LEU  19          2HD2      LEU  19  10.676  -2.405   8.562
  128    H    GLU  20           H        GLU  20   9.195   0.590   2.575
  129    HA   GLU  20           HA       GLU  20  11.045   2.787   3.239
  130    HB2  GLU  20           1HB      GLU  20  10.602   1.397   0.593
  131    HB3  GLU  20           2HB      GLU  20  11.566   2.853   0.792
  132    HG2  GLU  20           1HG      GLU  20  12.225   0.502   2.478
  133    HG3  GLU  20           2HG      GLU  20  12.651   0.452   0.768
  134    H    LYS  21           H        LYS  21  10.713   4.668   1.583
  135    HA   LYS  21           HA       LYS  21   8.266   5.867   2.106
  136    HB2  LYS  21           1HB      LYS  21  10.026   7.300   1.500
  137    HB3  LYS  21           2HB      LYS  21  10.383   6.390   0.038
  138    HG2  LYS  21           1HG      LYS  21   7.954   7.144  -0.630
  139    HG3  LYS  21           2HG      LYS  21   8.275   8.423   0.544
  140    HD2  LYS  21           1HD      LYS  21  10.407   7.862  -1.432
  141    HD3  LYS  21           2HD      LYS  21   8.933   8.616  -2.046
  142    HE2  LYS  21           1HE      LYS  21  10.243  10.442  -1.482
  143    HE3  LYS  21           2HE      LYS  21   9.223  10.244  -0.058
  144    HZ1  LYS  21           3HZ      LYS  21  11.830  10.515   0.110
  145    HZ2  LYS  21           1HZ      LYS  21  11.779   8.835  -0.079
  146    HZ3  LYS  21           2HZ      LYS  21  10.958   9.566   1.206
  147    HA   PRO  22           HA       PRO  22   5.800   3.437  -0.767
  148    HB2  PRO  22           1HB      PRO  22   3.416   4.354   0.152
  149    HB3  PRO  22           2HB      PRO  22   4.339   3.088   0.972
  150    HG2  PRO  22           1HG      PRO  22   4.172   6.013   1.590
  151    HG3  PRO  22           2HG      PRO  22   4.142   4.631   2.701
  152    HD2  PRO  22           1HD      PRO  22   6.367   6.116   2.282
  153    HD3  PRO  22           2HD      PRO  22   6.433   4.381   2.651
  154    H    LYS  23           H        LYS  23   6.567   4.691  -2.575
  155    HA   LYS  23           HA       LYS  23   5.914   7.254  -3.281
  156    HB2  LYS  23           1HB      LYS  23   7.421   5.898  -4.614
  157    HB3  LYS  23           2HB      LYS  23   6.105   4.824  -5.070
  158    HG2  LYS  23           1HG      LYS  23   6.535   6.250  -6.914
  159    HG3  LYS  23           2HG      LYS  23   5.012   6.773  -6.191
  160    HD2  LYS  23           1HD      LYS  23   6.098   8.786  -6.522
  161    HD3  LYS  23           2HD      LYS  23   6.528   8.414  -4.851
  162    HE2  LYS  23           1HE      LYS  23   8.627   7.342  -5.774
  163    HE3  LYS  23           2HE      LYS  23   8.211   8.073  -7.323
  164    HZ1  LYS  23           3HZ      LYS  23   9.238   9.311  -4.909
  165    HZ2  LYS  23           1HZ      LYS  23   8.025  10.180  -5.707
  166    HZ3  LYS  23           2HZ      LYS  23   9.442   9.758  -6.528
  167    H    TYR  24           H        TYR  24   3.936   4.349  -3.670
  168    HA   TYR  24           HA       TYR  24   1.605   6.084  -4.084
  169    HB2  TYR  24           1HB      TYR  24   1.829   3.492  -5.579
  170    HB3  TYR  24           2HB      TYR  24   0.810   4.885  -5.922
  171    HD1  TYR  24           HD2      TYR  24   1.720   6.839  -7.073
  172    HD2  TYR  24           HD1      TYR  24   4.130   3.414  -6.321
  173    HE1  TYR  24           HE2      TYR  24   3.376   7.654  -8.699
  174    HE2  TYR  24           HE1      TYR  24   5.793   4.220  -7.944
  175    HH   TYR  24           HH       TYR  24   5.272   7.219  -9.772
  176    H    ARG  25           H        ARG  25  -0.466   4.636  -3.956
  177    HA   ARG  25           HA       ARG  25  -0.141   2.580  -1.886
  178    HB2  ARG  25           1HB      ARG  25  -1.873   5.035  -1.752
  179    HB3  ARG  25           2HB      ARG  25  -2.271   3.588  -0.836
  180    HG2  ARG  25           1HG      ARG  25  -0.224   3.719   0.391
  181    HG3  ARG  25           2HG      ARG  25   0.360   5.031  -0.635
  182    HD2  ARG  25           1HD      ARG  25  -2.055   5.159   1.167
  183    HD3  ARG  25           2HD      ARG  25  -0.470   5.836   1.537
  184    HE   ARG  25           HE       ARG  25  -1.074   7.020  -0.801
  185   HH11  ARG  25          2HH1      ARG  25  -2.856   6.630   2.164
  186   HH12  ARG  25          1HH1      ARG  25  -3.744   8.106   1.977
  187   HH21  ARG  25          2HH2      ARG  25  -2.236   8.966  -1.058
  188   HH22  ARG  25          1HH2      ARG  25  -3.391   9.434   0.144
  189    H    CYS  26           H        CYS  26  -2.128   1.267  -1.591
  190    HA   CYS  26           HA       CYS  26  -3.105   0.390  -4.115
  191    HB2  CYS  26           1HB      CYS  26  -2.742  -1.145  -2.219
  192    HB3  CYS  26           2HB      CYS  26  -4.038  -0.348  -1.333
  193    HA   PRO  27           HA       PRO  27  -6.544   3.161  -4.467
  194    HB2  PRO  27           1HB      PRO  27  -7.753   1.915  -6.554
  195    HB3  PRO  27           2HB      PRO  27  -6.303   2.909  -6.738
  196    HG2  PRO  27           1HG      PRO  27  -6.549  -0.069  -6.567
  197    HG3  PRO  27           2HG      PRO  27  -5.542   0.910  -7.650
  198    HD2  PRO  27           1HD      PRO  27  -4.555  -0.291  -5.432
  199    HD3  PRO  27           2HD      PRO  27  -3.926   1.253  -6.042
  200    H    ALA  28           H        ALA  28  -6.570   0.263  -3.038
  201    HA   ALA  28           HA       ALA  28  -9.508   0.209  -2.790
  202    HB1  ALA  28           3HB      ALA  28  -7.600  -1.941  -3.309
  203    HB2  ALA  28           1HB      ALA  28  -8.719  -2.285  -1.989
  204    HB3  ALA  28           2HB      ALA  28  -9.340  -1.874  -3.589
  205    H    CYS  29           H        CYS  29  -6.879  -1.352  -0.976
  206    HA   CYS  29           HA       CYS  29  -8.132  -0.638   1.522
  207    HB2  CYS  29           1HB      CYS  29  -6.179  -1.862   2.520
  208    HB3  CYS  29           2HB      CYS  29  -7.136  -2.817   1.392
  209    H    ARG  30           H        ARG  30  -5.636   0.611  -0.496
  210    HA   ARG  30           HA       ARG  30  -4.475   2.576  -0.374
  211    HB2  ARG  30           1HB      ARG  30  -5.606   3.033   2.380
  212    HB3  ARG  30           2HB      ARG  30  -5.017   4.228   1.233
  213    HG2  ARG  30           1HG      ARG  30  -7.392   2.524   0.592
  214    HG3  ARG  30           2HG      ARG  30  -7.550   3.983   1.573
  215    HD2  ARG  30           1HD      ARG  30  -6.129   4.062  -1.061
  216    HD3  ARG  30           2HD      ARG  30  -7.890   4.131  -0.992
  217    HE   ARG  30           HE       ARG  30  -6.582   6.029   0.728
  218   HH11  ARG  30          2HH1      ARG  30  -7.784   5.418  -2.481
  219   HH12  ARG  30          1HH1      ARG  30  -7.983   7.095  -2.867
  220   HH21  ARG  30          2HH2      ARG  30  -6.839   8.241   0.232
  221   HH22  ARG  30          1HH2      ARG  30  -7.444   8.700  -1.323
  222    H    VAL  31           H        VAL  31  -3.167   0.287   0.170
  223    HA   VAL  31           HA       VAL  31  -1.679   0.618   2.655
  224    HB   VAL  31           HB       VAL  31  -0.540  -1.486   1.993
  225   HG11  VAL  31          1HG1      VAL  31  -3.479  -1.256   2.338
  226   HG12  VAL  31          2HG1      VAL  31  -2.820  -2.842   1.933
  227   HG13  VAL  31          3HG1      VAL  31  -2.270  -2.001   3.383
  228   HG21  VAL  31          3HG2      VAL  31  -2.524  -1.885  -0.190
  229   HG22  VAL  31          1HG2      VAL  31  -1.081  -0.928  -0.524
  230   HG23  VAL  31          2HG2      VAL  31  -0.924  -2.596   0.026
  231    HA   PRO  32           HA       PRO  32   1.722   2.734   0.838
  232    HB2  PRO  32           1HB      PRO  32   3.698   1.957   2.529
  233    HB3  PRO  32           2HB      PRO  32   2.445   3.116   2.986
  234    HG2  PRO  32           1HG      PRO  32   2.626   0.189   3.585
  235    HG3  PRO  32           2HG      PRO  32   2.149   1.522   4.652
  236    HD2  PRO  32           1HD      PRO  32   0.344  -0.103   3.455
  237    HD3  PRO  32           2HD      PRO  32   0.009   1.606   3.799
  238    H    TYR  33           H        TYR  33   2.633   2.162  -1.027
  239    HA   TYR  33           HA       TYR  33   4.405  -0.148  -1.108
  240    HB2  TYR  33           1HB      TYR  33   3.278  -1.368  -2.664
  241    HB3  TYR  33           2HB      TYR  33   1.884  -0.566  -1.948
  242    HD1  TYR  33           HD2      TYR  33   4.412  -0.020  -4.648
  243    HD2  TYR  33           HD1      TYR  33   0.387   0.479  -3.362
  244    HE1  TYR  33           HE2      TYR  33   3.833   0.921  -6.845
  245    HE2  TYR  33           HE1      TYR  33  -0.204   1.420  -5.556
  246    HH   TYR  33           HH       TYR  33   1.886   2.602  -7.673
  247    H    CYS  34           H        CYS  34   6.244   0.458  -2.018
  248    HA   CYS  34           HA       CYS  34   6.532   2.969  -3.324
  249    HB2  CYS  34           1HB      CYS  34   8.884   2.108  -3.774
  250    HB3  CYS  34           2HB      CYS  34   8.402   2.205  -2.084
  251    H    SER  35           H        SER  35   7.102  -0.343  -4.525
  252    HA   SER  35           HA       SER  35   6.438   0.635  -7.225
  253    HB2  SER  35           1HB      SER  35   7.869  -1.386  -7.962
  254    HB3  SER  35           2HB      SER  35   8.709   0.033  -7.336
  255    HG   SER  35           HG       SER  35   9.549  -1.780  -6.340
  256    H    VAL  36           H        VAL  36   5.624  -1.122  -8.696
  257    HA   VAL  36           HA       VAL  36   3.261  -2.215  -7.721
  258    HB   VAL  36           HB       VAL  36   4.854  -3.131 -10.120
  259   HG11  VAL  36          1HG1      VAL  36   1.891  -3.413  -9.735
  260   HG12  VAL  36          2HG1      VAL  36   2.936  -4.217 -10.909
  261   HG13  VAL  36          3HG1      VAL  36   3.018  -4.660  -9.203
  262   HG21  VAL  36          3HG2      VAL  36   3.776  -1.520 -11.390
  263   HG22  VAL  36          1HG2      VAL  36   2.483  -1.309 -10.210
  264   HG23  VAL  36          2HG2      VAL  36   4.091  -0.661  -9.883
  265    H    VAL  37           H        VAL  37   6.490  -3.555  -7.843
  266    HA   VAL  37           HA       VAL  37   5.966  -6.257  -7.500
  267    HB   VAL  37           HB       VAL  37   8.234  -4.655  -6.308
  268   HG11  VAL  37          1HG1      VAL  37   9.010  -6.526  -5.401
  269   HG12  VAL  37          2HG1      VAL  37   7.508  -7.333  -5.856
  270   HG13  VAL  37          3HG1      VAL  37   8.895  -7.368  -6.946
  271   HG21  VAL  37          3HG2      VAL  37   8.052  -6.194  -8.897
  272   HG22  VAL  37          1HG2      VAL  37   8.086  -4.439  -8.733
  273   HG23  VAL  37          2HG2      VAL  37   9.495  -5.395  -8.272
  274    H    CYS  38           H        CYS  38   6.549  -3.825  -4.956
  275    HA   CYS  38           HA       CYS  38   6.065  -5.524  -2.781
  276    HB2  CYS  38           1HB      CYS  38   5.936  -2.537  -3.122
  277    HB3  CYS  38           2HB      CYS  38   5.536  -3.298  -1.585
  278    H    PHE  39           H        PHE  39   3.908  -3.890  -4.939
  279    HA   PHE  39           HA       PHE  39   1.602  -4.116  -3.227
  280    HB2  PHE  39           1HB      PHE  39   1.537  -2.290  -4.730
  281    HB3  PHE  39           2HB      PHE  39   1.996  -3.297  -6.099
  282    HD1  PHE  39           HD1      PHE  39  -0.723  -2.999  -3.565
  283    HD2  PHE  39           HD2      PHE  39   0.358  -3.942  -7.572
  284    HE1  PHE  39           HE1      PHE  39  -3.099  -3.303  -4.131
  285    HE2  PHE  39           HE2      PHE  39  -2.016  -4.246  -8.145
  286    HZ   PHE  39           HZ       PHE  39  -3.748  -3.926  -6.423
  287    H    ARG  40           H        ARG  40   3.013  -5.903  -5.904
  288    HA   ARG  40           HA       ARG  40   0.916  -7.574  -6.584
  289    HB2  ARG  40           1HB      ARG  40   3.884  -8.123  -6.500
  290    HB3  ARG  40           2HB      ARG  40   2.715  -9.228  -7.211
  291    HG2  ARG  40           1HG      ARG  40   2.013  -7.122  -8.593
  292    HG3  ARG  40           2HG      ARG  40   3.631  -6.562  -8.167
  293    HD2  ARG  40           1HD      ARG  40   2.917  -9.112  -9.609
  294    HD3  ARG  40           2HD      ARG  40   3.699  -7.691 -10.300
  295    HE   ARG  40           HE       ARG  40   5.104  -8.926  -8.093
  296   HH11  ARG  40          2HH1      ARG  40   4.687  -8.737 -11.544
  297   HH12  ARG  40          1HH1      ARG  40   6.255  -9.384 -11.900
  298   HH21  ARG  40          2HH2      ARG  40   7.170  -9.779  -8.549
  299   HH22  ARG  40          1HH2      ARG  40   7.666  -9.978 -10.196
  300    H    LYS  41           H        LYS  41   3.580  -8.480  -4.388
  301    HA   LYS  41           HA       LYS  41   2.521 -10.817  -3.404
  302    HB2  LYS  41           1HB      LYS  41   4.117  -8.802  -1.811
  303    HB3  LYS  41           2HB      LYS  41   3.960 -10.518  -1.459
  304    HG2  LYS  41           1HG      LYS  41   5.306 -11.138  -3.243
  305    HG3  LYS  41           2HG      LYS  41   5.081  -9.598  -4.075
  306    HD2  LYS  41           1HD      LYS  41   6.450  -8.463  -2.455
  307    HD3  LYS  41           2HD      LYS  41   6.557  -9.920  -1.464
  308    HE2  LYS  41           1HE      LYS  41   8.600  -9.635  -2.726
  309    HE3  LYS  41           2HE      LYS  41   7.733 -11.055  -3.308
  310    HZ1  LYS  41           3HZ      LYS  41   8.611  -8.884  -4.793
  311    HZ2  LYS  41           1HZ      LYS  41   6.923  -8.779  -4.765
  312    HZ3  LYS  41           2HZ      LYS  41   7.673 -10.186  -5.328
  313    H    HIS  42           H        HIS  42   1.557  -7.567  -2.717
  314    HA   HIS  42           HA       HIS  42   0.107  -8.213  -0.314
  315    HB2  HIS  42           1HB      HIS  42   0.663  -6.005  -0.191
  316    HB3  HIS  42           2HB      HIS  42   0.604  -5.783  -1.937
  317    HD1  HIS  42           HD1      HIS  42  -1.667  -5.920   1.074
  318    HD2  HIS  42           HD2      HIS  42  -1.742  -4.726  -2.905
  319    HE1  HIS  42           HE1      HIS  42  -3.843  -4.695   0.781
  320    H    LYS  43           H        LYS  43  -0.764  -7.391  -3.662
  321    HA   LYS  43           HA       LYS  43  -3.490  -7.430  -3.536
  322    HB2  LYS  43           1HB      LYS  43  -2.309  -6.931  -5.594
  323    HB3  LYS  43           2HB      LYS  43  -1.724  -8.586  -5.700
  324    HG2  LYS  43           1HG      LYS  43  -3.455  -8.729  -7.152
  325    HG3  LYS  43           2HG      LYS  43  -4.323  -9.108  -5.663
  326    HD2  LYS  43           1HD      LYS  43  -5.704  -7.497  -6.506
  327    HD3  LYS  43           2HD      LYS  43  -4.598  -6.476  -5.584
  328    HE2  LYS  43           1HE      LYS  43  -3.584  -5.649  -7.456
  329    HE3  LYS  43           2HE      LYS  43  -3.892  -7.106  -8.400
  330    HZ1  LYS  43           3HZ      LYS  43  -5.844  -4.980  -7.712
  331    HZ2  LYS  43           1HZ      LYS  43  -6.265  -6.444  -8.448
  332    HZ3  LYS  43           2HZ      LYS  43  -5.245  -5.358  -9.248
  333    H    GLU  44           H        GLU  44  -1.310 -10.172  -3.424
  334    HA   GLU  44           HA       GLU  44  -3.054 -12.265  -3.914
  335    HB2  GLU  44           1HB      GLU  44  -1.417 -13.641  -3.102
  336    HB3  GLU  44           2HB      GLU  44  -0.471 -12.177  -3.327
  337    HG2  GLU  44           1HG      GLU  44  -0.699 -11.635  -0.977
  338    HG3  GLU  44           2HG      GLU  44  -1.716 -13.054  -0.731
  339    H    GLN  45           H        GLN  45  -2.605 -10.366  -0.991
  340    HA   GLN  45           HA       GLN  45  -4.981 -11.678   0.142
  341    HB2  GLN  45           1HB      GLN  45  -3.990 -11.491   2.382
  342    HB3  GLN  45           2HB      GLN  45  -3.023 -12.514   1.328
  343    HG2  GLN  45           1HG      GLN  45  -1.430 -11.242   2.400
  344    HG3  GLN  45           2HG      GLN  45  -1.657 -10.373   0.883
  345   HE21  GLN  45          1HE2      GLN  45  -2.085  -8.281   0.986
  346   HE22  GLN  45          2HE2      GLN  45  -2.576  -7.420   2.401
  347    H    CYS  46           H        CYS  46  -4.501  -9.138  -1.363
  348    HA   CYS  46           HA       CYS  46  -4.624  -6.907   0.312
  349    HB2  CYS  46           1HB      CYS  46  -4.240  -6.450  -1.956
  350    HB3  CYS  46           2HB      CYS  46  -5.598  -7.440  -2.481
  351    H    ASN  47           H        ASN  47  -6.042  -6.554   1.882
  352    HA   ASN  47           HA       ASN  47  -8.863  -7.261   1.408
  353    HB2  ASN  47           1HB      ASN  47  -7.176  -7.444   3.888
  354    HB3  ASN  47           2HB      ASN  47  -8.927  -7.290   4.007
  355   HD21  ASN  47          1HD2      ASN  47  -7.621  -9.483   4.998
  356   HD22  ASN  47          2HD2      ASN  47  -8.017 -10.871   4.048
  357    HA   PRO  48           HA       PRO  48  -9.118  -2.765   1.682
  358    HB2  PRO  48           1HB      PRO  48 -11.639  -2.631   0.684
  359    HB3  PRO  48           2HB      PRO  48 -10.210  -2.814  -0.339
  360    HG2  PRO  48           1HG      PRO  48 -12.141  -4.897   0.605
  361    HG3  PRO  48           2HG      PRO  48 -11.424  -4.683  -1.002
  362    HD2  PRO  48           1HD      PRO  48 -10.507  -6.513   0.771
  363    HD3  PRO  48           2HD      PRO  48  -9.444  -5.693  -0.391
  364    H    GLU  49           H        GLU  49 -11.239  -1.414   2.386
  365    HA   GLU  49           HA       GLU  49 -11.992  -2.527   5.000
  366    HB2  GLU  49           1HB      GLU  49 -12.571  -0.087   5.500
  367    HB3  GLU  49           2HB      GLU  49 -10.868  -0.491   5.343
  368    HG2  GLU  49           1HG      GLU  49 -12.443   0.562   3.025
  369    HG3  GLU  49           2HG      GLU  49 -11.715   1.638   4.215
  370    H    THR  50           H        THR  50 -13.920  -3.478   4.945
  371    HA   THR  50           HA       THR  50 -16.055  -2.262   3.326
  372    HB   THR  50           HB       THR  50 -17.215  -4.479   3.609
  373    HG1  THR  50           HG1      THR  50 -16.229  -5.465   5.288
  374   HG21  THR  50          3HG2      THR  50 -16.382  -4.935   1.594
  375   HG22  THR  50          1HG2      THR  50 -14.845  -5.427   2.303
  376   HG23  THR  50          2HG2      THR  50 -15.119  -3.738   1.878
  377    H    SER  51           H        SER  51 -15.427  -3.752   6.490
  378    HA   SER  51           HA       SER  51 -17.985  -2.945   7.535
  379    HB2  SER  51           1HB      SER  51 -15.568  -4.314   8.681
  380    HB3  SER  51           2HB      SER  51 -16.838  -3.712   9.747
  381    HG   SER  51           HG       SER  51 -17.519  -5.706   9.292
  382    H    GLY  52           H        GLY  52 -18.479  -1.106   8.554
  383    HA2  GLY  52           1HA      GLY  52 -17.246   0.414  10.338
  384    HA3  GLY  52           2HA      GLY  52 -16.373   0.887   8.887
  385    HA   PRO  53           HA       PRO  53 -19.428   3.979   8.242
  386    HB2  PRO  53           1HB      PRO  53 -19.029   4.431   5.595
  387    HB3  PRO  53           2HB      PRO  53 -17.905   4.980   6.844
  388    HG2  PRO  53           1HG      PRO  53 -17.744   2.568   5.078
  389    HG3  PRO  53           2HG      PRO  53 -16.465   3.709   5.531
  390    HD2  PRO  53           1HD      PRO  53 -16.743   1.288   6.711
  391    HD3  PRO  53           2HD      PRO  53 -16.124   2.708   7.579
  392    H    SER  54           H        SER  54 -21.546   3.602   8.176
  393    HA   SER  54           HA       SER  54 -22.640   2.074   5.917
  394    HB2  SER  54           1HB      SER  54 -22.469   0.831   8.232
  395    HB3  SER  54           2HB      SER  54 -23.893   1.794   8.624
  396    HG   SER  54           HG       SER  54 -24.165  -0.386   7.587
  397    H    SER  55           H        SER  55 -23.610   4.029   8.738
  398    HA   SER  55           HA       SER  55 -25.922   5.047   7.350
  399    HB2  SER  55           1HB      SER  55 -26.304   6.348   9.411
  400    HB3  SER  55           2HB      SER  55 -26.020   4.645   9.766
  401    HG   SER  55           HG       SER  55 -23.853   5.203  10.271
  402    H    GLY  56           H        GLY  56 -23.756   5.658   5.829
  403    HA2  GLY  56           1HA      GLY  56 -23.232   7.571   4.577
  404    HA3  GLY  56           2HA      GLY  56 -23.828   8.570   5.895
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1   3.320  31.624  33.529
    2    HA2  GLY   1           1HA      GLY   1   3.494  32.250  30.674
    3    HA3  GLY   1           2HA      GLY   1   4.089  30.683  31.200
    4    H    SER   2           H        SER   2   1.532  32.138  29.831
    5    HA   SER   2           HA       SER   2  -0.460  30.409  31.127
    6    HB2  SER   2           1HB      SER   2  -1.095  32.757  31.054
    7    HB3  SER   2           2HB      SER   2  -0.821  32.807  29.313
    8    HG   SER   2           HG       SER   2  -2.762  32.073  29.057
    9    H    SER   3           H        SER   3  -2.012  29.298  29.747
   10    HA   SER   3           HA       SER   3  -0.779  27.731  27.784
   11    HB2  SER   3           1HB      SER   3  -2.770  27.016  29.064
   12    HB3  SER   3           2HB      SER   3  -3.743  28.200  28.192
   13    HG   SER   3           HG       SER   3  -2.248  26.243  26.817
   14    H    GLY   4           H        GLY   4  -0.758  27.774  25.573
   15    HA2  GLY   4           1HA      GLY   4  -2.219  29.886  24.178
   16    HA3  GLY   4           2HA      GLY   4  -0.465  29.933  24.082
   17    H    SER   5           H        SER   5   0.590  28.589  22.699
   18    HA   SER   5           HA       SER   5  -0.775  27.545  20.503
   19    HB2  SER   5           1HB      SER   5   1.999  26.957  21.553
   20    HB3  SER   5           2HB      SER   5   1.401  26.369  20.001
   21    HG   SER   5           HG       SER   5   2.247  28.876  20.724
   22    H    SER   6           H        SER   6  -0.879  25.302  19.770
   23    HA   SER   6           HA       SER   6  -0.585  23.110  21.522
   24    HB2  SER   6           1HB      SER   6  -3.036  22.597  21.806
   25    HB3  SER   6           2HB      SER   6  -2.467  23.983  22.735
   26    HG   SER   6           HG       SER   6  -3.200  25.146  20.661
   27    H    GLY   7           H        GLY   7   0.068  21.719  20.013
   28    HA2  GLY   7           1HA      GLY   7  -1.734  20.689  18.079
   29    HA3  GLY   7           2HA      GLY   7  -0.572  21.759  17.308
   30    H    LEU   8           H        LEU   8  -0.989  18.765  19.075
   31    HA   LEU   8           HA       LEU   8   1.667  17.918  18.123
   32    HB2  LEU   8           1HB      LEU   8   1.615  18.266  20.567
   33    HB3  LEU   8           2HB      LEU   8   0.318  17.079  20.685
   34    HG   LEU   8           HG       LEU   8   2.071  15.492  19.560
   35   HD11  LEU   8          1HD1      LEU   8   4.299  16.002  19.787
   36   HD12  LEU   8          2HD1      LEU   8   4.010  17.200  21.048
   37   HD13  LEU   8          3HD1      LEU   8   3.629  17.579  19.368
   38   HD21  LEU   8          3HD2      LEU   8   1.953  16.368  22.427
   39   HD22  LEU   8          1HD2      LEU   8   3.005  15.051  21.906
   40   HD23  LEU   8          2HD2      LEU   8   1.260  14.930  21.676
   41    H    LYS   9           H        LYS   9   0.582  17.096  16.244
   42    HA   LYS   9           HA       LYS   9  -0.464  14.412  16.691
   43    HB2  LYS   9           1HB      LYS   9  -2.374  14.725  15.235
   44    HB3  LYS   9           2HB      LYS   9  -2.448  15.885  16.555
   45    HG2  LYS   9           1HG      LYS   9  -1.715  17.658  15.126
   46    HG3  LYS   9           2HG      LYS   9  -1.395  16.526  13.809
   47    HD2  LYS   9           1HD      LYS   9  -4.136  16.731  14.995
   48    HD3  LYS   9           2HD      LYS   9  -3.593  17.909  13.798
   49    HE2  LYS   9           1HE      LYS   9  -4.669  16.262  12.537
   50    HE3  LYS   9           2HE      LYS   9  -2.956  15.885  12.369
   51    HZ1  LYS   9           3HZ      LYS   9  -4.729  14.055  12.982
   52    HZ2  LYS   9           1HZ      LYS   9  -4.412  14.602  14.552
   53    HZ3  LYS   9           2HZ      LYS   9  -3.153  14.003  13.594
   54    H    CYS  10           H        CYS  10   0.286  12.986  15.237
   55    HA   CYS  10           HA       CYS  10   1.035  13.773  12.572
   56    HB2  CYS  10           1HB      CYS  10   3.384  13.150  12.739
   57    HB3  CYS  10           2HB      CYS  10   3.026  14.454  13.863
   58    HG   CYS  10           HG       CYS  10   4.800  12.127  14.671
   59    H    SER  11           H        SER  11   1.244  12.034  11.172
   60    HA   SER  11           HA       SER  11   1.179   9.331  12.243
   61    HB2  SER  11           1HB      SER  11  -1.189   9.931  12.195
   62    HB3  SER  11           2HB      SER  11  -1.048  10.429  10.509
   63    HG   SER  11           HG       SER  11  -0.216   8.104  10.304
   64    H    THR  12           H        THR  12   2.692   8.302  11.135
   65    HA   THR  12           HA       THR  12   2.867   8.755   8.230
   66    HB   THR  12           HB       THR  12   5.243   8.265  10.033
   67    HG1  THR  12           HG1      THR  12   4.132  10.405  10.168
   68   HG21  THR  12          3HG2      THR  12   5.390   7.481   7.655
   69   HG22  THR  12          1HG2      THR  12   6.580   8.704   8.096
   70   HG23  THR  12          2HG2      THR  12   5.161   9.155   7.151
   71    H    VAL  13           H        VAL  13   3.128   6.970   6.966
   72    HA   VAL  13           HA       VAL  13   3.424   4.376   8.330
   73    HB   VAL  13           HB       VAL  13   1.051   4.831   7.638
   74   HG11  VAL  13          1HG1      VAL  13   1.266   4.167   4.894
   75   HG12  VAL  13          2HG1      VAL  13   0.626   5.644   5.617
   76   HG13  VAL  13          3HG1      VAL  13   2.336   5.536   5.197
   77   HG21  VAL  13          3HG2      VAL  13   1.651   2.574   7.987
   78   HG22  VAL  13          1HG2      VAL  13   0.810   2.609   6.437
   79   HG23  VAL  13          2HG2      VAL  13   2.570   2.504   6.484
   80    H    VAL  14           H        VAL  14   4.375   2.696   7.088
   81    HA   VAL  14           HA       VAL  14   5.784   3.599   4.663
   82    HB   VAL  14           HB       VAL  14   7.733   2.245   5.341
   83   HG11  VAL  14          1HG1      VAL  14   8.440   4.252   5.991
   84   HG12  VAL  14          2HG1      VAL  14   6.835   4.700   6.572
   85   HG13  VAL  14          3HG1      VAL  14   7.942   3.818   7.626
   86   HG21  VAL  14          3HG2      VAL  14   6.864   0.614   6.787
   87   HG22  VAL  14          1HG2      VAL  14   7.834   1.658   7.826
   88   HG23  VAL  14          2HG2      VAL  14   6.078   1.816   7.811
   89    H    CYS  15           H        CYS  15   6.372   1.919   3.173
   90    HA   CYS  15           HA       CYS  15   4.479   0.250   2.311
   91    HB2  CYS  15           1HB      CYS  15   6.785   0.632   1.306
   92    HB3  CYS  15           2HB      CYS  15   7.355  -0.663   2.354
   93    H    VAL  16           H        VAL  16   3.424  -1.510   2.964
   94    HA   VAL  16           HA       VAL  16   4.072  -2.700   5.506
   95    HB   VAL  16           HB       VAL  16   2.051  -4.050   5.176
   96   HG11  VAL  16          1HG1      VAL  16   1.061  -1.423   4.309
   97   HG12  VAL  16          2HG1      VAL  16   0.699  -2.351   5.766
   98   HG13  VAL  16          3HG1      VAL  16   2.175  -1.390   5.675
   99   HG21  VAL  16          3HG2      VAL  16   2.015  -4.538   2.881
  100   HG22  VAL  16          1HG2      VAL  16   0.641  -3.460   3.129
  101   HG23  VAL  16          2HG2      VAL  16   2.135  -2.838   2.429
  102    H    ILE  17           H        ILE  17   5.745  -3.080   2.955
  103    HA   ILE  17           HA       ILE  17   5.940  -6.010   3.180
  104    HB   ILE  17           HB       ILE  17   6.579  -4.512   0.648
  105   HG12  ILE  17          1HG1      ILE  17   4.153  -4.283   1.310
  106   HG13  ILE  17          2HG1      ILE  17   4.431  -5.080  -0.234
  107   HG21  ILE  17          1HG2      ILE  17   5.913  -7.056  -0.034
  108   HG22  ILE  17          2HG2      ILE  17   7.557  -6.495   0.264
  109   HG23  ILE  17          3HG2      ILE  17   6.656  -7.302   1.546
  110   HD11  ILE  17          3HD1      ILE  17   3.581  -6.288   2.370
  111   HD12  ILE  17          1HD1      ILE  17   2.770  -6.341   0.805
  112   HD13  ILE  17          2HD1      ILE  17   4.249  -7.266   1.063
  113    H    CYS  18           H        CYS  18   7.732  -3.172   1.962
  114    HA   CYS  18           HA       CYS  18  10.200  -4.388   3.003
  115    HB2  CYS  18           1HB      CYS  18  11.416  -3.037   1.415
  116    HB3  CYS  18           2HB      CYS  18  10.127  -3.881   0.562
  117    H    LEU  19           H        LEU  19   7.947  -1.968   3.601
  118    HA   LEU  19           HA       LEU  19   7.847  -0.242   5.078
  119    HB2  LEU  19           1HB      LEU  19  10.254  -1.709   6.113
  120    HB3  LEU  19           2HB      LEU  19   9.658  -0.239   6.882
  121    HG   LEU  19           HG       LEU  19   7.473  -1.399   7.234
  122   HD11  LEU  19          1HD1      LEU  19   7.071  -3.289   6.148
  123   HD12  LEU  19          2HD1      LEU  19   8.309  -4.076   7.126
  124   HD13  LEU  19          3HD1      LEU  19   8.736  -3.361   5.571
  125   HD21  LEU  19          3HD2      LEU  19   8.260  -2.754   9.107
  126   HD22  LEU  19          1HD2      LEU  19   9.137  -1.226   9.013
  127   HD23  LEU  19          2HD2      LEU  19   9.899  -2.716   8.454
  128    H    GLU  20           H        GLU  20   8.746   0.537   2.694
  129    HA   GLU  20           HA       GLU  20  10.901   2.436   3.348
  130    HB2  GLU  20           1HB      GLU  20  10.426   0.960   0.758
  131    HB3  GLU  20           2HB      GLU  20  11.503   2.342   0.900
  132    HG2  GLU  20           1HG      GLU  20  11.928   0.110   2.791
  133    HG3  GLU  20           2HG      GLU  20  12.340  -0.174   1.100
  134    H    LYS  21           H        LYS  21  10.850   4.432   2.052
  135    HA   LYS  21           HA       LYS  21   8.545   5.855   2.261
  136    HB2  LYS  21           1HB      LYS  21  10.870   6.126   0.384
  137    HB3  LYS  21           2HB      LYS  21   9.510   7.236   0.273
  138    HG2  LYS  21           1HG      LYS  21   9.968   8.220   2.292
  139    HG3  LYS  21           2HG      LYS  21  10.799   6.794   2.921
  140    HD2  LYS  21           1HD      LYS  21  12.589   7.260   1.173
  141    HD3  LYS  21           2HD      LYS  21  11.814   8.831   0.952
  142    HE2  LYS  21           1HE      LYS  21  12.052   9.094   3.487
  143    HE3  LYS  21           2HE      LYS  21  13.166   7.730   3.399
  144    HZ1  LYS  21           3HZ      LYS  21  13.722  10.406   2.918
  145    HZ2  LYS  21           1HZ      LYS  21  13.831   9.625   1.422
  146    HZ3  LYS  21           2HZ      LYS  21  14.762   9.086   2.726
  147    HA   PRO  22           HA       PRO  22   6.094   3.643  -0.829
  148    HB2  PRO  22           1HB      PRO  22   3.715   4.598   0.067
  149    HB3  PRO  22           2HB      PRO  22   4.552   3.239   0.826
  150    HG2  PRO  22           1HG      PRO  22   4.482   6.117   1.645
  151    HG3  PRO  22           2HG      PRO  22   4.352   4.664   2.653
  152    HD2  PRO  22           1HD      PRO  22   6.651   6.076   2.422
  153    HD3  PRO  22           2HD      PRO  22   6.631   4.318   2.668
  154    H    LYS  23           H        LYS  23   6.131   4.485  -2.814
  155    HA   LYS  23           HA       LYS  23   5.866   7.307  -3.287
  156    HB2  LYS  23           1HB      LYS  23   6.047   4.981  -5.211
  157    HB3  LYS  23           2HB      LYS  23   6.105   6.676  -5.676
  158    HG2  LYS  23           1HG      LYS  23   8.141   6.954  -4.324
  159    HG3  LYS  23           2HG      LYS  23   8.095   5.233  -3.936
  160    HD2  LYS  23           1HD      LYS  23   8.014   6.033  -6.800
  161    HD3  LYS  23           2HD      LYS  23   9.549   6.171  -5.939
  162    HE2  LYS  23           1HE      LYS  23   9.375   3.811  -5.283
  163    HE3  LYS  23           2HE      LYS  23   7.857   3.683  -6.170
  164    HZ1  LYS  23           3HZ      LYS  23   9.277   4.506  -8.142
  165    HZ2  LYS  23           1HZ      LYS  23   9.391   2.885  -7.670
  166    HZ3  LYS  23           2HZ      LYS  23  10.592   3.985  -7.215
  167    H    TYR  24           H        TYR  24   3.815   4.490  -3.514
  168    HA   TYR  24           HA       TYR  24   1.528   6.236  -4.007
  169    HB2  TYR  24           1HB      TYR  24   1.634   3.691  -5.567
  170    HB3  TYR  24           2HB      TYR  24   0.770   5.184  -5.917
  171    HD1  TYR  24           HD1      TYR  24   4.188   3.716  -5.814
  172    HD2  TYR  24           HD2      TYR  24   1.660   6.736  -7.424
  173    HE1  TYR  24           HE1      TYR  24   5.977   4.378  -7.365
  174    HE2  TYR  24           HE2      TYR  24   3.442   7.406  -8.980
  175    HH   TYR  24           HH       TYR  24   6.645   5.906  -8.862
  176    H    ARG  25           H        ARG  25  -0.559   4.818  -3.917
  177    HA   ARG  25           HA       ARG  25  -0.248   2.739  -1.860
  178    HB2  ARG  25           1HB      ARG  25  -1.949   5.198  -1.794
  179    HB3  ARG  25           2HB      ARG  25  -2.535   3.735  -1.013
  180    HG2  ARG  25           1HG      ARG  25  -0.556   3.667   0.393
  181    HG3  ARG  25           2HG      ARG  25   0.084   5.098  -0.418
  182    HD2  ARG  25           1HD      ARG  25  -2.551   5.048   1.040
  183    HD3  ARG  25           2HD      ARG  25  -1.029   5.518   1.797
  184    HE   ARG  25           HE       ARG  25  -2.634   7.104   0.058
  185   HH11  ARG  25          2HH1      ARG  25   0.649   6.464   1.022
  186   HH12  ARG  25          1HH1      ARG  25   1.220   8.044   0.597
  187   HH21  ARG  25          2HH2      ARG  25  -1.895   9.187  -0.506
  188   HH22  ARG  25          1HH2      ARG  25  -0.228   9.592  -0.271
  189    H    CYS  26           H        CYS  26  -2.169   1.337  -1.652
  190    HA   CYS  26           HA       CYS  26  -3.005   0.401  -4.196
  191    HB2  CYS  26           1HB      CYS  26  -2.698  -1.058  -2.207
  192    HB3  CYS  26           2HB      CYS  26  -4.115  -0.314  -1.474
  193    HA   PRO  27           HA       PRO  27  -6.477   3.104  -4.766
  194    HB2  PRO  27           1HB      PRO  27  -7.478   1.862  -6.963
  195    HB3  PRO  27           2HB      PRO  27  -6.053   2.906  -7.016
  196    HG2  PRO  27           1HG      PRO  27  -6.208  -0.081  -6.917
  197    HG3  PRO  27           2HG      PRO  27  -5.156   0.952  -7.901
  198    HD2  PRO  27           1HD      PRO  27  -4.302  -0.260  -5.635
  199    HD3  PRO  27           2HD      PRO  27  -3.681   1.316  -6.167
  200    H    ALA  28           H        ALA  28  -6.516   0.212  -3.358
  201    HA   ALA  28           HA       ALA  28  -9.459   0.042  -3.356
  202    HB1  ALA  28           3HB      ALA  28  -7.482  -2.218  -3.079
  203    HB2  ALA  28           1HB      ALA  28  -9.232  -2.367  -2.905
  204    HB3  ALA  28           2HB      ALA  28  -8.535  -1.905  -4.459
  205    H    CYS  29           H        CYS  29  -6.789  -1.262  -1.381
  206    HA   CYS  29           HA       CYS  29  -8.300  -0.671   1.031
  207    HB2  CYS  29           1HB      CYS  29  -6.447  -1.886   2.175
  208    HB3  CYS  29           2HB      CYS  29  -7.246  -2.840   0.929
  209    H    ARG  30           H        ARG  30  -5.901   0.783  -0.868
  210    HA   ARG  30           HA       ARG  30  -4.687   2.693  -0.633
  211    HB2  ARG  30           1HB      ARG  30  -6.334   3.046   1.878
  212    HB3  ARG  30           2HB      ARG  30  -5.327   4.285   1.139
  213    HG2  ARG  30           1HG      ARG  30  -7.548   4.739   0.489
  214    HG3  ARG  30           2HG      ARG  30  -6.745   4.053  -0.925
  215    HD2  ARG  30           1HD      ARG  30  -7.934   2.099  -0.823
  216    HD3  ARG  30           2HD      ARG  30  -8.170   2.209   0.921
  217    HE   ARG  30           HE       ARG  30  -9.910   3.201  -1.106
  218   HH11  ARG  30          2HH1      ARG  30  -8.758   3.792   2.126
  219   HH12  ARG  30          1HH1      ARG  30 -10.184   4.643   2.619
  220   HH21  ARG  30          2HH2      ARG  30 -11.793   4.320  -0.469
  221   HH22  ARG  30          1HH2      ARG  30 -11.910   4.942   1.143
  222    H    VAL  31           H        VAL  31  -3.324   0.516   0.025
  223    HA   VAL  31           HA       VAL  31  -2.077   0.982   2.638
  224    HB   VAL  31           HB       VAL  31  -0.934  -1.188   2.246
  225   HG11  VAL  31          1HG1      VAL  31  -2.813  -1.427   3.570
  226   HG12  VAL  31          2HG1      VAL  31  -3.915  -0.970   2.270
  227   HG13  VAL  31          3HG1      VAL  31  -3.143  -2.556   2.257
  228   HG21  VAL  31          3HG2      VAL  31  -2.670  -1.284  -0.219
  229   HG22  VAL  31          1HG2      VAL  31  -0.910  -1.175  -0.183
  230   HG23  VAL  31          2HG2      VAL  31  -1.716  -2.626   0.413
  231    HA   PRO  32           HA       PRO  32   1.529   2.823   0.933
  232    HB2  PRO  32           1HB      PRO  32   3.398   2.002   2.724
  233    HB3  PRO  32           2HB      PRO  32   2.184   3.231   3.098
  234    HG2  PRO  32           1HG      PRO  32   2.201   0.317   3.781
  235    HG3  PRO  32           2HG      PRO  32   1.746   1.701   4.793
  236    HD2  PRO  32           1HD      PRO  32  -0.085   0.128   3.566
  237    HD3  PRO  32           2HD      PRO  32  -0.352   1.860   3.850
  238    H    TYR  33           H        TYR  33   2.627   2.218  -0.814
  239    HA   TYR  33           HA       TYR  33   4.241  -0.191  -0.779
  240    HB2  TYR  33           1HB      TYR  33   3.178  -1.373  -2.435
  241    HB3  TYR  33           2HB      TYR  33   1.783  -0.609  -1.681
  242    HD1  TYR  33           HD2      TYR  33   4.264  -0.011  -4.409
  243    HD2  TYR  33           HD1      TYR  33   0.276   0.523  -3.024
  244    HE1  TYR  33           HE2      TYR  33   3.654   0.992  -6.570
  245    HE2  TYR  33           HE1      TYR  33  -0.345   1.527  -5.182
  246    HH   TYR  33           HH       TYR  33   2.066   2.036  -7.733
  247    H    CYS  34           H        CYS  34   6.128   0.226  -1.713
  248    HA   CYS  34           HA       CYS  34   6.723   2.710  -2.890
  249    HB2  CYS  34           1HB      CYS  34   8.851   1.407  -3.648
  250    HB3  CYS  34           2HB      CYS  34   8.569   1.675  -1.931
  251    H    SER  35           H        SER  35   7.151  -0.420  -4.525
  252    HA   SER  35           HA       SER  35   6.143   0.841  -6.991
  253    HB2  SER  35           1HB      SER  35   8.197  -1.371  -6.764
  254    HB3  SER  35           2HB      SER  35   7.656  -0.598  -8.254
  255    HG   SER  35           HG       SER  35   9.203   0.767  -7.895
  256    H    VAL  36           H        VAL  36   5.681  -1.123  -8.643
  257    HA   VAL  36           HA       VAL  36   3.306  -2.311  -7.766
  258    HB   VAL  36           HB       VAL  36   4.127  -1.904 -10.176
  259   HG11  VAL  36          1HG1      VAL  36   5.159  -3.805 -11.277
  260   HG12  VAL  36          2HG1      VAL  36   6.191  -3.224  -9.968
  261   HG13  VAL  36          3HG1      VAL  36   5.222  -4.682  -9.748
  262   HG21  VAL  36          3HG2      VAL  36   2.932  -4.484 -10.429
  263   HG22  VAL  36          1HG2      VAL  36   2.217  -3.650  -9.049
  264   HG23  VAL  36          2HG2      VAL  36   2.196  -2.896 -10.644
  265    H    VAL  37           H        VAL  37   6.578  -3.637  -8.050
  266    HA   VAL  37           HA       VAL  37   6.269  -6.282  -7.636
  267    HB   VAL  37           HB       VAL  37   8.256  -4.535  -6.176
  268   HG11  VAL  37          1HG1      VAL  37   8.633  -7.433  -6.846
  269   HG12  VAL  37          2HG1      VAL  37   9.519  -6.435  -5.691
  270   HG13  VAL  37          3HG1      VAL  37   7.863  -6.934  -5.340
  271   HG21  VAL  37          3HG2      VAL  37   8.122  -4.486  -8.744
  272   HG22  VAL  37          1HG2      VAL  37   9.693  -4.779  -7.998
  273   HG23  VAL  37          2HG2      VAL  37   8.770  -6.125  -8.667
  274    H    CYS  38           H        CYS  38   6.727  -4.091  -4.855
  275    HA   CYS  38           HA       CYS  38   6.002  -5.885  -2.876
  276    HB2  CYS  38           1HB      CYS  38   6.030  -2.905  -3.072
  277    HB3  CYS  38           2HB      CYS  38   5.243  -3.643  -1.681
  278    H    PHE  39           H        PHE  39   3.979  -3.867  -4.912
  279    HA   PHE  39           HA       PHE  39   1.563  -4.273  -3.476
  280    HB2  PHE  39           1HB      PHE  39   1.660  -2.396  -4.937
  281    HB3  PHE  39           2HB      PHE  39   2.141  -3.396  -6.303
  282    HD1  PHE  39           HD1      PHE  39  -0.667  -3.094  -3.866
  283    HD2  PHE  39           HD2      PHE  39   0.543  -3.912  -7.864
  284    HE1  PHE  39           HE1      PHE  39  -3.026  -3.307  -4.533
  285    HE2  PHE  39           HE2      PHE  39  -1.813  -4.125  -8.537
  286    HZ   PHE  39           HZ       PHE  39  -3.602  -3.822  -6.871
  287    H    ARG  40           H        ARG  40   3.263  -6.078  -5.922
  288    HA   ARG  40           HA       ARG  40   1.215  -7.684  -6.910
  289    HB2  ARG  40           1HB      ARG  40   4.123  -8.371  -6.450
  290    HB3  ARG  40           2HB      ARG  40   3.011  -9.329  -7.418
  291    HG2  ARG  40           1HG      ARG  40   2.673  -7.302  -8.858
  292    HG3  ARG  40           2HG      ARG  40   3.995  -6.543  -7.970
  293    HD2  ARG  40           1HD      ARG  40   5.143  -7.429  -9.743
  294    HD3  ARG  40           2HD      ARG  40   5.257  -8.761  -8.594
  295    HE   ARG  40           HE       ARG  40   3.672  -8.682 -11.031
  296   HH11  ARG  40          2HH1      ARG  40   4.464 -10.334  -8.071
  297   HH12  ARG  40          1HH1      ARG  40   3.821 -11.855  -8.594
  298   HH21  ARG  40          2HH2      ARG  40   2.822 -10.680 -11.732
  299   HH22  ARG  40          1HH2      ARG  40   2.888 -12.051 -10.678
  300    H    LYS  41           H        LYS  41   3.550  -8.573  -4.359
  301    HA   LYS  41           HA       LYS  41   2.327 -10.928  -3.556
  302    HB2  LYS  41           1HB      LYS  41   3.864  -8.969  -1.839
  303    HB3  LYS  41           2HB      LYS  41   3.538 -10.648  -1.430
  304    HG2  LYS  41           1HG      LYS  41   4.917 -11.428  -3.211
  305    HG3  LYS  41           2HG      LYS  41   5.089  -9.797  -3.864
  306    HD2  LYS  41           1HD      LYS  41   6.500  -9.123  -2.141
  307    HD3  LYS  41           2HD      LYS  41   5.970 -10.421  -1.069
  308    HE2  LYS  41           1HE      LYS  41   7.004 -11.975  -2.879
  309    HE3  LYS  41           2HE      LYS  41   7.869 -10.522  -3.379
  310    HZ1  LYS  41           3HZ      LYS  41   8.450 -10.383  -0.873
  311    HZ2  LYS  41           1HZ      LYS  41   9.309 -11.446  -1.870
  312    HZ3  LYS  41           2HZ      LYS  41   8.081 -12.034  -0.867
  313    H    HIS  42           H        HIS  42   1.910  -7.667  -2.185
  314    HA   HIS  42           HA       HIS  42   0.069  -8.273  -0.207
  315    HB2  HIS  42           1HB      HIS  42   0.724  -6.093  -0.022
  316    HB3  HIS  42           2HB      HIS  42   0.756  -5.842  -1.765
  317    HD1  HIS  42           HD1      HIS  42  -1.583  -5.798   1.174
  318    HD2  HIS  42           HD2      HIS  42  -1.573  -4.809  -2.861
  319    HE1  HIS  42           HE1      HIS  42  -3.710  -4.513   0.791
  320    H    LYS  43           H        LYS  43  -0.499  -7.531  -3.624
  321    HA   LYS  43           HA       LYS  43  -3.183  -7.297  -3.801
  322    HB2  LYS  43           1HB      LYS  43  -1.638  -7.310  -5.735
  323    HB3  LYS  43           2HB      LYS  43  -1.509  -9.059  -5.601
  324    HG2  LYS  43           1HG      LYS  43  -3.045  -8.453  -7.367
  325    HG3  LYS  43           2HG      LYS  43  -3.906  -9.266  -6.058
  326    HD2  LYS  43           1HD      LYS  43  -4.579  -7.043  -5.187
  327    HD3  LYS  43           2HD      LYS  43  -3.809  -6.296  -6.589
  328    HE2  LYS  43           1HE      LYS  43  -6.014  -6.429  -7.264
  329    HE3  LYS  43           2HE      LYS  43  -5.332  -7.904  -7.949
  330    HZ1  LYS  43           3HZ      LYS  43  -6.334  -9.210  -6.327
  331    HZ2  LYS  43           1HZ      LYS  43  -7.531  -8.076  -6.704
  332    HZ3  LYS  43           2HZ      LYS  43  -6.619  -7.903  -5.291
  333    H    GLU  44           H        GLU  44  -1.454 -10.403  -3.614
  334    HA   GLU  44           HA       GLU  44  -3.648 -12.100  -3.723
  335    HB2  GLU  44           1HB      GLU  44  -2.198 -13.770  -3.169
  336    HB3  GLU  44           2HB      GLU  44  -1.022 -12.524  -3.560
  337    HG2  GLU  44           1HG      GLU  44  -0.844 -11.959  -1.183
  338    HG3  GLU  44           2HG      GLU  44  -1.995 -13.238  -0.803
  339    H    GLN  45           H        GLN  45  -2.296 -10.335  -0.996
  340    HA   GLN  45           HA       GLN  45  -4.460 -11.369   0.708
  341    HB2  GLN  45           1HB      GLN  45  -3.120 -10.883   2.608
  342    HB3  GLN  45           2HB      GLN  45  -2.066 -11.684   1.451
  343    HG2  GLN  45           1HG      GLN  45  -1.176  -9.502   0.770
  344    HG3  GLN  45           2HG      GLN  45  -2.208  -8.723   1.968
  345   HE21  GLN  45          1HE2      GLN  45  -1.357  -8.361   3.887
  346   HE22  GLN  45          2HE2      GLN  45   0.041  -9.138   4.541
  347    H    CYS  46           H        CYS  46  -4.626  -9.191  -1.307
  348    HA   CYS  46           HA       CYS  46  -4.939  -6.782   0.280
  349    HB2  CYS  46           1HB      CYS  46  -4.064  -6.442  -1.915
  350    HB3  CYS  46           2HB      CYS  46  -5.352  -7.393  -2.647
  351    H    ASN  47           H        ASN  47  -6.629  -7.064   1.673
  352    HA   ASN  47           HA       ASN  47  -9.243  -7.718   0.486
  353    HB2  ASN  47           1HB      ASN  47  -8.411  -7.913   3.389
  354    HB3  ASN  47           2HB      ASN  47  -9.954  -8.421   2.710
  355   HD21  ASN  47          1HD2      ASN  47  -7.569  -9.775   4.071
  356   HD22  ASN  47          2HD2      ASN  47  -7.268 -11.151   3.070
  357    HA   PRO  48           HA       PRO  48  -9.845  -3.311   1.271
  358    HB2  PRO  48           1HB      PRO  48 -12.071  -3.122  -0.272
  359    HB3  PRO  48           2HB      PRO  48 -10.435  -3.104  -0.940
  360    HG2  PRO  48           1HG      PRO  48 -12.385  -5.369  -0.767
  361    HG3  PRO  48           2HG      PRO  48 -11.333  -4.899  -2.115
  362    HD2  PRO  48           1HD      PRO  48 -10.727  -6.933  -0.433
  363    HD3  PRO  48           2HD      PRO  48  -9.483  -5.916  -1.189
  364    H    GLU  49           H        GLU  49 -11.207  -5.915   2.579
  365    HA   GLU  49           HA       GLU  49 -13.808  -5.177   3.308
  366    HB2  GLU  49           1HB      GLU  49 -11.756  -6.952   4.612
  367    HB3  GLU  49           2HB      GLU  49 -13.345  -6.704   5.321
  368    HG2  GLU  49           1HG      GLU  49 -14.186  -7.389   2.945
  369    HG3  GLU  49           2HG      GLU  49 -12.587  -8.120   2.815
  370    H    THR  50           H        THR  50 -14.208  -5.021   5.890
  371    HA   THR  50           HA       THR  50 -14.181  -3.682   7.734
  372    HB   THR  50           HB       THR  50 -11.451  -2.649   7.061
  373    HG1  THR  50           HG1      THR  50 -10.942  -4.722   6.808
  374   HG21  THR  50          3HG2      THR  50 -12.589  -1.850   9.082
  375   HG22  THR  50          1HG2      THR  50 -11.155  -2.794   9.484
  376   HG23  THR  50          2HG2      THR  50 -12.758  -3.513   9.644
  377    H    SER  51           H        SER  51 -15.500  -2.655   5.643
  378    HA   SER  51           HA       SER  51 -14.562   0.024   5.062
  379    HB2  SER  51           1HB      SER  51 -16.345   0.169   3.519
  380    HB3  SER  51           2HB      SER  51 -15.818  -1.511   3.429
  381    HG   SER  51           HG       SER  51 -17.842  -1.922   3.820
  382    H    GLY  52           H        GLY  52 -15.780   1.937   5.535
  383    HA2  GLY  52           1HA      GLY  52 -18.057   2.228   7.008
  384    HA3  GLY  52           2HA      GLY  52 -16.817   1.929   8.217
  385    HA   PRO  53           HA       PRO  53 -15.629   6.142   8.206
  386    HB2  PRO  53           1HB      PRO  53 -12.922   6.026   8.369
  387    HB3  PRO  53           2HB      PRO  53 -13.984   5.604   9.717
  388    HG2  PRO  53           1HG      PRO  53 -12.597   3.808   7.765
  389    HG3  PRO  53           2HG      PRO  53 -12.775   3.628   9.520
  390    HD2  PRO  53           1HD      PRO  53 -14.325   2.284   7.753
  391    HD3  PRO  53           2HD      PRO  53 -14.919   2.800   9.344
  392    H    SER  54           H        SER  54 -14.097   7.769   7.144
  393    HA   SER  54           HA       SER  54 -13.433   8.855   5.259
  394    HB2  SER  54           1HB      SER  54 -12.603   6.044   4.518
  395    HB3  SER  54           2HB      SER  54 -12.214   7.459   3.540
  396    HG   SER  54           HG       SER  54 -11.373   6.857   6.172
  397    H    SER  55           H        SER  55 -16.129   8.332   5.401
  398    HA   SER  55           HA       SER  55 -18.042   8.241   4.170
  399    HB2  SER  55           1HB      SER  55 -16.042   9.106   2.082
  400    HB3  SER  55           2HB      SER  55 -17.764   8.959   1.728
  401    HG   SER  55           HG       SER  55 -17.184  11.084   2.367
  402    H    GLY  56           H        GLY  56 -16.901   5.763   4.644
  403    HA2  GLY  56           1HA      GLY  56 -17.620   4.329   2.165
  404    HA3  GLY  56           2HA      GLY  56 -16.248   3.832   3.143
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1  13.216  34.164  26.911
    2    HA2  GLY   1           1HA      GLY   1  13.120  31.582  27.747
    3    HA3  GLY   1           2HA      GLY   1  12.041  32.819  28.376
    4    H    SER   2           H        SER   2  12.204  31.265  25.182
    5    HA   SER   2           HA       SER   2   9.397  30.450  25.559
    6    HB2  SER   2           1HB      SER   2  10.884  31.497  23.183
    7    HB3  SER   2           2HB      SER   2   9.535  30.390  22.924
    8    HG   SER   2           HG       SER   2   8.922  32.626  22.945
    9    H    SER   3           H        SER   3   9.499  28.377  26.212
   10    HA   SER   3           HA       SER   3  11.465  26.523  25.346
   11    HB2  SER   3           1HB      SER   3  10.423  26.154  27.472
   12    HB3  SER   3           2HB      SER   3   8.814  26.156  26.751
   13    HG   SER   3           HG       SER   3  10.610  24.294  25.751
   14    H    GLY   4           H        GLY   4  11.545  25.268  23.594
   15    HA2  GLY   4           1HA      GLY   4   9.674  23.851  22.296
   16    HA3  GLY   4           2HA      GLY   4   9.403  25.461  21.644
   17    H    SER   5           H        SER   5  10.185  25.464  19.639
   18    HA   SER   5           HA       SER   5  11.645  25.342  17.899
   19    HB2  SER   5           1HB      SER   5  13.707  25.139  20.108
   20    HB3  SER   5           2HB      SER   5  14.070  25.428  18.407
   21    HG   SER   5           HG       SER   5  13.853  27.446  18.967
   22    H    SER   6           H        SER   6  10.338  23.007  18.585
   23    HA   SER   6           HA       SER   6  12.342  20.880  18.437
   24    HB2  SER   6           1HB      SER   6   9.352  20.811  18.891
   25    HB3  SER   6           2HB      SER   6  10.353  19.366  18.739
   26    HG   SER   6           HG       SER   6  11.513  20.050  20.566
   27    H    GLY   7           H        GLY   7  13.017  20.359  16.464
   28    HA2  GLY   7           1HA      GLY   7  11.005  19.936  14.371
   29    HA3  GLY   7           2HA      GLY   7  12.354  21.007  14.024
   30    H    LEU   8           H        LEU   8  11.253  17.936  13.654
   31    HA   LEU   8           HA       LEU   8  13.934  16.968  13.029
   32    HB2  LEU   8           1HB      LEU   8  12.079  15.789  15.035
   33    HB3  LEU   8           2HB      LEU   8  13.035  14.696  14.035
   34    HG   LEU   8           HG       LEU   8  14.426  16.889  15.501
   35   HD11  LEU   8          1HD1      LEU   8  13.865  14.272  16.843
   36   HD12  LEU   8          2HD1      LEU   8  12.779  15.647  17.038
   37   HD13  LEU   8          3HD1      LEU   8  14.465  15.777  17.540
   38   HD21  LEU   8          3HD2      LEU   8  15.756  14.430  15.666
   39   HD22  LEU   8          1HD2      LEU   8  16.154  15.801  14.630
   40   HD23  LEU   8          2HD2      LEU   8  15.105  14.517  14.029
   41    H    LYS   9           H        LYS   9  13.922  15.080  11.625
   42    HA   LYS   9           HA       LYS   9  11.805  15.253   9.678
   43    HB2  LYS   9           1HB      LYS   9  14.243  13.466   9.774
   44    HB3  LYS   9           2HB      LYS   9  13.168  13.647   8.394
   45    HG2  LYS   9           1HG      LYS   9  13.800  15.961   8.151
   46    HG3  LYS   9           2HG      LYS   9  14.791  15.874   9.610
   47    HD2  LYS   9           1HD      LYS   9  15.305  13.994   7.342
   48    HD3  LYS   9           2HD      LYS   9  15.907  15.651   7.264
   49    HE2  LYS   9           1HE      LYS   9  17.060  15.309   9.410
   50    HE3  LYS   9           2HE      LYS   9  16.485  13.643   9.441
   51    HZ1  LYS   9           3HZ      LYS   9  18.112  14.705   7.209
   52    HZ2  LYS   9           1HZ      LYS   9  17.803  13.089   7.602
   53    HZ3  LYS   9           2HZ      LYS   9  18.814  14.020   8.588
   54    H    CYS  10           H        CYS  10  10.171  13.858   9.344
   55    HA   CYS  10           HA       CYS  10  10.204  11.168  10.327
   56    HB2  CYS  10           1HB      CYS  10   8.314  11.376  11.868
   57    HB3  CYS  10           2HB      CYS  10   9.667  12.362  12.407
   58    HG   CYS  10           HG       CYS  10   8.567  14.773  11.560
   59    H    SER  11           H        SER  11   8.541   9.901   9.473
   60    HA   SER  11           HA       SER  11   6.931  11.248   7.405
   61    HB2  SER  11           1HB      SER  11   6.963   9.106   6.184
   62    HB3  SER  11           2HB      SER  11   8.596   9.706   6.474
   63    HG   SER  11           HG       SER  11   7.959   7.366   6.970
   64    H    THR  12           H        THR  12   5.007   9.671   6.766
   65    HA   THR  12           HA       THR  12   3.447   9.375   9.210
   66    HB   THR  12           HB       THR  12   2.343  10.596   7.464
   67    HG1  THR  12           HG1      THR  12   0.471   9.497   7.560
   68   HG21  THR  12          3HG2      THR  12   1.929   8.567   5.488
   69   HG22  THR  12          1HG2      THR  12   3.659   8.783   5.747
   70   HG23  THR  12          2HG2      THR  12   2.655  10.163   5.302
   71    H    VAL  13           H        VAL  13   4.721   7.442   6.568
   72    HA   VAL  13           HA       VAL  13   4.731   5.058   8.052
   73    HB   VAL  13           HB       VAL  13   2.338   5.022   7.825
   74   HG11  VAL  13          1HG1      VAL  13   2.189   6.549   5.893
   75   HG12  VAL  13          2HG1      VAL  13   2.743   5.243   4.843
   76   HG13  VAL  13          3HG1      VAL  13   1.201   5.102   5.690
   77   HG21  VAL  13          3HG2      VAL  13   2.066   2.938   6.414
   78   HG22  VAL  13          1HG2      VAL  13   3.774   3.103   6.007
   79   HG23  VAL  13          2HG2      VAL  13   3.286   2.859   7.684
   80    H    VAL  14           H        VAL  14   5.742   3.354   6.957
   81    HA   VAL  14           HA       VAL  14   6.791   4.062   4.293
   82    HB   VAL  14           HB       VAL  14   8.787   2.732   4.837
   83   HG11  VAL  14          1HG1      VAL  14   9.825   4.319   6.310
   84   HG12  VAL  14          2HG1      VAL  14   8.688   5.180   5.270
   85   HG13  VAL  14          3HG1      VAL  14   8.258   4.822   6.944
   86   HG21  VAL  14          3HG2      VAL  14   7.585   1.274   6.509
   87   HG22  VAL  14          1HG2      VAL  14   9.189   1.827   6.991
   88   HG23  VAL  14          2HG2      VAL  14   7.752   2.599   7.661
   89    H    CYS  15           H        CYS  15   7.121   2.366   2.788
   90    HA   CYS  15           HA       CYS  15   5.155   0.666   2.230
   91    HB2  CYS  15           1HB      CYS  15   7.331   1.015   0.944
   92    HB3  CYS  15           2HB      CYS  15   8.007  -0.270   1.939
   93    H    VAL  16           H        VAL  16   4.184  -1.055   3.082
   94    HA   VAL  16           HA       VAL  16   5.175  -2.183   5.543
   95    HB   VAL  16           HB       VAL  16   3.102  -3.561   5.471
   96   HG11  VAL  16          1HG1      VAL  16   3.358  -1.061   6.266
   97   HG12  VAL  16          2HG1      VAL  16   2.233  -0.766   4.938
   98   HG13  VAL  16          3HG1      VAL  16   1.786  -1.860   6.248
   99   HG21  VAL  16          3HG2      VAL  16   3.134  -2.725   2.729
  100   HG22  VAL  16          1HG2      VAL  16   2.098  -3.912   3.521
  101   HG23  VAL  16          2HG2      VAL  16   1.629  -2.212   3.492
  102    H    ILE  17           H        ILE  17   6.451  -2.660   2.788
  103    HA   ILE  17           HA       ILE  17   6.591  -5.594   3.033
  104    HB   ILE  17           HB       ILE  17   6.948  -4.073   0.453
  105   HG12  ILE  17          1HG1      ILE  17   4.618  -3.902   1.319
  106   HG13  ILE  17          2HG1      ILE  17   4.732  -4.803  -0.189
  107   HG21  ILE  17          1HG2      ILE  17   6.270  -6.951   0.547
  108   HG22  ILE  17          2HG2      ILE  17   7.316  -6.067  -0.563
  109   HG23  ILE  17          3HG2      ILE  17   7.899  -6.496   1.045
  110   HD11  ILE  17          3HD1      ILE  17   3.754  -6.550   0.742
  111   HD12  ILE  17          1HD1      ILE  17   4.968  -6.601   2.019
  112   HD13  ILE  17          2HD1      ILE  17   3.528  -5.600   2.210
  113    H    CYS  18           H        CYS  18   8.334  -2.766   1.735
  114    HA   CYS  18           HA       CYS  18  10.858  -4.095   2.466
  115    HB2  CYS  18           1HB      CYS  18  11.950  -2.775   0.768
  116    HB3  CYS  18           2HB      CYS  18  10.547  -3.558   0.048
  117    H    LEU  19           H        LEU  19   8.789  -1.487   3.166
  118    HA   LEU  19           HA       LEU  19   8.887   0.135   4.765
  119    HB2  LEU  19           1HB      LEU  19  11.649  -0.839   5.444
  120    HB3  LEU  19           2HB      LEU  19  10.535   0.062   6.469
  121    HG   LEU  19           HG       LEU  19   9.984  -2.746   5.533
  122   HD11  LEU  19          1HD1      LEU  19  12.100  -2.128   7.109
  123   HD12  LEU  19          2HD1      LEU  19  11.199  -3.642   7.193
  124   HD13  LEU  19          3HD1      LEU  19  10.828  -2.332   8.313
  125   HD21  LEU  19          3HD2      LEU  19   8.396  -2.763   7.353
  126   HD22  LEU  19          1HD2      LEU  19   8.071  -1.387   6.298
  127   HD23  LEU  19          2HD2      LEU  19   8.890  -1.141   7.841
  128    H    GLU  20           H        GLU  20   9.300   1.022   2.334
  129    HA   GLU  20           HA       GLU  20  11.450   2.995   2.657
  130    HB2  GLU  20           1HB      GLU  20  10.817   1.529   0.089
  131    HB3  GLU  20           2HB      GLU  20  11.985   2.832   0.263
  132    HG2  GLU  20           1HG      GLU  20  13.217   1.394   1.896
  133    HG3  GLU  20           2HG      GLU  20  12.123   0.081   1.465
  134    H    LYS  21           H        LYS  21  11.122   4.970   1.458
  135    HA   LYS  21           HA       LYS  21   8.713   6.178   1.762
  136    HB2  LYS  21           1HB      LYS  21  10.849   6.672  -0.305
  137    HB3  LYS  21           2HB      LYS  21   9.440   7.714  -0.151
  138    HG2  LYS  21           1HG      LYS  21  10.092   8.502   1.932
  139    HG3  LYS  21           2HG      LYS  21  11.177   7.139   2.215
  140    HD2  LYS  21           1HD      LYS  21  12.532   9.043   1.744
  141    HD3  LYS  21           2HD      LYS  21  12.591   7.993   0.326
  142    HE2  LYS  21           1HE      LYS  21  12.292  10.133  -0.561
  143    HE3  LYS  21           2HE      LYS  21  10.675   9.433  -0.579
  144    HZ1  LYS  21           3HZ      LYS  21  11.304  10.837   1.853
  145    HZ2  LYS  21           1HZ      LYS  21   9.932  10.940   0.867
  146    HZ3  LYS  21           2HZ      LYS  21  11.319  11.829   0.482
  147    HA   PRO  22           HA       PRO  22   6.339   3.772  -1.241
  148    HB2  PRO  22           1HB      PRO  22   3.926   4.511  -0.242
  149    HB3  PRO  22           2HB      PRO  22   4.909   3.228   0.473
  150    HG2  PRO  22           1HG      PRO  22   4.621   6.087   1.314
  151    HG3  PRO  22           2HG      PRO  22   4.661   4.624   2.316
  152    HD2  PRO  22           1HD      PRO  22   6.816   6.233   2.002
  153    HD3  PRO  22           2HD      PRO  22   6.959   4.479   2.236
  154    H    LYS  23           H        LYS  23   6.073   4.557  -3.225
  155    HA   LYS  23           HA       LYS  23   5.645   7.364  -3.696
  156    HB2  LYS  23           1HB      LYS  23   5.842   4.999  -5.566
  157    HB3  LYS  23           2HB      LYS  23   5.645   6.659  -6.110
  158    HG2  LYS  23           1HG      LYS  23   7.906   6.449  -6.270
  159    HG3  LYS  23           2HG      LYS  23   7.773   7.054  -4.617
  160    HD2  LYS  23           1HD      LYS  23   8.185   4.956  -3.687
  161    HD3  LYS  23           2HD      LYS  23   7.773   4.109  -5.181
  162    HE2  LYS  23           1HE      LYS  23  10.068   3.951  -5.193
  163    HE3  LYS  23           2HE      LYS  23   9.820   5.416  -6.142
  164    HZ1  LYS  23           3HZ      LYS  23  10.188   5.634  -3.235
  165    HZ2  LYS  23           1HZ      LYS  23  10.565   6.748  -4.451
  166    HZ3  LYS  23           2HZ      LYS  23  11.541   5.387  -4.220
  167    H    TYR  24           H        TYR  24   3.759   4.397  -3.983
  168    HA   TYR  24           HA       TYR  24   1.345   6.049  -4.266
  169    HB2  TYR  24           1HB      TYR  24   1.453   3.409  -5.657
  170    HB3  TYR  24           2HB      TYR  24   0.507   4.841  -6.045
  171    HD1  TYR  24           HD1      TYR  24   3.891   3.357  -6.225
  172    HD2  TYR  24           HD2      TYR  24   1.317   6.467  -7.570
  173    HE1  TYR  24           HE1      TYR  24   5.542   3.974  -7.941
  174    HE2  TYR  24           HE2      TYR  24   2.960   7.092  -9.289
  175    HH   TYR  24           HH       TYR  24   5.218   6.862  -9.847
  176    H    ARG  25           H        ARG  25  -0.665   4.553  -3.938
  177    HA   ARG  25           HA       ARG  25  -0.135   2.585  -1.827
  178    HB2  ARG  25           1HB      ARG  25  -1.779   5.070  -1.637
  179    HB3  ARG  25           2HB      ARG  25  -2.327   3.636  -0.780
  180    HG2  ARG  25           1HG      ARG  25  -0.289   3.541   0.483
  181    HG3  ARG  25           2HG      ARG  25   0.404   4.858  -0.464
  182    HD2  ARG  25           1HD      ARG  25  -1.698   6.170   0.355
  183    HD3  ARG  25           2HD      ARG  25  -1.742   4.935   1.613
  184    HE   ARG  25           HE       ARG  25   0.839   6.143   1.319
  185   HH11  ARG  25          2HH1      ARG  25  -2.303   6.480   2.778
  186   HH12  ARG  25          1HH1      ARG  25  -1.738   7.481   4.074
  187   HH21  ARG  25          2HH2      ARG  25   1.596   7.460   3.021
  188   HH22  ARG  25          1HH2      ARG  25   0.480   8.039   4.211
  189    H    CYS  26           H        CYS  26  -2.058   1.230  -1.345
  190    HA   CYS  26           HA       CYS  26  -3.190   0.252  -3.772
  191    HB2  CYS  26           1HB      CYS  26  -2.638  -1.282  -1.970
  192    HB3  CYS  26           2HB      CYS  26  -3.757  -0.460  -0.887
  193    HA   PRO  27           HA       PRO  27  -6.755   2.879  -3.880
  194    HB2  PRO  27           1HB      PRO  27  -8.084   1.546  -5.836
  195    HB3  PRO  27           2HB      PRO  27  -6.695   2.591  -6.159
  196    HG2  PRO  27           1HG      PRO  27  -6.805  -0.390  -5.916
  197    HG3  PRO  27           2HG      PRO  27  -5.933   0.605  -7.097
  198    HD2  PRO  27           1HD      PRO  27  -4.717  -0.511  -4.951
  199    HD3  PRO  27           2HD      PRO  27  -4.204   1.043  -5.638
  200    H    ALA  28           H        ALA  28  -6.546   0.005  -2.412
  201    HA   ALA  28           HA       ALA  28  -9.451  -0.175  -1.935
  202    HB1  ALA  28           3HB      ALA  28  -9.163  -2.540  -1.458
  203    HB2  ALA  28           1HB      ALA  28  -8.569  -2.159  -3.075
  204    HB3  ALA  28           2HB      ALA  28  -7.430  -2.406  -1.752
  205    H    CYS  29           H        CYS  29  -6.660  -1.572  -0.242
  206    HA   CYS  29           HA       CYS  29  -7.763  -0.831   2.306
  207    HB2  CYS  29           1HB      CYS  29  -5.574  -1.833   3.155
  208    HB3  CYS  29           2HB      CYS  29  -6.646  -2.915   2.272
  209    H    ARG  30           H        ARG  30  -5.497   0.517   0.086
  210    HA   ARG  30           HA       ARG  30  -4.447   2.544   0.069
  211    HB2  ARG  30           1HB      ARG  30  -5.564   3.037   2.828
  212    HB3  ARG  30           2HB      ARG  30  -5.010   4.231   1.662
  213    HG2  ARG  30           1HG      ARG  30  -7.339   2.426   1.101
  214    HG3  ARG  30           2HG      ARG  30  -7.518   3.959   1.957
  215    HD2  ARG  30           1HD      ARG  30  -6.107   4.826  -0.127
  216    HD3  ARG  30           2HD      ARG  30  -6.865   3.427  -0.887
  217    HE   ARG  30           HE       ARG  30  -8.670   5.180   0.539
  218   HH11  ARG  30          2HH1      ARG  30  -7.171   4.396  -2.504
  219   HH12  ARG  30          1HH1      ARG  30  -8.385   5.186  -3.454
  220   HH21  ARG  30          2HH2      ARG  30 -10.274   6.223  -0.701
  221   HH22  ARG  30          1HH2      ARG  30 -10.149   6.226  -2.428
  222    H    VAL  31           H        VAL  31  -2.866   0.515   0.547
  223    HA   VAL  31           HA       VAL  31  -1.310   1.117   2.965
  224    HB   VAL  31           HB       VAL  31  -0.092  -1.032   2.353
  225   HG11  VAL  31          1HG1      VAL  31  -2.208  -0.594   3.937
  226   HG12  VAL  31          2HG1      VAL  31  -2.916  -1.764   2.822
  227   HG13  VAL  31          3HG1      VAL  31  -1.466  -2.181   3.737
  228   HG21  VAL  31          3HG2      VAL  31  -0.730  -1.226   0.043
  229   HG22  VAL  31          1HG2      VAL  31  -1.392  -2.600   0.929
  230   HG23  VAL  31          2HG2      VAL  31  -2.440  -1.257   0.473
  231    HA   PRO  32           HA       PRO  32   1.868   3.073   0.635
  232    HB2  PRO  32           1HB      PRO  32   3.974   2.627   2.289
  233    HB3  PRO  32           2HB      PRO  32   2.699   3.796   2.651
  234    HG2  PRO  32           1HG      PRO  32   3.047   1.000   3.660
  235    HG3  PRO  32           2HG      PRO  32   2.574   2.459   4.549
  236    HD2  PRO  32           1HD      PRO  32   0.777   0.610   3.723
  237    HD3  PRO  32           2HD      PRO  32   0.386   2.338   3.834
  238    H    TYR  33           H        TYR  33   2.792   2.319  -1.156
  239    HA   TYR  33           HA       TYR  33   4.563   0.007  -1.005
  240    HB2  TYR  33           1HB      TYR  33   3.455  -1.322  -2.518
  241    HB3  TYR  33           2HB      TYR  33   2.080  -0.555  -1.730
  242    HD1  TYR  33           HD2      TYR  33   4.351  -0.119  -4.659
  243    HD2  TYR  33           HD1      TYR  33   0.468   0.488  -3.030
  244    HE1  TYR  33           HE2      TYR  33   3.573   0.712  -6.839
  245    HE2  TYR  33           HE1      TYR  33  -0.321   1.321  -5.206
  246    HH   TYR  33           HH       TYR  33   1.440   2.435  -7.497
  247    H    CYS  34           H        CYS  34   6.395   0.461  -2.019
  248    HA   CYS  34           HA       CYS  34   6.831   2.845  -3.429
  249    HB2  CYS  34           1HB      CYS  34   8.977   1.579  -4.181
  250    HB3  CYS  34           2HB      CYS  34   8.755   1.948  -2.474
  251    H    SER  35           H        SER  35   7.274  -0.400  -4.822
  252    HA   SER  35           HA       SER  35   6.138   0.633  -7.338
  253    HB2  SER  35           1HB      SER  35   8.274   0.191  -8.030
  254    HB3  SER  35           2HB      SER  35   8.544  -1.019  -6.775
  255    HG   SER  35           HG       SER  35   6.744  -1.507  -8.888
  256    H    VAL  36           H        VAL  36   4.981  -0.885  -8.666
  257    HA   VAL  36           HA       VAL  36   2.945  -2.235  -7.509
  258    HB   VAL  36           HB       VAL  36   3.498  -1.833 -10.036
  259   HG11  VAL  36          1HG1      VAL  36   5.418  -3.318 -10.147
  260   HG12  VAL  36          2HG1      VAL  36   4.413  -4.683  -9.656
  261   HG13  VAL  36          3HG1      VAL  36   4.133  -3.895 -11.209
  262   HG21  VAL  36          3HG2      VAL  36   1.999  -4.346  -9.346
  263   HG22  VAL  36          1HG2      VAL  36   1.383  -2.741  -8.955
  264   HG23  VAL  36          2HG2      VAL  36   1.668  -3.190 -10.636
  265    H    VAL  37           H        VAL  37   6.195  -3.452  -8.043
  266    HA   VAL  37           HA       VAL  37   5.915  -6.149  -7.672
  267    HB   VAL  37           HB       VAL  37   8.091  -4.398  -6.521
  268   HG11  VAL  37          1HG1      VAL  37   9.339  -6.700  -6.952
  269   HG12  VAL  37          2HG1      VAL  37   8.524  -6.348  -5.426
  270   HG13  VAL  37          3HG1      VAL  37   7.724  -7.340  -6.646
  271   HG21  VAL  37          3HG2      VAL  37   9.038  -4.320  -8.553
  272   HG22  VAL  37          1HG2      VAL  37   8.631  -5.998  -8.911
  273   HG23  VAL  37          2HG2      VAL  37   7.429  -4.730  -9.148
  274    H    CYS  38           H        CYS  38   6.762  -3.944  -4.997
  275    HA   CYS  38           HA       CYS  38   6.360  -5.698  -2.912
  276    HB2  CYS  38           1HB      CYS  38   6.278  -2.735  -3.179
  277    HB3  CYS  38           2HB      CYS  38   5.640  -3.433  -1.694
  278    H    PHE  39           H        PHE  39   3.996  -3.927  -4.770
  279    HA   PHE  39           HA       PHE  39   1.811  -4.358  -2.985
  280    HB2  PHE  39           1HB      PHE  39   1.653  -2.521  -4.510
  281    HB3  PHE  39           2HB      PHE  39   1.943  -3.568  -5.896
  282    HD1  PHE  39           HD1      PHE  39  -0.486  -2.872  -3.180
  283    HD2  PHE  39           HD2      PHE  39   0.165  -4.539  -7.042
  284    HE1  PHE  39           HE1      PHE  39  -2.913  -3.167  -3.459
  285    HE2  PHE  39           HE2      PHE  39  -2.260  -4.835  -7.327
  286    HZ   PHE  39           HZ       PHE  39  -3.803  -4.148  -5.535
  287    H    ARG  40           H        ARG  40   3.012  -5.990  -5.882
  288    HA   ARG  40           HA       ARG  40   1.025  -7.752  -6.462
  289    HB2  ARG  40           1HB      ARG  40   3.996  -8.298  -6.365
  290    HB3  ARG  40           2HB      ARG  40   2.824  -9.364  -7.128
  291    HG2  ARG  40           1HG      ARG  40   2.172  -7.445  -8.600
  292    HG3  ARG  40           2HG      ARG  40   3.542  -6.557  -7.930
  293    HD2  ARG  40           1HD      ARG  40   4.213  -7.561 -10.005
  294    HD3  ARG  40           2HD      ARG  40   5.031  -8.393  -8.684
  295    HE   ARG  40           HE       ARG  40   2.903  -9.956  -9.043
  296   HH11  ARG  40          2HH1      ARG  40   5.122  -8.561 -11.334
  297   HH12  ARG  40          1HH1      ARG  40   4.961  -9.854 -12.476
  298   HH21  ARG  40          2HH2      ARG  40   2.681 -11.664 -10.538
  299   HH22  ARG  40          1HH2      ARG  40   3.571 -11.618 -12.023
  300    H    LYS  41           H        LYS  41   3.646  -8.441  -4.138
  301    HA   LYS  41           HA       LYS  41   2.726 -10.860  -3.183
  302    HB2  LYS  41           1HB      LYS  41   4.133  -8.685  -1.622
  303    HB3  LYS  41           2HB      LYS  41   4.004 -10.369  -1.128
  304    HG2  LYS  41           1HG      LYS  41   5.368 -11.090  -2.935
  305    HG3  LYS  41           2HG      LYS  41   5.318  -9.494  -3.687
  306    HD2  LYS  41           1HD      LYS  41   7.435  -9.700  -2.619
  307    HD3  LYS  41           2HD      LYS  41   6.463  -8.602  -1.635
  308    HE2  LYS  41           1HE      LYS  41   5.859 -10.609  -0.223
  309    HE3  LYS  41           2HE      LYS  41   7.102 -11.496  -1.104
  310    HZ1  LYS  41           3HZ      LYS  41   8.771 -10.310  -0.130
  311    HZ2  LYS  41           1HZ      LYS  41   7.643 -10.284   1.131
  312    HZ3  LYS  41           2HZ      LYS  41   7.821  -8.935   0.127
  313    H    HIS  42           H        HIS  42   1.713  -7.610  -2.309
  314    HA   HIS  42           HA       HIS  42   0.083  -8.442  -0.106
  315    HB2  HIS  42           1HB      HIS  42   0.644  -6.241   0.182
  316    HB3  HIS  42           2HB      HIS  42   0.614  -5.895  -1.545
  317    HD1  HIS  42           HD1      HIS  42  -1.601  -6.062   1.468
  318    HD2  HIS  42           HD2      HIS  42  -1.841  -5.029  -2.549
  319    HE1  HIS  42           HE1      HIS  42  -3.819  -4.909   1.203
  320    H    LYS  43           H        LYS  43  -0.832  -6.934  -3.209
  321    HA   LYS  43           HA       LYS  43  -3.473  -7.173  -3.286
  322    HB2  LYS  43           1HB      LYS  43  -1.671  -6.737  -5.202
  323    HB3  LYS  43           2HB      LYS  43  -2.125  -8.375  -5.655
  324    HG2  LYS  43           1HG      LYS  43  -4.210  -6.280  -5.191
  325    HG3  LYS  43           2HG      LYS  43  -3.363  -6.398  -6.735
  326    HD2  LYS  43           1HD      LYS  43  -4.102  -8.698  -6.992
  327    HD3  LYS  43           2HD      LYS  43  -4.885  -8.644  -5.411
  328    HE2  LYS  43           1HE      LYS  43  -6.473  -7.034  -6.174
  329    HE3  LYS  43           2HE      LYS  43  -5.598  -6.802  -7.686
  330    HZ1  LYS  43           3HZ      LYS  43  -7.285  -8.205  -8.313
  331    HZ2  LYS  43           1HZ      LYS  43  -7.290  -9.057  -6.851
  332    HZ3  LYS  43           2HZ      LYS  43  -6.057  -9.319  -7.978
  333    H    GLU  44           H        GLU  44  -1.262  -9.904  -3.539
  334    HA   GLU  44           HA       GLU  44  -2.798 -11.969  -4.343
  335    HB2  GLU  44           1HB      GLU  44  -0.690 -11.743  -2.251
  336    HB3  GLU  44           2HB      GLU  44  -1.600 -13.245  -2.337
  337    HG2  GLU  44           1HG      GLU  44  -0.296 -12.064  -4.760
  338    HG3  GLU  44           2HG      GLU  44   0.592 -13.088  -3.634
  339    H    GLN  45           H        GLN  45  -2.760 -10.701  -1.017
  340    HA   GLN  45           HA       GLN  45  -5.442 -11.857  -0.649
  341    HB2  GLN  45           1HB      GLN  45  -4.872 -12.327   1.700
  342    HB3  GLN  45           2HB      GLN  45  -3.854 -13.226   0.583
  343    HG2  GLN  45           1HG      GLN  45  -2.000 -11.827   0.991
  344    HG3  GLN  45           2HG      GLN  45  -2.993 -10.633   1.824
  345   HE21  GLN  45          1HE2      GLN  45  -1.478 -13.759   2.041
  346   HE22  GLN  45          2HE2      GLN  45  -1.595 -13.920   3.757
  347    H    CYS  46           H        CYS  46  -4.505  -9.150  -1.401
  348    HA   CYS  46           HA       CYS  46  -4.446  -7.220   0.469
  349    HB2  CYS  46           1HB      CYS  46  -4.460  -6.440  -1.727
  350    HB3  CYS  46           2HB      CYS  46  -5.907  -7.350  -2.147
  351    H    ASN  47           H        ASN  47  -5.596  -6.686   2.196
  352    HA   ASN  47           HA       ASN  47  -8.439  -7.459   2.284
  353    HB2  ASN  47           1HB      ASN  47  -6.450  -7.341   4.562
  354    HB3  ASN  47           2HB      ASN  47  -8.171  -7.670   4.743
  355   HD21  ASN  47          1HD2      ASN  47  -8.905  -9.465   3.120
  356   HD22  ASN  47          2HD2      ASN  47  -7.928 -10.890   3.147
  357    HA   PRO  48           HA       PRO  48  -8.665  -2.947   2.515
  358    HB2  PRO  48           1HB      PRO  48 -11.300  -2.836   1.869
  359    HB3  PRO  48           2HB      PRO  48 -10.022  -3.016   0.662
  360    HG2  PRO  48           1HG      PRO  48 -11.791  -5.105   1.873
  361    HG3  PRO  48           2HG      PRO  48 -11.301  -4.897   0.181
  362    HD2  PRO  48           1HD      PRO  48 -10.137  -6.709   1.823
  363    HD3  PRO  48           2HD      PRO  48  -9.249  -5.890   0.522
  364    H    GLU  49           H        GLU  49  -9.640  -5.322   4.541
  365    HA   GLU  49           HA       GLU  49 -11.669  -4.046   6.065
  366    HB2  GLU  49           1HB      GLU  49  -9.722  -6.220   6.857
  367    HB3  GLU  49           2HB      GLU  49 -11.140  -5.745   7.781
  368    HG2  GLU  49           1HG      GLU  49 -11.516  -6.552   4.949
  369    HG3  GLU  49           2HG      GLU  49 -11.175  -7.804   6.142
  370    H    THR  50           H        THR  50 -10.982  -1.939   6.484
  371    HA   THR  50           HA       THR  50  -8.545  -1.112   7.494
  372    HB   THR  50           HB       THR  50 -11.253   0.059   8.164
  373    HG1  THR  50           HG1      THR  50 -11.059   1.175   6.295
  374   HG21  THR  50          3HG2      THR  50  -9.035   0.717   9.444
  375   HG22  THR  50          1HG2      THR  50 -10.203   1.941   8.951
  376   HG23  THR  50          2HG2      THR  50  -8.752   1.668   7.986
  377    H    SER  51           H        SER  51  -7.558  -1.160   9.428
  378    HA   SER  51           HA       SER  51  -8.738  -2.764  11.523
  379    HB2  SER  51           1HB      SER  51  -6.592  -2.836  12.491
  380    HB3  SER  51           2HB      SER  51  -6.276  -2.808  10.756
  381    HG   SER  51           HG       SER  51  -5.773  -0.639  10.905
  382    H    GLY  52           H        GLY  52  -9.293  -2.096  13.574
  383    HA2  GLY  52           1HA      GLY  52  -9.409   0.832  13.965
  384    HA3  GLY  52           2HA      GLY  52 -10.693  -0.256  14.470
  385    HA   PRO  53           HA       PRO  53  -6.892  -0.893  17.436
  386    HB2  PRO  53           1HB      PRO  53  -5.119   1.163  17.469
  387    HB3  PRO  53           2HB      PRO  53  -4.942  -0.241  16.410
  388    HG2  PRO  53           1HG      PRO  53  -6.025   2.479  15.785
  389    HG3  PRO  53           2HG      PRO  53  -4.930   1.463  14.829
  390    HD2  PRO  53           1HD      PRO  53  -7.579   1.652  14.297
  391    HD3  PRO  53           2HD      PRO  53  -6.649   0.168  14.003
  392    H    SER  54           H        SER  54  -7.577   2.571  16.899
  393    HA   SER  54           HA       SER  54  -9.066   2.733  19.358
  394    HB2  SER  54           1HB      SER  54  -6.847   2.948  20.294
  395    HB3  SER  54           2HB      SER  54  -6.412   4.162  19.092
  396    HG   SER  54           HG       SER  54  -7.036   5.002  21.193
  397    H    SER  55           H        SER  55 -10.499   4.396  19.340
  398    HA   SER  55           HA       SER  55 -10.158   6.583  17.446
  399    HB2  SER  55           1HB      SER  55 -12.375   6.246  16.444
  400    HB3  SER  55           2HB      SER  55 -11.338   4.849  16.155
  401    HG   SER  55           HG       SER  55 -12.392   3.844  17.956
  402    H    GLY  56           H        GLY  56 -10.888   8.458  18.246
  403    HA2  GLY  56           1HA      GLY  56 -12.441   9.828  19.410
  404    HA3  GLY  56           2HA      GLY  56 -12.958   8.419  20.323
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1  -9.868  41.847  11.906
    2    HA2  GLY   1           1HA      GLY   1  -7.598  40.836  12.578
    3    HA3  GLY   1           2HA      GLY   1  -8.430  41.776  13.808
    4    H    SER   2           H        SER   2  -8.387  38.455  12.513
    5    HA   SER   2           HA       SER   2  -8.262  37.468  15.272
    6    HB2  SER   2           1HB      SER   2 -10.177  36.434  13.166
    7    HB3  SER   2           2HB      SER   2  -9.929  35.718  14.758
    8    HG   SER   2           HG       SER   2 -11.542  37.026  15.211
    9    H    SER   3           H        SER   3  -7.177  35.524  15.541
   10    HA   SER   3           HA       SER   3  -5.632  34.653  13.195
   11    HB2  SER   3           1HB      SER   3  -4.337  35.543  15.126
   12    HB3  SER   3           2HB      SER   3  -4.991  34.246  16.126
   13    HG   SER   3           HG       SER   3  -3.473  33.861  13.758
   14    H    GLY   4           H        GLY   4  -5.494  32.504  12.637
   15    HA2  GLY   4           1HA      GLY   4  -7.331  30.696  14.086
   16    HA3  GLY   4           2HA      GLY   4  -7.149  30.683  12.339
   17    H    SER   5           H        SER   5  -6.847  28.315  13.227
   18    HA   SER   5           HA       SER   5  -3.943  27.888  13.496
   19    HB2  SER   5           1HB      SER   5  -4.920  27.252  15.588
   20    HB3  SER   5           2HB      SER   5  -6.215  26.365  14.784
   21    HG   SER   5           HG       SER   5  -3.771  25.510  15.496
   22    H    SER   6           H        SER   6  -3.528  27.539  11.346
   23    HA   SER   6           HA       SER   6  -5.082  25.504   9.932
   24    HB2  SER   6           1HB      SER   6  -3.724  26.258   7.946
   25    HB3  SER   6           2HB      SER   6  -4.737  27.512   8.661
   26    HG   SER   6           HG       SER   6  -2.290  27.821   8.162
   27    H    GLY   7           H        GLY   7  -4.431  23.476  10.235
   28    HA2  GLY   7           1HA      GLY   7  -1.969  22.500   9.381
   29    HA3  GLY   7           2HA      GLY   7  -1.838  22.748  11.116
   30    H    LEU   8           H        LEU   8  -2.515  20.511   8.814
   31    HA   LEU   8           HA       LEU   8  -4.531  19.071  10.354
   32    HB2  LEU   8           1HB      LEU   8  -4.843  17.711   8.494
   33    HB3  LEU   8           2HB      LEU   8  -4.535  19.307   7.812
   34    HG   LEU   8           HG       LEU   8  -2.333  17.288   8.080
   35   HD11  LEU   8          1HD1      LEU   8  -2.905  16.170   6.193
   36   HD12  LEU   8          2HD1      LEU   8  -3.748  17.551   5.494
   37   HD13  LEU   8          3HD1      LEU   8  -4.528  16.584   6.745
   38   HD21  LEU   8          3HD2      LEU   8  -1.394  19.308   7.517
   39   HD22  LEU   8          1HD2      LEU   8  -2.807  19.834   6.603
   40   HD23  LEU   8          2HD2      LEU   8  -1.714  18.631   5.919
   41    H    LYS   9           H        LYS   9  -4.172  16.672  10.628
   42    HA   LYS   9           HA       LYS   9  -1.376  16.151  11.402
   43    HB2  LYS   9           1HB      LYS   9  -2.189  14.834  13.273
   44    HB3  LYS   9           2HB      LYS   9  -2.856  16.459  13.354
   45    HG2  LYS   9           1HG      LYS   9  -4.735  15.274  13.802
   46    HG3  LYS   9           2HG      LYS   9  -4.847  15.312  12.041
   47    HD2  LYS   9           1HD      LYS   9  -3.743  13.106  11.953
   48    HD3  LYS   9           2HD      LYS   9  -3.719  13.069  13.718
   49    HE2  LYS   9           1HE      LYS   9  -6.259  13.400  12.143
   50    HE3  LYS   9           2HE      LYS   9  -5.607  11.816  12.561
   51    HZ1  LYS   9           3HZ      LYS   9  -5.719  13.553  14.821
   52    HZ2  LYS   9           1HZ      LYS   9  -6.368  12.003  14.624
   53    HZ3  LYS   9           2HZ      LYS   9  -7.244  13.358  14.116
   54    H    CYS  10           H        CYS  10  -0.641  13.973  11.240
   55    HA   CYS  10           HA       CYS  10  -2.227  11.901  10.123
   56    HB2  CYS  10           1HB      CYS  10  -1.975  13.358   8.120
   57    HB3  CYS  10           2HB      CYS  10  -0.229  13.177   8.244
   58    HG   CYS  10           HG       CYS  10  -1.088  11.561   6.158
   59    H    SER  11           H        SER  11  -1.261   9.952  10.388
   60    HA   SER  11           HA       SER  11   1.303   9.940  11.742
   61    HB2  SER  11           1HB      SER  11  -0.844   8.542  12.315
   62    HB3  SER  11           2HB      SER  11  -0.223   7.445  11.082
   63    HG   SER  11           HG       SER  11   0.803   6.715  12.808
   64    H    THR  12           H        THR  12   3.192   9.404  10.859
   65    HA   THR  12           HA       THR  12   3.451   9.023   8.065
   66    HB   THR  12           HB       THR  12   5.224  10.098   9.345
   67    HG1  THR  12           HG1      THR  12   6.988   8.769   8.506
   68   HG21  THR  12          3HG2      THR  12   5.904   9.284  11.303
   69   HG22  THR  12          1HG2      THR  12   6.547   7.857  10.491
   70   HG23  THR  12          2HG2      THR  12   4.883   7.865  11.075
   71    H    VAL  13           H        VAL  13   3.594   7.227   6.857
   72    HA   VAL  13           HA       VAL  13   3.898   4.637   8.216
   73    HB   VAL  13           HB       VAL  13   1.493   5.079   7.665
   74   HG11  VAL  13          1HG1      VAL  13   0.963   5.941   5.690
   75   HG12  VAL  13          2HG1      VAL  13   2.635   5.792   5.145
   76   HG13  VAL  13          3HG1      VAL  13   1.510   4.453   4.916
   77   HG21  VAL  13          3HG2      VAL  13   3.040   2.768   6.588
   78   HG22  VAL  13          1HG2      VAL  13   1.900   2.833   7.933
   79   HG23  VAL  13          2HG2      VAL  13   1.308   2.864   6.272
   80    H    VAL  14           H        VAL  14   4.878   2.996   7.002
   81    HA   VAL  14           HA       VAL  14   6.109   3.869   4.469
   82    HB   VAL  14           HB       VAL  14   8.109   2.551   5.054
   83   HG11  VAL  14          1HG1      VAL  14   8.983   4.431   5.850
   84   HG12  VAL  14          2HG1      VAL  14   7.344   5.051   6.060
   85   HG13  VAL  14          3HG1      VAL  14   8.152   4.222   7.391
   86   HG21  VAL  14          3HG2      VAL  14   7.135   2.393   7.879
   87   HG22  VAL  14          1HG2      VAL  14   6.730   1.125   6.722
   88   HG23  VAL  14          2HG2      VAL  14   8.418   1.479   7.087
   89    H    CYS  15           H        CYS  15   6.598   2.199   2.951
   90    HA   CYS  15           HA       CYS  15   4.684   0.491   2.231
   91    HB2  CYS  15           1HB      CYS  15   6.877   0.892   1.042
   92    HB3  CYS  15           2HB      CYS  15   7.586  -0.334   2.088
   93    H    VAL  16           H        VAL  16   3.644  -1.183   3.074
   94    HA   VAL  16           HA       VAL  16   4.521  -2.381   5.529
   95    HB   VAL  16           HB       VAL  16   2.477  -3.700   5.420
   96   HG11  VAL  16          1HG1      VAL  16   1.297  -1.204   4.519
   97   HG12  VAL  16          2HG1      VAL  16   1.271  -1.957   6.115
   98   HG13  VAL  16          3HG1      VAL  16   2.639  -0.951   5.634
   99   HG21  VAL  16          3HG2      VAL  16   2.483  -2.771   2.589
  100   HG22  VAL  16          1HG2      VAL  16   2.105  -4.360   3.255
  101   HG23  VAL  16          2HG2      VAL  16   0.936  -3.047   3.390
  102    H    ILE  17           H        ILE  17   5.853  -2.799   2.730
  103    HA   ILE  17           HA       ILE  17   6.034  -5.734   2.937
  104    HB   ILE  17           HB       ILE  17   6.555  -4.063   0.476
  105   HG12  ILE  17          1HG1      ILE  17   4.168  -4.077   1.087
  106   HG13  ILE  17          2HG1      ILE  17   4.461  -4.986  -0.391
  107   HG21  ILE  17          1HG2      ILE  17   6.471  -7.043   0.921
  108   HG22  ILE  17          2HG2      ILE  17   6.543  -6.270  -0.662
  109   HG23  ILE  17          3HG2      ILE  17   7.874  -6.071   0.478
  110   HD11  ILE  17          3HD1      ILE  17   3.383  -6.690   0.503
  111   HD12  ILE  17          1HD1      ILE  17   4.656  -6.826   1.716
  112   HD13  ILE  17          2HD1      ILE  17   3.232  -5.835   2.038
  113    H    CYS  18           H        CYS  18   7.939  -2.972   1.713
  114    HA   CYS  18           HA       CYS  18  10.362  -4.311   2.701
  115    HB2  CYS  18           1HB      CYS  18  11.608  -2.961   1.127
  116    HB3  CYS  18           2HB      CYS  18  10.280  -3.747   0.279
  117    H    LEU  19           H        LEU  19   8.286  -1.656   3.232
  118    HA   LEU  19           HA       LEU  19   8.270  -0.046   4.845
  119    HB2  LEU  19           1HB      LEU  19  10.908  -1.134   5.796
  120    HB3  LEU  19           2HB      LEU  19   9.740  -0.180   6.709
  121    HG   LEU  19           HG       LEU  19   8.915  -2.856   5.685
  122   HD11  LEU  19          1HD1      LEU  19  10.563  -2.455   8.176
  123   HD12  LEU  19          2HD1      LEU  19  11.133  -3.215   6.691
  124   HD13  LEU  19          3HD1      LEU  19   9.837  -3.964   7.623
  125   HD21  LEU  19          3HD2      LEU  19   7.125  -2.069   6.790
  126   HD22  LEU  19          1HD2      LEU  19   8.075  -0.894   7.700
  127   HD23  LEU  19          2HD2      LEU  19   8.011  -2.575   8.230
  128    H    GLU  20           H        GLU  20   8.969   0.841   2.479
  129    HA   GLU  20           HA       GLU  20  11.159   2.719   3.041
  130    HB2  GLU  20           1HB      GLU  20  10.674   1.300   0.416
  131    HB3  GLU  20           2HB      GLU  20  11.841   2.591   0.664
  132    HG2  GLU  20           1HG      GLU  20  12.827   1.059   2.480
  133    HG3  GLU  20           2HG      GLU  20  11.890  -0.214   1.699
  134    H    LYS  21           H        LYS  21  11.028   4.730   1.858
  135    HA   LYS  21           HA       LYS  21   8.723   6.105   2.026
  136    HB2  LYS  21           1HB      LYS  21  11.082   6.376   0.231
  137    HB3  LYS  21           2HB      LYS  21   9.672   7.364  -0.130
  138    HG2  LYS  21           1HG      LYS  21   9.808   8.511   1.899
  139    HG3  LYS  21           2HG      LYS  21  10.870   7.296   2.616
  140    HD2  LYS  21           1HD      LYS  21  11.681   8.966   0.248
  141    HD3  LYS  21           2HD      LYS  21  11.954   9.483   1.913
  142    HE2  LYS  21           1HE      LYS  21  12.951   6.894   0.731
  143    HE3  LYS  21           2HE      LYS  21  13.915   8.362   0.882
  144    HZ1  LYS  21           3HZ      LYS  21  13.790   6.423   2.734
  145    HZ2  LYS  21           1HZ      LYS  21  12.638   7.511   3.327
  146    HZ3  LYS  21           2HZ      LYS  21  14.226   8.025   3.058
  147    HA   PRO  22           HA       PRO  22   6.265   3.769  -0.981
  148    HB2  PRO  22           1HB      PRO  22   3.880   4.601   0.012
  149    HB3  PRO  22           2HB      PRO  22   4.807   3.275   0.724
  150    HG2  PRO  22           1HG      PRO  22   4.632   6.138   1.580
  151    HG3  PRO  22           2HG      PRO  22   4.608   4.670   2.574
  152    HD2  PRO  22           1HD      PRO  22   6.828   6.191   2.277
  153    HD3  PRO  22           2HD      PRO  22   6.899   4.432   2.501
  154    H    LYS  23           H        LYS  23   6.068   4.585  -2.962
  155    HA   LYS  23           HA       LYS  23   5.700   7.414  -3.396
  156    HB2  LYS  23           1HB      LYS  23   5.882   5.118  -5.356
  157    HB3  LYS  23           2HB      LYS  23   5.867   6.821  -5.793
  158    HG2  LYS  23           1HG      LYS  23   7.934   7.049  -4.324
  159    HG3  LYS  23           2HG      LYS  23   7.996   5.285  -4.343
  160    HD2  LYS  23           1HD      LYS  23   9.410   5.986  -6.094
  161    HD3  LYS  23           2HD      LYS  23   7.919   5.458  -6.877
  162    HE2  LYS  23           1HE      LYS  23   8.595   7.506  -7.899
  163    HE3  LYS  23           2HE      LYS  23   7.181   7.844  -6.903
  164    HZ1  LYS  23           3HZ      LYS  23   8.637   9.560  -6.408
  165    HZ2  LYS  23           1HZ      LYS  23  10.000   8.557  -6.402
  166    HZ3  LYS  23           2HZ      LYS  23   8.888   8.481  -5.129
  167    H    TYR  24           H        TYR  24   3.816   4.461  -3.815
  168    HA   TYR  24           HA       TYR  24   1.419   6.127  -4.146
  169    HB2  TYR  24           1HB      TYR  24   1.598   3.536  -5.625
  170    HB3  TYR  24           2HB      TYR  24   0.638   4.966  -5.988
  171    HD1  TYR  24           HD1      TYR  24   3.997   3.468  -6.210
  172    HD2  TYR  24           HD2      TYR  24   1.521   6.740  -7.333
  173    HE1  TYR  24           HE1      TYR  24   5.689   4.178  -7.848
  174    HE2  TYR  24           HE2      TYR  24   3.205   7.459  -8.975
  175    HH   TYR  24           HH       TYR  24   5.989   7.003  -9.073
  176    H    ARG  25           H        ARG  25  -0.612   4.807  -3.789
  177    HA   ARG  25           HA       ARG  25  -0.159   2.726  -1.755
  178    HB2  ARG  25           1HB      ARG  25  -1.842   5.188  -1.625
  179    HB3  ARG  25           2HB      ARG  25  -2.417   3.738  -0.813
  180    HG2  ARG  25           1HG      ARG  25  -0.320   3.640   0.462
  181    HG3  ARG  25           2HG      ARG  25   0.210   5.127  -0.326
  182    HD2  ARG  25           1HD      ARG  25  -2.405   5.034   1.123
  183    HD3  ARG  25           2HD      ARG  25  -0.901   5.238   2.020
  184    HE   ARG  25           HE       ARG  25  -1.167   7.069  -0.170
  185   HH11  ARG  25          2HH1      ARG  25  -1.993   6.476   3.159
  186   HH12  ARG  25          1HH1      ARG  25  -2.194   8.153   3.544
  187   HH21  ARG  25          2HH2      ARG  25  -1.430   9.281   0.324
  188   HH22  ARG  25          1HH2      ARG  25  -1.875   9.747   1.931
  189    H    CYS  26           H        CYS  26  -2.059   1.319  -1.401
  190    HA   CYS  26           HA       CYS  26  -3.091   0.409  -3.907
  191    HB2  CYS  26           1HB      CYS  26  -2.517  -1.201  -2.186
  192    HB3  CYS  26           2HB      CYS  26  -3.666  -0.469  -1.071
  193    HA   PRO  27           HA       PRO  27  -6.699   3.009  -3.875
  194    HB2  PRO  27           1HB      PRO  27  -7.835   1.951  -6.102
  195    HB3  PRO  27           2HB      PRO  27  -6.474   3.079  -6.160
  196    HG2  PRO  27           1HG      PRO  27  -6.471   0.093  -6.382
  197    HG3  PRO  27           2HG      PRO  27  -5.566   1.287  -7.331
  198    HD2  PRO  27           1HD      PRO  27  -4.448  -0.107  -5.296
  199    HD3  PRO  27           2HD      PRO  27  -3.959   1.551  -5.701
  200    H    ALA  28           H        ALA  28  -6.465  -0.021  -2.809
  201    HA   ALA  28           HA       ALA  28  -9.374  -0.476  -2.716
  202    HB1  ALA  28           3HB      ALA  28  -7.645  -2.222  -3.673
  203    HB2  ALA  28           1HB      ALA  28  -7.455  -2.620  -1.965
  204    HB3  ALA  28           2HB      ALA  28  -9.041  -2.737  -2.728
  205    H    CYS  29           H        CYS  29  -6.530  -1.257  -0.701
  206    HA   CYS  29           HA       CYS  29  -8.160  -0.748   1.681
  207    HB2  CYS  29           1HB      CYS  29  -6.168  -1.834   2.856
  208    HB3  CYS  29           2HB      CYS  29  -7.138  -2.873   1.818
  209    H    ARG  30           H        ARG  30  -5.763   0.682  -0.231
  210    HA   ARG  30           HA       ARG  30  -4.673   2.678  -0.053
  211    HB2  ARG  30           1HB      ARG  30  -5.955   2.993   2.662
  212    HB3  ARG  30           2HB      ARG  30  -5.296   4.260   1.636
  213    HG2  ARG  30           1HG      ARG  30  -7.633   2.561   0.816
  214    HG3  ARG  30           2HG      ARG  30  -7.809   4.070   1.714
  215    HD2  ARG  30           1HD      ARG  30  -6.331   3.862  -0.901
  216    HD3  ARG  30           2HD      ARG  30  -8.048   4.246  -0.791
  217    HE   ARG  30           HE       ARG  30  -6.716   6.020   0.872
  218   HH11  ARG  30          2HH1      ARG  30  -6.823   5.238  -2.519
  219   HH12  ARG  30          1HH1      ARG  30  -6.428   6.844  -3.035
  220   HH21  ARG  30          2HH2      ARG  30  -6.195   8.138   0.205
  221   HH22  ARG  30          1HH2      ARG  30  -6.070   8.493  -1.485
  222    H    VAL  31           H        VAL  31  -3.140   0.602   0.377
  223    HA   VAL  31           HA       VAL  31  -1.696   1.062   2.897
  224    HB   VAL  31           HB       VAL  31  -0.554  -1.100   2.396
  225   HG11  VAL  31          1HG1      VAL  31  -3.563  -1.134   2.595
  226   HG12  VAL  31          2HG1      VAL  31  -2.521  -2.522   2.918
  227   HG13  VAL  31          3HG1      VAL  31  -2.409  -1.080   3.927
  228   HG21  VAL  31          3HG2      VAL  31  -1.856  -0.737  -0.120
  229   HG22  VAL  31          1HG2      VAL  31  -0.691  -1.971   0.359
  230   HG23  VAL  31          2HG2      VAL  31  -2.415  -2.243   0.608
  231    HA   PRO  32           HA       PRO  32   1.669   2.960   0.799
  232    HB2  PRO  32           1HB      PRO  32   3.699   2.303   2.477
  233    HB3  PRO  32           2HB      PRO  32   2.473   3.511   2.880
  234    HG2  PRO  32           1HG      PRO  32   2.651   0.641   3.714
  235    HG3  PRO  32           2HG      PRO  32   2.225   2.064   4.683
  236    HD2  PRO  32           1HD      PRO  32   0.364   0.366   3.691
  237    HD3  PRO  32           2HD      PRO  32   0.056   2.101   3.902
  238    H    TYR  33           H        TYR  33   2.732   2.330  -0.963
  239    HA   TYR  33           HA       TYR  33   4.357  -0.074  -0.930
  240    HB2  TYR  33           1HB      TYR  33   3.210  -1.310  -2.470
  241    HB3  TYR  33           2HB      TYR  33   1.843  -0.459  -1.759
  242    HD1  TYR  33           HD2      TYR  33   4.331  -0.104  -4.522
  243    HD2  TYR  33           HD1      TYR  33   0.371   0.647  -3.160
  244    HE1  TYR  33           HE2      TYR  33   3.745   0.792  -6.737
  245    HE2  TYR  33           HE1      TYR  33  -0.226   1.544  -5.371
  246    HH   TYR  33           HH       TYR  33   0.602   2.261  -7.352
  247    H    CYS  34           H        CYS  34   6.226   0.395  -1.864
  248    HA   CYS  34           HA       CYS  34   6.739   2.830  -3.167
  249    HB2  CYS  34           1HB      CYS  34   8.893   1.556  -3.891
  250    HB3  CYS  34           2HB      CYS  34   8.621   1.883  -2.182
  251    H    SER  35           H        SER  35   7.209  -0.367  -4.658
  252    HA   SER  35           HA       SER  35   6.154   0.760  -7.170
  253    HB2  SER  35           1HB      SER  35   8.415  -1.173  -6.679
  254    HB3  SER  35           2HB      SER  35   7.639  -1.034  -8.256
  255    HG   SER  35           HG       SER  35   8.574   0.840  -8.558
  256    H    VAL  36           H        VAL  36   5.540  -1.142  -8.725
  257    HA   VAL  36           HA       VAL  36   3.251  -2.358  -7.767
  258    HB   VAL  36           HB       VAL  36   4.989  -3.328 -10.041
  259   HG11  VAL  36          1HG1      VAL  36   2.079  -3.835  -9.430
  260   HG12  VAL  36          2HG1      VAL  36   2.916  -4.327 -10.904
  261   HG13  VAL  36          3HG1      VAL  36   3.385  -5.016  -9.349
  262   HG21  VAL  36          3HG2      VAL  36   3.665  -0.897  -9.765
  263   HG22  VAL  36          1HG2      VAL  36   4.268  -1.611 -11.261
  264   HG23  VAL  36          2HG2      VAL  36   2.596  -1.878 -10.768
  265    H    VAL  37           H        VAL  37   6.441  -3.865  -8.270
  266    HA   VAL  37           HA       VAL  37   6.129  -6.421  -7.621
  267    HB   VAL  37           HB       VAL  37   8.215  -4.653  -6.336
  268   HG11  VAL  37          1HG1      VAL  37   7.815  -7.592  -6.409
  269   HG12  VAL  37          2HG1      VAL  37   9.462  -6.982  -6.578
  270   HG13  VAL  37          3HG1      VAL  37   8.512  -6.574  -5.149
  271   HG21  VAL  37          3HG2      VAL  37   7.794  -5.531  -9.053
  272   HG22  VAL  37          1HG2      VAL  37   8.975  -4.390  -8.411
  273   HG23  VAL  37          2HG2      VAL  37   9.335  -6.116  -8.427
  274    H    CYS  38           H        CYS  38   6.772  -4.108  -4.980
  275    HA   CYS  38           HA       CYS  38   6.120  -5.765  -2.872
  276    HB2  CYS  38           1HB      CYS  38   6.163  -2.809  -3.255
  277    HB3  CYS  38           2HB      CYS  38   5.396  -3.437  -1.801
  278    H    PHE  39           H        PHE  39   3.997  -3.791  -4.873
  279    HA   PHE  39           HA       PHE  39   1.655  -4.139  -3.324
  280    HB2  PHE  39           1HB      PHE  39   1.792  -2.345  -4.943
  281    HB3  PHE  39           2HB      PHE  39   2.012  -3.496  -6.257
  282    HD1  PHE  39           HD1      PHE  39  -0.416  -3.132  -3.441
  283    HD2  PHE  39           HD2      PHE  39   0.186  -3.624  -7.626
  284    HE1  PHE  39           HE1      PHE  39  -2.852  -3.203  -3.780
  285    HE2  PHE  39           HE2      PHE  39  -2.249  -3.694  -7.971
  286    HZ   PHE  39           HZ       PHE  39  -3.771  -3.483  -6.047
  287    H    ARG  40           H        ARG  40   3.100  -5.973  -5.958
  288    HA   ARG  40           HA       ARG  40   1.028  -7.650  -6.657
  289    HB2  ARG  40           1HB      ARG  40   3.943  -8.407  -6.380
  290    HB3  ARG  40           2HB      ARG  40   2.740  -9.272  -7.327
  291    HG2  ARG  40           1HG      ARG  40   2.463  -7.287  -8.751
  292    HG3  ARG  40           2HG      ARG  40   3.720  -6.468  -7.822
  293    HD2  ARG  40           1HD      ARG  40   5.301  -8.260  -8.454
  294    HD3  ARG  40           2HD      ARG  40   4.039  -8.989  -9.447
  295    HE   ARG  40           HE       ARG  40   5.544  -6.570 -10.025
  296   HH11  ARG  40          2HH1      ARG  40   2.879  -8.656 -10.842
  297   HH12  ARG  40          1HH1      ARG  40   2.725  -8.044 -12.456
  298   HH21  ARG  40          2HH2      ARG  40   5.352  -5.757 -12.148
  299   HH22  ARG  40          1HH2      ARG  40   4.133  -6.396 -13.198
  300    H    LYS  41           H        LYS  41   3.610  -8.597  -4.384
  301    HA   LYS  41           HA       LYS  41   2.495 -10.876  -3.375
  302    HB2  LYS  41           1HB      LYS  41   4.075  -8.797  -1.852
  303    HB3  LYS  41           2HB      LYS  41   3.788 -10.442  -1.300
  304    HG2  LYS  41           1HG      LYS  41   5.067 -11.345  -3.103
  305    HG3  LYS  41           2HG      LYS  41   5.204  -9.759  -3.866
  306    HD2  LYS  41           1HD      LYS  41   6.578  -8.947  -2.079
  307    HD3  LYS  41           2HD      LYS  41   6.299 -10.410  -1.133
  308    HE2  LYS  41           1HE      LYS  41   8.483 -10.525  -2.139
  309    HE3  LYS  41           2HE      LYS  41   7.433 -11.719  -2.901
  310    HZ1  LYS  41           3HZ      LYS  41   7.138 -10.254  -4.771
  311    HZ2  LYS  41           1HZ      LYS  41   8.792 -10.491  -4.508
  312    HZ3  LYS  41           2HZ      LYS  41   8.058  -9.044  -4.030
  313    H    HIS  42           H        HIS  42   1.799  -7.553  -2.413
  314    HA   HIS  42           HA       HIS  42   0.166  -8.155  -0.197
  315    HB2  HIS  42           1HB      HIS  42   0.777  -5.937  -0.198
  316    HB3  HIS  42           2HB      HIS  42   0.587  -5.774  -1.941
  317    HD1  HIS  42           HD1      HIS  42  -1.543  -6.018   1.185
  318    HD2  HIS  42           HD2      HIS  42  -1.756  -4.625  -2.724
  319    HE1  HIS  42           HE1      HIS  42  -3.737  -4.799   1.024
  320    H    LYS  43           H        LYS  43  -0.870  -7.013  -3.416
  321    HA   LYS  43           HA       LYS  43  -3.531  -7.276  -3.306
  322    HB2  LYS  43           1HB      LYS  43  -2.292  -6.648  -5.342
  323    HB3  LYS  43           2HB      LYS  43  -1.834  -8.329  -5.578
  324    HG2  LYS  43           1HG      LYS  43  -3.627  -7.953  -7.039
  325    HG3  LYS  43           2HG      LYS  43  -4.311  -8.846  -5.679
  326    HD2  LYS  43           1HD      LYS  43  -5.189  -6.798  -4.732
  327    HD3  LYS  43           2HD      LYS  43  -4.420  -5.847  -6.005
  328    HE2  LYS  43           1HE      LYS  43  -5.838  -6.793  -7.670
  329    HE3  LYS  43           2HE      LYS  43  -6.465  -7.992  -6.540
  330    HZ1  LYS  43           3HZ      LYS  43  -8.133  -6.501  -6.396
  331    HZ2  LYS  43           1HZ      LYS  43  -7.170  -5.186  -6.849
  332    HZ3  LYS  43           2HZ      LYS  43  -7.113  -5.769  -5.263
  333    H    GLU  44           H        GLU  44  -1.254  -9.947  -3.431
  334    HA   GLU  44           HA       GLU  44  -2.793 -12.100  -4.044
  335    HB2  GLU  44           1HB      GLU  44  -0.791 -11.943  -1.785
  336    HB3  GLU  44           2HB      GLU  44  -1.379 -13.428  -2.518
  337    HG2  GLU  44           1HG      GLU  44   0.141 -11.275  -3.970
  338    HG3  GLU  44           2HG      GLU  44   0.845 -12.759  -3.329
  339    H    GLN  45           H        GLN  45  -2.590 -10.552  -0.852
  340    HA   GLN  45           HA       GLN  45  -5.127 -11.878  -0.155
  341    HB2  GLN  45           1HB      GLN  45  -2.931 -11.160   1.790
  342    HB3  GLN  45           2HB      GLN  45  -4.408 -12.048   2.141
  343    HG2  GLN  45           1HG      GLN  45  -2.594 -13.160   0.078
  344    HG3  GLN  45           2HG      GLN  45  -2.080 -13.250   1.762
  345   HE21  GLN  45          1HE2      GLN  45  -3.182 -15.169  -0.401
  346   HE22  GLN  45          2HE2      GLN  45  -4.342 -16.106   0.472
  347    H    CYS  46           H        CYS  46  -4.283  -9.144  -1.256
  348    HA   CYS  46           HA       CYS  46  -4.594  -7.095   0.536
  349    HB2  CYS  46           1HB      CYS  46  -4.133  -6.408  -1.638
  350    HB3  CYS  46           2HB      CYS  46  -5.402  -7.412  -2.332
  351    H    ASN  47           H        ASN  47  -6.064  -6.880   2.085
  352    HA   ASN  47           HA       ASN  47  -8.864  -7.560   1.467
  353    HB2  ASN  47           1HB      ASN  47  -7.460  -8.770   3.362
  354    HB3  ASN  47           2HB      ASN  47  -7.906  -7.339   4.288
  355   HD21  ASN  47          1HD2      ASN  47  -9.568  -9.406   1.927
  356   HD22  ASN  47          2HD2      ASN  47 -10.954  -9.706   2.914
  357    HA   PRO  48           HA       PRO  48  -9.122  -3.058   1.879
  358    HB2  PRO  48           1HB      PRO  48 -11.525  -2.873   0.630
  359    HB3  PRO  48           2HB      PRO  48  -9.995  -3.006  -0.245
  360    HG2  PRO  48           1HG      PRO  48 -12.006  -5.131   0.388
  361    HG3  PRO  48           2HG      PRO  48 -11.125  -4.839  -1.123
  362    HD2  PRO  48           1HD      PRO  48 -10.391  -6.755   0.645
  363    HD3  PRO  48           2HD      PRO  48  -9.216  -5.879  -0.358
  364    H    GLU  49           H        GLU  49 -11.203  -1.701   2.506
  365    HA   GLU  49           HA       GLU  49 -12.203  -2.912   4.974
  366    HB2  GLU  49           1HB      GLU  49 -11.268  -0.837   5.473
  367    HB3  GLU  49           2HB      GLU  49 -11.887  -0.094   4.005
  368    HG2  GLU  49           1HG      GLU  49 -13.943   0.307   4.903
  369    HG3  GLU  49           2HG      GLU  49 -13.844  -1.052   6.021
  370    H    THR  50           H        THR  50 -13.506  -0.796   2.412
  371    HA   THR  50           HA       THR  50 -16.214  -1.368   3.037
  372    HB   THR  50           HB       THR  50 -16.770  -0.222   0.948
  373    HG1  THR  50           HG1      THR  50 -14.249  -0.981   0.289
  374   HG21  THR  50          3HG2      THR  50 -15.415   1.911   1.375
  375   HG22  THR  50          1HG2      THR  50 -14.639   1.009   2.676
  376   HG23  THR  50          2HG2      THR  50 -16.381   1.283   2.710
  377    H    SER  51           H        SER  51 -17.733  -2.608   1.895
  378    HA   SER  51           HA       SER  51 -16.891  -4.349  -0.243
  379    HB2  SER  51           1HB      SER  51 -17.459  -5.431   2.516
  380    HB3  SER  51           2HB      SER  51 -17.600  -6.425   1.066
  381    HG   SER  51           HG       SER  51 -15.438  -6.000   2.425
  382    H    GLY  52           H        GLY  52 -18.545  -4.255  -1.603
  383    HA2  GLY  52           1HA      GLY  52 -20.836  -5.091  -1.985
  384    HA3  GLY  52           2HA      GLY  52 -21.277  -4.308  -0.475
  385    HA   PRO  53           HA       PRO  53 -21.816  -1.502  -4.297
  386    HB2  PRO  53           1HB      PRO  53 -24.505  -1.723  -4.600
  387    HB3  PRO  53           2HB      PRO  53 -23.355  -2.772  -5.436
  388    HG2  PRO  53           1HG      PRO  53 -24.947  -3.304  -2.958
  389    HG3  PRO  53           2HG      PRO  53 -24.638  -4.372  -4.339
  390    HD2  PRO  53           1HD      PRO  53 -23.274  -4.574  -2.009
  391    HD3  PRO  53           2HD      PRO  53 -22.541  -4.956  -3.580
  392    H    SER  54           H        SER  54 -22.291  -1.582  -1.141
  393    HA   SER  54           HA       SER  54 -24.231  -0.062  -0.177
  394    HB2  SER  54           1HB      SER  54 -22.779   0.769   1.493
  395    HB3  SER  54           2HB      SER  54 -22.042  -0.748   0.977
  396    HG   SER  54           HG       SER  54 -21.083   1.793   0.809
  397    H    SER  55           H        SER  55 -25.238   1.755  -0.695
  398    HA   SER  55           HA       SER  55 -24.028   3.576  -2.607
  399    HB2  SER  55           1HB      SER  55 -26.793   3.199  -1.504
  400    HB3  SER  55           2HB      SER  55 -26.369   4.706  -2.316
  401    HG   SER  55           HG       SER  55 -25.788   2.241  -3.535
  402    H    GLY  56           H        GLY  56 -25.511   3.788   0.627
  403    HA2  GLY  56           1HA      GLY  56 -23.658   5.387   1.842
  404    HA3  GLY  56           2HA      GLY  56 -24.695   6.518   0.985
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1   0.761  26.478  34.364
    2    HA2  GLY   1           1HA      GLY   1  -0.673  24.873  33.104
    3    HA3  GLY   1           2HA      GLY   1  -1.590  26.279  32.583
    4    H    SER   2           H        SER   2   1.754  25.048  32.574
    5    HA   SER   2           HA       SER   2   2.024  26.132  29.846
    6    HB2  SER   2           1HB      SER   2   4.398  26.498  30.289
    7    HB3  SER   2           2HB      SER   2   3.424  27.350  31.487
    8    HG   SER   2           HG       SER   2   4.913  24.969  31.788
    9    H    SER   3           H        SER   3   1.845  24.454  28.504
   10    HA   SER   3           HA       SER   3   3.657  22.193  28.867
   11    HB2  SER   3           1HB      SER   3   0.693  21.847  28.352
   12    HB3  SER   3           2HB      SER   3   1.890  20.553  28.402
   13    HG   SER   3           HG       SER   3   0.738  20.819  30.389
   14    H    GLY   4           H        GLY   4   4.747  21.902  27.044
   15    HA2  GLY   4           1HA      GLY   4   3.460  21.850  24.484
   16    HA3  GLY   4           2HA      GLY   4   4.434  23.296  24.704
   17    H    SER   5           H        SER   5   4.706  20.930  22.893
   18    HA   SER   5           HA       SER   5   7.550  20.568  23.285
   19    HB2  SER   5           1HB      SER   5   6.281  18.719  24.578
   20    HB3  SER   5           2HB      SER   5   5.903  18.067  22.984
   21    HG   SER   5           HG       SER   5   7.780  17.104  23.579
   22    H    SER   6           H        SER   6   8.516  19.310  21.439
   23    HA   SER   6           HA       SER   6   7.053  19.966  18.972
   24    HB2  SER   6           1HB      SER   6  10.030  19.590  19.384
   25    HB3  SER   6           2HB      SER   6   9.247  20.057  17.875
   26    HG   SER   6           HG       SER   6   9.413  22.020  18.578
   27    H    GLY   7           H        GLY   7   7.211  18.513  17.166
   28    HA2  GLY   7           1HA      GLY   7   7.970  16.352  16.307
   29    HA3  GLY   7           2HA      GLY   7   7.833  15.732  17.945
   30    H    LEU   8           H        LEU   8   5.962  16.984  15.219
   31    HA   LEU   8           HA       LEU   8   3.723  15.288  16.101
   32    HB2  LEU   8           1HB      LEU   8   2.153  16.950  15.298
   33    HB3  LEU   8           2HB      LEU   8   3.200  17.629  16.542
   34    HG   LEU   8           HG       LEU   8   3.798  18.056  13.636
   35   HD11  LEU   8          1HD1      LEU   8   2.590  20.333  14.179
   36   HD12  LEU   8          2HD1      LEU   8   1.665  19.314  15.280
   37   HD13  LEU   8          3HD1      LEU   8   1.697  18.945  13.556
   38   HD21  LEU   8          3HD2      LEU   8   4.972  18.818  16.100
   39   HD22  LEU   8          1HD2      LEU   8   4.324  20.270  15.338
   40   HD23  LEU   8          2HD2      LEU   8   5.470  19.253  14.464
   41    H    LYS   9           H        LYS   9   2.738  14.079  14.556
   42    HA   LYS   9           HA       LYS   9   2.657  12.852  12.627
   43    HB2  LYS   9           1HB      LYS   9   2.647  15.671  11.538
   44    HB3  LYS   9           2HB      LYS   9   2.253  14.246  10.585
   45    HG2  LYS   9           1HG      LYS   9   0.257  13.900  11.677
   46    HG3  LYS   9           2HG      LYS   9   0.773  14.776  13.120
   47    HD2  LYS   9           1HD      LYS   9   0.321  16.835  12.194
   48    HD3  LYS   9           2HD      LYS   9   0.525  16.253  10.540
   49    HE2  LYS   9           1HE      LYS   9  -1.588  14.811  11.127
   50    HE3  LYS   9           2HE      LYS   9  -1.836  16.053  12.353
   51    HZ1  LYS   9           3HZ      LYS   9  -2.378  17.580  10.819
   52    HZ2  LYS   9           1HZ      LYS   9  -2.725  16.239   9.847
   53    HZ3  LYS   9           2HZ      LYS   9  -1.240  17.034   9.692
   54    H    CYS  10           H        CYS  10   5.246  12.977  13.587
   55    HA   CYS  10           HA       CYS  10   7.240  13.880  11.913
   56    HB2  CYS  10           1HB      CYS  10   8.638  12.056  12.842
   57    HB3  CYS  10           2HB      CYS  10   7.736  12.916  14.083
   58    HG   CYS  10           HG       CYS  10   6.759   9.906  12.781
   59    H    SER  11           H        SER  11   5.382  10.879  11.697
   60    HA   SER  11           HA       SER  11   6.047  10.690   8.874
   61    HB2  SER  11           1HB      SER  11   6.823   8.607  10.908
   62    HB3  SER  11           2HB      SER  11   6.570   8.192   9.213
   63    HG   SER  11           HG       SER  11   8.363   9.195   8.687
   64    H    THR  12           H        THR  12   4.606   9.388   7.679
   65    HA   THR  12           HA       THR  12   2.018   9.057   8.978
   66    HB   THR  12           HB       THR  12   2.780   8.849   6.059
   67    HG1  THR  12           HG1      THR  12   1.603  10.905   7.632
   68   HG21  THR  12          3HG2      THR  12   0.588   7.722   7.249
   69   HG22  THR  12          1HG2      THR  12   0.678   8.226   5.562
   70   HG23  THR  12          2HG2      THR  12  -0.025   9.304   6.767
   71    H    VAL  13           H        VAL  13   3.811   7.129   6.568
   72    HA   VAL  13           HA       VAL  13   3.855   4.762   8.101
   73    HB   VAL  13           HB       VAL  13   1.440   4.758   7.755
   74   HG11  VAL  13          1HG1      VAL  13   2.164   4.902   4.836
   75   HG12  VAL  13          2HG1      VAL  13   0.565   4.441   5.425
   76   HG13  VAL  13          3HG1      VAL  13   1.204   6.049   5.769
   77   HG21  VAL  13          3HG2      VAL  13   3.120   2.688   6.411
   78   HG22  VAL  13          1HG2      VAL  13   2.197   2.587   7.910
   79   HG23  VAL  13          2HG2      VAL  13   1.363   2.554   6.357
   80    H    VAL  14           H        VAL  14   5.083   3.181   7.139
   81    HA   VAL  14           HA       VAL  14   6.212   3.881   4.515
   82    HB   VAL  14           HB       VAL  14   8.133   2.484   5.128
   83   HG11  VAL  14          1HG1      VAL  14   7.955   4.935   5.731
   84   HG12  VAL  14          2HG1      VAL  14   7.580   4.408   7.373
   85   HG13  VAL  14          3HG1      VAL  14   9.132   3.994   6.646
   86   HG21  VAL  14          3HG2      VAL  14   7.444   0.817   6.546
   87   HG22  VAL  14          1HG2      VAL  14   8.182   1.930   7.698
   88   HG23  VAL  14          2HG2      VAL  14   6.429   1.898   7.501
   89    H    CYS  15           H        CYS  15   6.793   2.102   3.075
   90    HA   CYS  15           HA       CYS  15   4.743   0.512   2.296
   91    HB2  CYS  15           1HB      CYS  15   6.976   0.890   1.129
   92    HB3  CYS  15           2HB      CYS  15   7.603  -0.431   2.111
   93    H    VAL  16           H        VAL  16   3.659  -1.127   3.149
   94    HA   VAL  16           HA       VAL  16   4.502  -2.376   5.577
   95    HB   VAL  16           HB       VAL  16   2.458  -3.747   5.342
   96   HG11  VAL  16          1HG1      VAL  16   2.010  -1.802   6.492
   97   HG12  VAL  16          2HG1      VAL  16   2.369  -0.772   5.104
   98   HG13  VAL  16          3HG1      VAL  16   0.863  -1.689   5.157
   99   HG21  VAL  16          3HG2      VAL  16   2.675  -2.841   2.594
  100   HG22  VAL  16          1HG2      VAL  16   1.750  -4.181   3.273
  101   HG23  VAL  16          2HG2      VAL  16   1.070  -2.554   3.266
  102    H    ILE  17           H        ILE  17   5.823  -2.785   2.743
  103    HA   ILE  17           HA       ILE  17   6.035  -5.717   2.975
  104    HB   ILE  17           HB       ILE  17   6.549  -4.088   0.487
  105   HG12  ILE  17          1HG1      ILE  17   4.161  -4.028   1.172
  106   HG13  ILE  17          2HG1      ILE  17   4.414  -4.885  -0.345
  107   HG21  ILE  17          1HG2      ILE  17   7.736  -6.003   0.130
  108   HG22  ILE  17          2HG2      ILE  17   6.706  -6.970   1.184
  109   HG23  ILE  17          3HG2      ILE  17   6.151  -6.534  -0.432
  110   HD11  ILE  17          3HD1      ILE  17   3.607  -5.931   2.317
  111   HD12  ILE  17          1HD1      ILE  17   2.956  -6.284   0.716
  112   HD13  ILE  17          2HD1      ILE  17   4.497  -6.983   1.215
  113    H    CYS  18           H        CYS  18   7.884  -2.910   1.770
  114    HA   CYS  18           HA       CYS  18  10.336  -4.225   2.733
  115    HB2  CYS  18           1HB      CYS  18  11.559  -2.923   1.110
  116    HB3  CYS  18           2HB      CYS  18  10.217  -3.718   0.294
  117    H    LEU  19           H        LEU  19   8.191  -1.720   3.382
  118    HA   LEU  19           HA       LEU  19   8.189  -0.008   4.878
  119    HB2  LEU  19           1HB      LEU  19  10.578  -1.565   5.799
  120    HB3  LEU  19           2HB      LEU  19  10.134  -0.044   6.570
  121    HG   LEU  19           HG       LEU  19   7.892  -1.057   7.065
  122   HD11  LEU  19          1HD1      LEU  19   8.842  -3.072   5.348
  123   HD12  LEU  19          2HD1      LEU  19   7.317  -3.027   6.231
  124   HD13  LEU  19          3HD1      LEU  19   8.734  -3.786   6.957
  125   HD21  LEU  19          3HD2      LEU  19   8.982  -1.154   9.015
  126   HD22  LEU  19          1HD2      LEU  19  10.475  -1.709   8.257
  127   HD23  LEU  19          2HD2      LEU  19   9.204  -2.866   8.652
  128    H    GLU  20           H        GLU  20   8.909   0.845   2.512
  129    HA   GLU  20           HA       GLU  20  11.113   2.711   3.060
  130    HB2  GLU  20           1HB      GLU  20  10.622   1.251   0.459
  131    HB3  GLU  20           2HB      GLU  20  11.783   2.554   0.674
  132    HG2  GLU  20           1HG      GLU  20  12.721   1.019   2.564
  133    HG3  GLU  20           2HG      GLU  20  11.872  -0.248   1.680
  134    H    LYS  21           H        LYS  21  10.997   4.716   1.874
  135    HA   LYS  21           HA       LYS  21   8.704   6.108   2.015
  136    HB2  LYS  21           1HB      LYS  21  11.011   6.344   0.119
  137    HB3  LYS  21           2HB      LYS  21   9.631   7.419  -0.058
  138    HG2  LYS  21           1HG      LYS  21  10.033   8.487   1.944
  139    HG3  LYS  21           2HG      LYS  21  10.944   7.127   2.606
  140    HD2  LYS  21           1HD      LYS  21  12.644   8.604   2.144
  141    HD3  LYS  21           2HD      LYS  21  12.593   7.679   0.641
  142    HE2  LYS  21           1HE      LYS  21  11.199   9.415  -0.375
  143    HE3  LYS  21           2HE      LYS  21  11.244  10.334   1.129
  144    HZ1  LYS  21           3HZ      LYS  21  13.044  11.311   0.307
  145    HZ2  LYS  21           1HZ      LYS  21  13.169  10.209  -0.971
  146    HZ3  LYS  21           2HZ      LYS  21  13.870   9.851   0.526
  147    HA   PRO  22           HA       PRO  22   6.247   3.760  -0.986
  148    HB2  PRO  22           1HB      PRO  22   3.861   4.599   0.000
  149    HB3  PRO  22           2HB      PRO  22   4.785   3.274   0.718
  150    HG2  PRO  22           1HG      PRO  22   4.614   6.140   1.565
  151    HG3  PRO  22           2HG      PRO  22   4.585   4.675   2.563
  152    HD2  PRO  22           1HD      PRO  22   6.808   6.191   2.266
  153    HD3  PRO  22           2HD      PRO  22   6.876   4.432   2.496
  154    H    LYS  23           H        LYS  23   6.153   4.609  -2.965
  155    HA   LYS  23           HA       LYS  23   5.797   7.416  -3.424
  156    HB2  LYS  23           1HB      LYS  23   5.981   5.043  -5.281
  157    HB3  LYS  23           2HB      LYS  23   5.778   6.694  -5.853
  158    HG2  LYS  23           1HG      LYS  23   7.895   7.336  -5.132
  159    HG3  LYS  23           2HG      LYS  23   8.040   5.961  -4.034
  160    HD2  LYS  23           1HD      LYS  23   7.897   4.542  -6.205
  161    HD3  LYS  23           2HD      LYS  23   8.338   6.049  -7.012
  162    HE2  LYS  23           1HE      LYS  23  10.362   6.204  -5.711
  163    HE3  LYS  23           2HE      LYS  23   9.899   4.796  -4.757
  164    HZ1  LYS  23           3HZ      LYS  23  10.677   3.425  -6.307
  165    HZ2  LYS  23           1HZ      LYS  23  11.435   4.768  -7.002
  166    HZ3  LYS  23           2HZ      LYS  23   9.925   4.263  -7.570
  167    H    TYR  24           H        TYR  24   3.813   4.520  -3.820
  168    HA   TYR  24           HA       TYR  24   1.465   6.265  -4.109
  169    HB2  TYR  24           1HB      TYR  24   1.509   3.646  -5.543
  170    HB3  TYR  24           2HB      TYR  24   0.619   5.115  -5.924
  171    HD1  TYR  24           HD1      TYR  24   3.944   3.508  -6.083
  172    HD2  TYR  24           HD2      TYR  24   1.522   6.754  -7.388
  173    HE1  TYR  24           HE1      TYR  24   5.648   4.099  -7.755
  174    HE2  TYR  24           HE2      TYR  24   3.219   7.353  -9.065
  175    HH   TYR  24           HH       TYR  24   6.214   6.551  -9.017
  176    H    ARG  25           H        ARG  25  -0.604   4.826  -3.858
  177    HA   ARG  25           HA       ARG  25  -0.180   2.841  -1.734
  178    HB2  ARG  25           1HB      ARG  25  -1.778   5.352  -1.623
  179    HB3  ARG  25           2HB      ARG  25  -2.436   3.929  -0.826
  180    HG2  ARG  25           1HG      ARG  25  -0.376   3.729   0.492
  181    HG3  ARG  25           2HG      ARG  25   0.247   5.185  -0.287
  182    HD2  ARG  25           1HD      ARG  25  -2.352   5.128   1.228
  183    HD3  ARG  25           2HD      ARG  25  -0.807   5.486   1.999
  184    HE   ARG  25           HE       ARG  25  -2.305   7.197   0.214
  185   HH11  ARG  25          2HH1      ARG  25   0.765   6.534   1.715
  186   HH12  ARG  25          1HH1      ARG  25   1.353   8.154   1.530
  187   HH21  ARG  25          2HH2      ARG  25  -1.543   9.333  -0.035
  188   HH22  ARG  25          1HH2      ARG  25   0.039   9.745   0.535
  189    H    CYS  26           H        CYS  26  -1.902   1.321  -1.470
  190    HA   CYS  26           HA       CYS  26  -2.998   0.412  -3.899
  191    HB2  CYS  26           1HB      CYS  26  -2.481  -1.062  -1.980
  192    HB3  CYS  26           2HB      CYS  26  -3.808  -0.334  -1.081
  193    HA   PRO  27           HA       PRO  27  -6.552   3.068  -4.112
  194    HB2  PRO  27           1HB      PRO  27  -7.689   1.872  -6.268
  195    HB3  PRO  27           2HB      PRO  27  -6.298   2.956  -6.393
  196    HG2  PRO  27           1HG      PRO  27  -6.372  -0.036  -6.386
  197    HG3  PRO  27           2HG      PRO  27  -5.424   1.057  -7.411
  198    HD2  PRO  27           1HD      PRO  27  -4.369  -0.205  -5.260
  199    HD3  PRO  27           2HD      PRO  27  -3.830   1.404  -5.783
  200    H    ALA  28           H        ALA  28  -6.412   0.124  -2.814
  201    HA   ALA  28           HA       ALA  28  -9.341  -0.167  -2.644
  202    HB1  ALA  28           3HB      ALA  28  -7.202  -2.154  -3.007
  203    HB2  ALA  28           1HB      ALA  28  -8.453  -2.587  -1.842
  204    HB3  ALA  28           2HB      ALA  28  -8.893  -2.198  -3.505
  205    H    CYS  29           H        CYS  29  -6.607  -1.429  -0.745
  206    HA   CYS  29           HA       CYS  29  -8.026  -0.836   1.709
  207    HB2  CYS  29           1HB      CYS  29  -5.930  -1.879   2.744
  208    HB3  CYS  29           2HB      CYS  29  -6.933  -2.926   1.744
  209    H    ARG  30           H        ARG  30  -5.685   0.658  -0.267
  210    HA   ARG  30           HA       ARG  30  -4.613   2.663  -0.100
  211    HB2  ARG  30           1HB      ARG  30  -5.965   2.978   2.583
  212    HB3  ARG  30           2HB      ARG  30  -5.265   4.250   1.591
  213    HG2  ARG  30           1HG      ARG  30  -7.566   2.562   0.659
  214    HG3  ARG  30           2HG      ARG  30  -7.785   4.051   1.580
  215    HD2  ARG  30           1HD      ARG  30  -6.256   5.103  -0.225
  216    HD3  ARG  30           2HD      ARG  30  -6.670   3.675  -1.173
  217    HE   ARG  30           HE       ARG  30  -8.352   5.921  -0.617
  218   HH11  ARG  30          2HH1      ARG  30  -8.328   2.507  -1.295
  219   HH12  ARG  30          1HH1      ARG  30  -9.930   2.494  -1.956
  220   HH21  ARG  30          2HH2      ARG  30 -10.462   5.918  -1.484
  221   HH22  ARG  30          1HH2      ARG  30 -11.142   4.435  -2.063
  222    H    VAL  31           H        VAL  31  -3.054   0.617   0.378
  223    HA   VAL  31           HA       VAL  31  -1.646   1.140   2.907
  224    HB   VAL  31           HB       VAL  31  -0.441  -1.022   2.370
  225   HG11  VAL  31          1HG1      VAL  31  -1.865  -1.922   3.819
  226   HG12  VAL  31          2HG1      VAL  31  -2.930  -0.538   3.560
  227   HG13  VAL  31          3HG1      VAL  31  -3.134  -2.001   2.596
  228   HG21  VAL  31          3HG2      VAL  31  -2.627  -1.197   0.299
  229   HG22  VAL  31          1HG2      VAL  31  -0.888  -1.168   0.009
  230   HG23  VAL  31          2HG2      VAL  31  -1.625  -2.553   0.815
  231    HA   PRO  32           HA       PRO  32   1.752   3.000   0.834
  232    HB2  PRO  32           1HB      PRO  32   3.786   2.291   2.486
  233    HB3  PRO  32           2HB      PRO  32   2.576   3.506   2.918
  234    HG2  PRO  32           1HG      PRO  32   2.728   0.621   3.702
  235    HG3  PRO  32           2HG      PRO  32   2.324   2.031   4.698
  236    HD2  PRO  32           1HD      PRO  32   0.437   0.371   3.689
  237    HD3  PRO  32           2HD      PRO  32   0.151   2.106   3.933
  238    H    TYR  33           H        TYR  33   2.678   2.339  -0.992
  239    HA   TYR  33           HA       TYR  33   4.311  -0.075  -0.998
  240    HB2  TYR  33           1HB      TYR  33   3.124  -1.260  -2.544
  241    HB3  TYR  33           2HB      TYR  33   1.780  -0.384  -1.820
  242    HD1  TYR  33           HD2      TYR  33   4.285  -0.017  -4.568
  243    HD2  TYR  33           HD1      TYR  33   0.322   0.738  -3.218
  244    HE1  TYR  33           HE2      TYR  33   3.720   0.923  -6.770
  245    HE2  TYR  33           HE1      TYR  33  -0.254   1.679  -5.416
  246    HH   TYR  33           HH       TYR  33   0.631   2.478  -7.367
  247    H    CYS  34           H        CYS  34   6.180   0.371  -1.942
  248    HA   CYS  34           HA       CYS  34   6.705   2.826  -3.226
  249    HB2  CYS  34           1HB      CYS  34   8.873   1.564  -3.917
  250    HB3  CYS  34           2HB      CYS  34   8.576   1.882  -2.211
  251    H    SER  35           H        SER  35   7.153  -0.392  -4.684
  252    HA   SER  35           HA       SER  35   6.156   0.730  -7.221
  253    HB2  SER  35           1HB      SER  35   8.332  -1.309  -6.723
  254    HB3  SER  35           2HB      SER  35   7.631  -1.016  -8.314
  255    HG   SER  35           HG       SER  35   8.914   0.925  -6.686
  256    H    VAL  36           H        VAL  36   5.622  -1.259  -8.766
  257    HA   VAL  36           HA       VAL  36   3.267  -2.406  -7.828
  258    HB   VAL  36           HB       VAL  36   5.024  -3.410 -10.072
  259   HG11  VAL  36          1HG1      VAL  36   2.923  -4.725  -8.966
  260   HG12  VAL  36          2HG1      VAL  36   2.115  -3.775 -10.214
  261   HG13  VAL  36          3HG1      VAL  36   3.422  -4.876 -10.651
  262   HG21  VAL  36          3HG2      VAL  36   4.025  -1.908 -11.491
  263   HG22  VAL  36          1HG2      VAL  36   2.585  -1.750 -10.485
  264   HG23  VAL  36          2HG2      VAL  36   4.085  -0.956 -10.007
  265    H    VAL  37           H        VAL  37   6.472  -3.907  -8.215
  266    HA   VAL  37           HA       VAL  37   6.124  -6.470  -7.571
  267    HB   VAL  37           HB       VAL  37   8.194  -4.698  -6.265
  268   HG11  VAL  37          1HG1      VAL  37   7.794  -7.643  -6.324
  269   HG12  VAL  37          2HG1      VAL  37   9.443  -7.022  -6.426
  270   HG13  VAL  37          3HG1      VAL  37   8.429  -6.613  -5.041
  271   HG21  VAL  37          3HG2      VAL  37   7.859  -5.750  -8.972
  272   HG22  VAL  37          1HG2      VAL  37   8.875  -4.435  -8.382
  273   HG23  VAL  37          2HG2      VAL  37   9.434  -6.103  -8.262
  274    H    CYS  38           H        CYS  38   6.715  -4.130  -4.942
  275    HA   CYS  38           HA       CYS  38   6.011  -5.770  -2.834
  276    HB2  CYS  38           1HB      CYS  38   6.040  -2.806  -3.225
  277    HB3  CYS  38           2HB      CYS  38   5.320  -3.459  -1.757
  278    H    PHE  39           H        PHE  39   3.950  -3.765  -4.873
  279    HA   PHE  39           HA       PHE  39   1.575  -4.092  -3.374
  280    HB2  PHE  39           1HB      PHE  39   1.662  -2.294  -4.936
  281    HB3  PHE  39           2HB      PHE  39   2.076  -3.377  -6.261
  282    HD1  PHE  39           HD1      PHE  39  -0.636  -3.002  -3.722
  283    HD2  PHE  39           HD2      PHE  39   0.412  -3.826  -7.764
  284    HE1  PHE  39           HE1      PHE  39  -3.020  -3.202  -4.295
  285    HE2  PHE  39           HE2      PHE  39  -1.971  -4.026  -8.344
  286    HZ   PHE  39           HZ       PHE  39  -3.690  -3.714  -6.609
  287    H    ARG  40           H        ARG  40   3.124  -5.999  -5.866
  288    HA   ARG  40           HA       ARG  40   0.994  -7.645  -6.605
  289    HB2  ARG  40           1HB      ARG  40   3.946  -8.274  -6.445
  290    HB3  ARG  40           2HB      ARG  40   2.755  -9.289  -7.246
  291    HG2  ARG  40           1HG      ARG  40   2.211  -7.134  -8.591
  292    HG3  ARG  40           2HG      ARG  40   3.807  -6.615  -8.047
  293    HD2  ARG  40           1HD      ARG  40   3.219  -9.181  -9.520
  294    HD3  ARG  40           2HD      ARG  40   3.858  -7.713 -10.256
  295    HE   ARG  40           HE       ARG  40   5.580  -8.326  -8.199
  296   HH11  ARG  40          2HH1      ARG  40   4.443  -9.892 -11.093
  297   HH12  ARG  40          1HH1      ARG  40   5.902 -10.795 -11.334
  298   HH21  ARG  40          2HH2      ARG  40   7.506  -9.509  -8.506
  299   HH22  ARG  40          1HH2      ARG  40   7.643 -10.577  -9.862
  300    H    LYS  41           H        LYS  41   3.644  -8.590  -4.411
  301    HA   LYS  41           HA       LYS  41   2.593 -10.889  -3.393
  302    HB2  LYS  41           1HB      LYS  41   4.165  -8.781  -1.902
  303    HB3  LYS  41           2HB      LYS  41   3.900 -10.420  -1.323
  304    HG2  LYS  41           1HG      LYS  41   5.238 -11.353  -2.996
  305    HG3  LYS  41           2HG      LYS  41   5.189  -9.885  -3.975
  306    HD2  LYS  41           1HD      LYS  41   7.269  -9.650  -3.070
  307    HD3  LYS  41           2HD      LYS  41   6.324  -8.855  -1.809
  308    HE2  LYS  41           1HE      LYS  41   6.771 -11.793  -1.624
  309    HE3  LYS  41           2HE      LYS  41   8.105 -10.710  -1.228
  310    HZ1  LYS  41           3HZ      LYS  41   6.653 -11.380   0.679
  311    HZ2  LYS  41           1HZ      LYS  41   5.414 -10.460  -0.014
  312    HZ3  LYS  41           2HZ      LYS  41   6.847  -9.711   0.482
  313    H    HIS  42           H        HIS  42   1.817  -7.589  -2.424
  314    HA   HIS  42           HA       HIS  42   0.220  -8.271  -0.187
  315    HB2  HIS  42           1HB      HIS  42   0.755  -6.056  -0.067
  316    HB3  HIS  42           2HB      HIS  42   0.707  -5.839  -1.814
  317    HD1  HIS  42           HD1      HIS  42  -1.626  -6.078   1.155
  318    HD2  HIS  42           HD2      HIS  42  -1.604  -4.733  -2.776
  319    HE1  HIS  42           HE1      HIS  42  -3.805  -4.861   0.849
  320    H    LYS  43           H        LYS  43  -0.774  -7.121  -3.417
  321    HA   LYS  43           HA       LYS  43  -3.444  -7.328  -3.331
  322    HB2  LYS  43           1HB      LYS  43  -1.900  -6.879  -5.349
  323    HB3  LYS  43           2HB      LYS  43  -1.982  -8.614  -5.625
  324    HG2  LYS  43           1HG      LYS  43  -4.182  -8.554  -6.245
  325    HG3  LYS  43           2HG      LYS  43  -4.523  -7.103  -5.299
  326    HD2  LYS  43           1HD      LYS  43  -3.655  -5.690  -6.916
  327    HD3  LYS  43           2HD      LYS  43  -2.666  -6.960  -7.640
  328    HE2  LYS  43           1HE      LYS  43  -5.054  -8.018  -8.114
  329    HE3  LYS  43           2HE      LYS  43  -5.544  -6.327  -8.026
  330    HZ1  LYS  43           3HZ      LYS  43  -3.241  -6.492  -9.607
  331    HZ2  LYS  43           1HZ      LYS  43  -4.804  -6.045 -10.077
  332    HZ3  LYS  43           2HZ      LYS  43  -4.327  -7.666 -10.159
  333    H    GLU  44           H        GLU  44  -1.217 -10.048  -3.439
  334    HA   GLU  44           HA       GLU  44  -2.766 -12.182  -4.034
  335    HB2  GLU  44           1HB      GLU  44  -0.767 -11.943  -1.783
  336    HB3  GLU  44           2HB      GLU  44  -1.448 -13.472  -2.321
  337    HG2  GLU  44           1HG      GLU  44  -0.022 -11.631  -4.206
  338    HG3  GLU  44           2HG      GLU  44   0.841 -12.807  -3.217
  339    H    GLN  45           H        GLN  45  -2.644 -10.594  -0.857
  340    HA   GLN  45           HA       GLN  45  -5.237 -11.844  -0.239
  341    HB2  GLN  45           1HB      GLN  45  -4.602 -12.074   2.068
  342    HB3  GLN  45           2HB      GLN  45  -3.363 -12.831   1.076
  343    HG2  GLN  45           1HG      GLN  45  -2.231 -10.465   1.279
  344    HG3  GLN  45           2HG      GLN  45  -3.233 -10.367   2.726
  345   HE21  GLN  45          1HE2      GLN  45  -0.754 -12.257   1.104
  346   HE22  GLN  45          2HE2      GLN  45  -0.090 -12.959   2.536
  347    H    CYS  46           H        CYS  46  -4.534  -9.215  -1.408
  348    HA   CYS  46           HA       CYS  46  -4.755  -7.133   0.437
  349    HB2  CYS  46           1HB      CYS  46  -4.156  -6.463  -1.716
  350    HB3  CYS  46           2HB      CYS  46  -5.438  -7.403  -2.472
  351    H    ASN  47           H        ASN  47  -6.280  -7.151   1.979
  352    HA   ASN  47           HA       ASN  47  -9.073  -7.598   1.159
  353    HB2  ASN  47           1HB      ASN  47  -7.930  -9.086   2.953
  354    HB3  ASN  47           2HB      ASN  47  -8.125  -7.691   4.011
  355   HD21  ASN  47          1HD2      ASN  47 -10.449  -6.712   3.748
  356   HD22  ASN  47          2HD2      ASN  47 -11.724  -7.868   3.901
  357    HA   PRO  48           HA       PRO  48  -9.158  -3.136   1.925
  358    HB2  PRO  48           1HB      PRO  48 -11.480  -2.739   0.574
  359    HB3  PRO  48           2HB      PRO  48  -9.911  -2.873  -0.230
  360    HG2  PRO  48           1HG      PRO  48 -12.043  -4.945   0.123
  361    HG3  PRO  48           2HG      PRO  48 -11.069  -4.575  -1.312
  362    HD2  PRO  48           1HD      PRO  48 -10.515  -6.658   0.327
  363    HD3  PRO  48           2HD      PRO  48  -9.251  -5.762  -0.538
  364    H    GLU  49           H        GLU  49 -11.242  -1.744   2.527
  365    HA   GLU  49           HA       GLU  49 -12.769  -3.250   4.547
  366    HB2  GLU  49           1HB      GLU  49 -11.206  -0.728   4.806
  367    HB3  GLU  49           2HB      GLU  49 -12.708  -0.856   5.711
  368    HG2  GLU  49           1HG      GLU  49 -10.600  -2.980   5.851
  369    HG3  GLU  49           2HG      GLU  49 -10.549  -1.547   6.875
  370    H    THR  50           H        THR  50 -14.520  -3.417   3.097
  371    HA   THR  50           HA       THR  50 -15.695  -1.170   1.818
  372    HB   THR  50           HB       THR  50 -17.666  -2.678   1.482
  373    HG1  THR  50           HG1      THR  50 -17.818  -4.302   2.820
  374   HG21  THR  50          3HG2      THR  50 -15.030  -3.981   0.803
  375   HG22  THR  50          1HG2      THR  50 -15.712  -2.610  -0.071
  376   HG23  THR  50          2HG2      THR  50 -16.559  -4.158  -0.058
  377    H    SER  51           H        SER  51 -15.953   0.408   3.442
  378    HA   SER  51           HA       SER  51 -18.128  -0.154   5.351
  379    HB2  SER  51           1HB      SER  51 -15.792   0.343   6.292
  380    HB3  SER  51           2HB      SER  51 -16.047   1.995   5.731
  381    HG   SER  51           HG       SER  51 -17.257   0.611   7.816
  382    H    GLY  52           H        GLY  52 -18.740   0.598   2.762
  383    HA2  GLY  52           1HA      GLY  52 -20.571   2.086   2.224
  384    HA3  GLY  52           2HA      GLY  52 -19.797   3.314   3.215
  385    HA   PRO  53           HA       PRO  53 -17.285   2.979  -0.926
  386    HB2  PRO  53           1HB      PRO  53 -18.549   1.694  -2.956
  387    HB3  PRO  53           2HB      PRO  53 -17.467   0.873  -1.825
  388    HG2  PRO  53           1HG      PRO  53 -20.458   0.994  -1.836
  389    HG3  PRO  53           2HG      PRO  53 -19.395  -0.393  -1.533
  390    HD2  PRO  53           1HD      PRO  53 -20.588   0.991   0.465
  391    HD3  PRO  53           2HD      PRO  53 -18.995   0.229   0.650
  392    H    SER  54           H        SER  54 -17.950   5.186  -0.781
  393    HA   SER  54           HA       SER  54 -20.155   5.911  -2.597
  394    HB2  SER  54           1HB      SER  54 -20.605   6.662  -0.338
  395    HB3  SER  54           2HB      SER  54 -19.015   7.418  -0.233
  396    HG   SER  54           HG       SER  54 -19.648   8.964  -1.656
  397    H    SER  55           H        SER  55 -18.896   5.896  -4.474
  398    HA   SER  55           HA       SER  55 -17.456   8.330  -4.964
  399    HB2  SER  55           1HB      SER  55 -15.995   5.704  -4.791
  400    HB3  SER  55           2HB      SER  55 -15.411   7.001  -5.833
  401    HG   SER  55           HG       SER  55 -15.704   6.991  -3.023
  402    H    GLY  56           H        GLY  56 -16.585   8.337  -7.279
  403    HA2  GLY  56           1HA      GLY  56 -18.714   7.445  -8.996
  404    HA3  GLY  56           2HA      GLY  56 -17.295   8.362  -9.481
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1  -3.725  25.900  35.020
    2    HA2  GLY   1           1HA      GLY   1  -3.440  27.915  36.971
    3    HA3  GLY   1           2HA      GLY   1  -2.350  26.591  37.357
    4    H    SER   2           H        SER   2  -1.259  25.764  35.139
    5    HA   SER   2           HA       SER   2   0.302  28.040  34.265
    6    HB2  SER   2           1HB      SER   2   0.539  25.071  33.751
    7    HB3  SER   2           2HB      SER   2   1.630  26.263  33.045
    8    HG   SER   2           HG       SER   2   1.355  26.630  35.715
    9    H    SER   3           H        SER   3   0.979  27.964  31.842
   10    HA   SER   3           HA       SER   3  -1.041  27.137  29.981
   11    HB2  SER   3           1HB      SER   3  -0.933  29.953  30.945
   12    HB3  SER   3           2HB      SER   3  -1.196  29.695  29.221
   13    HG   SER   3           HG       SER   3  -2.800  28.022  30.352
   14    H    GLY   4           H        GLY   4  -0.292  27.094  27.892
   15    HA2  GLY   4           1HA      GLY   4   1.149  27.653  26.113
   16    HA3  GLY   4           2HA      GLY   4   2.208  28.466  27.255
   17    H    SER   5           H        SER   5   0.997  25.196  26.520
   18    HA   SER   5           HA       SER   5   3.567  24.100  26.161
   19    HB2  SER   5           1HB      SER   5   3.715  22.700  28.188
   20    HB3  SER   5           2HB      SER   5   3.777  24.418  28.582
   21    HG   SER   5           HG       SER   5   1.452  22.794  28.717
   22    H    SER   6           H        SER   6   3.054  22.705  24.617
   23    HA   SER   6           HA       SER   6   1.150  20.589  25.169
   24    HB2  SER   6           1HB      SER   6  -0.364  22.187  24.217
   25    HB3  SER   6           2HB      SER   6   0.759  22.559  22.909
   26    HG   SER   6           HG       SER   6   0.321  20.642  21.968
   27    H    GLY   7           H        GLY   7   1.401  18.767  23.823
   28    HA2  GLY   7           1HA      GLY   7   4.057  18.488  22.748
   29    HA3  GLY   7           2HA      GLY   7   2.824  17.238  22.824
   30    H    LEU   8           H        LEU   8   4.202  17.139  20.620
   31    HA   LEU   8           HA       LEU   8   2.691  18.630  18.582
   32    HB2  LEU   8           1HB      LEU   8   5.436  17.421  18.589
   33    HB3  LEU   8           2HB      LEU   8   4.613  17.828  17.084
   34    HG   LEU   8           HG       LEU   8   6.194  19.565  17.734
   35   HD11  LEU   8          1HD1      LEU   8   4.818  21.002  16.763
   36   HD12  LEU   8          2HD1      LEU   8   3.907  21.181  18.262
   37   HD13  LEU   8          3HD1      LEU   8   3.466  19.924  17.107
   38   HD21  LEU   8          3HD2      LEU   8   4.649  20.576  19.989
   39   HD22  LEU   8          1HD2      LEU   8   6.392  20.388  19.801
   40   HD23  LEU   8          2HD2      LEU   8   5.408  19.015  20.308
   41    H    LYS   9           H        LYS   9   2.437  17.398  16.475
   42    HA   LYS   9           HA       LYS   9   1.533  14.668  17.096
   43    HB2  LYS   9           1HB      LYS   9  -0.138  16.426  16.316
   44    HB3  LYS   9           2HB      LYS   9   0.658  16.350  14.750
   45    HG2  LYS   9           1HG      LYS   9  -0.065  14.185  14.344
   46    HG3  LYS   9           2HG      LYS   9  -0.378  13.864  16.051
   47    HD2  LYS   9           1HD      LYS   9  -2.496  14.121  15.019
   48    HD3  LYS   9           2HD      LYS   9  -2.199  15.610  15.919
   49    HE2  LYS   9           1HE      LYS   9  -3.021  16.336  13.854
   50    HE3  LYS   9           2HE      LYS   9  -1.275  16.535  13.720
   51    HZ1  LYS   9           3HZ      LYS   9  -2.328  13.974  12.847
   52    HZ2  LYS   9           1HZ      LYS   9  -1.126  14.944  12.157
   53    HZ3  LYS   9           2HZ      LYS   9  -2.757  15.302  11.892
   54    H    CYS  10           H        CYS  10   2.214  12.952  15.906
   55    HA   CYS  10           HA       CYS  10   3.790  13.406  13.496
   56    HB2  CYS  10           1HB      CYS  10   5.382  13.417  15.426
   57    HB3  CYS  10           2HB      CYS  10   4.869  11.777  15.803
   58    HG   CYS  10           HG       CYS  10   7.376  12.512  14.085
   59    H    SER  11           H        SER  11   3.369  11.925  11.985
   60    HA   SER  11           HA       SER  11   2.662   9.213  12.666
   61    HB2  SER  11           1HB      SER  11   0.514  10.566  12.869
   62    HB3  SER  11           2HB      SER  11   0.624  10.827  11.129
   63    HG   SER  11           HG       SER  11   0.317   8.694  10.776
   64    H    THR  12           H        THR  12   3.592   7.951  11.209
   65    HA   THR  12           HA       THR  12   3.534   8.612   8.393
   66    HB   THR  12           HB       THR  12   6.178   8.351   9.837
   67    HG1  THR  12           HG1      THR  12   6.261  10.520   8.538
   68   HG21  THR  12          3HG2      THR  12   6.328   7.221   7.722
   69   HG22  THR  12          1HG2      THR  12   7.142   8.778   7.573
   70   HG23  THR  12          2HG2      THR  12   5.528   8.559   6.897
   71    H    VAL  13           H        VAL  13   3.513   6.822   7.143
   72    HA   VAL  13           HA       VAL  13   4.114   4.250   8.454
   73    HB   VAL  13           HB       VAL  13   1.683   4.627   8.011
   74   HG11  VAL  13          1HG1      VAL  13   0.997   4.315   5.584
   75   HG12  VAL  13          2HG1      VAL  13   1.656   5.891   6.024
   76   HG13  VAL  13          3HG1      VAL  13   2.663   4.720   5.171
   77   HG21  VAL  13          3HG2      VAL  13   1.428   2.424   6.686
   78   HG22  VAL  13          1HG2      VAL  13   3.190   2.370   6.744
   79   HG23  VAL  13          2HG2      VAL  13   2.258   2.385   8.241
   80    H    VAL  14           H        VAL  14   5.081   2.627   7.207
   81    HA   VAL  14           HA       VAL  14   6.252   3.552   4.663
   82    HB   VAL  14           HB       VAL  14   8.211   2.148   5.146
   83   HG11  VAL  14          1HG1      VAL  14   9.059   3.516   7.123
   84   HG12  VAL  14          2HG1      VAL  14   8.501   4.410   5.707
   85   HG13  VAL  14          3HG1      VAL  14   7.468   4.276   7.131
   86   HG21  VAL  14          3HG2      VAL  14   8.456   1.409   7.585
   87   HG22  VAL  14          1HG2      VAL  14   6.703   1.581   7.678
   88   HG23  VAL  14          2HG2      VAL  14   7.418   0.440   6.540
   89    H    CYS  15           H        CYS  15   6.787   1.851   3.121
   90    HA   CYS  15           HA       CYS  15   4.752   0.277   2.326
   91    HB2  CYS  15           1HB      CYS  15   6.957   0.669   1.138
   92    HB3  CYS  15           2HB      CYS  15   7.616  -0.651   2.099
   93    H    VAL  16           H        VAL  16   3.668  -1.394   3.117
   94    HA   VAL  16           HA       VAL  16   4.515  -2.718   5.508
   95    HB   VAL  16           HB       VAL  16   2.456  -4.011   5.319
   96   HG11  VAL  16          1HG1      VAL  16   0.960  -1.798   4.794
   97   HG12  VAL  16          2HG1      VAL  16   1.747  -2.140   6.336
   98   HG13  VAL  16          3HG1      VAL  16   2.531  -1.086   5.159
   99   HG21  VAL  16          3HG2      VAL  16   1.492  -4.458   3.367
  100   HG22  VAL  16          1HG2      VAL  16   1.276  -2.739   3.039
  101   HG23  VAL  16          2HG2      VAL  16   2.770  -3.546   2.565
  102    H    ILE  17           H        ILE  17   5.839  -3.045   2.678
  103    HA   ILE  17           HA       ILE  17   6.022  -5.985   2.811
  104    HB   ILE  17           HB       ILE  17   6.531  -4.296   0.363
  105   HG12  ILE  17          1HG1      ILE  17   4.184  -4.120   0.888
  106   HG13  ILE  17          2HG1      ILE  17   4.365  -5.241  -0.457
  107   HG21  ILE  17          1HG2      ILE  17   6.953  -6.224  -0.777
  108   HG22  ILE  17          2HG2      ILE  17   7.525  -6.706   0.819
  109   HG23  ILE  17          3HG2      ILE  17   5.924  -7.200   0.271
  110   HD11  ILE  17          3HD1      ILE  17   4.415  -6.991   1.550
  111   HD12  ILE  17          1HD1      ILE  17   3.454  -5.722   2.308
  112   HD13  ILE  17          2HD1      ILE  17   2.921  -6.444   0.789
  113    H    CYS  18           H        CYS  18   7.872  -3.147   1.684
  114    HA   CYS  18           HA       CYS  18  10.330  -4.511   2.557
  115    HB2  CYS  18           1HB      CYS  18  11.537  -3.175   0.972
  116    HB3  CYS  18           2HB      CYS  18  10.144  -3.856   0.139
  117    H    LEU  19           H        LEU  19   8.217  -1.976   3.295
  118    HA   LEU  19           HA       LEU  19   8.235  -0.364   4.900
  119    HB2  LEU  19           1HB      LEU  19  10.833  -1.625   5.764
  120    HB3  LEU  19           2HB      LEU  19   9.846  -0.513   6.710
  121    HG   LEU  19           HG       LEU  19   8.808  -3.189   5.818
  122   HD11  LEU  19          1HD1      LEU  19  10.993  -2.858   7.493
  123   HD12  LEU  19          2HD1      LEU  19   9.970  -4.288   7.360
  124   HD13  LEU  19          3HD1      LEU  19   9.626  -3.069   8.588
  125   HD21  LEU  19          3HD2      LEU  19   8.017  -1.138   7.863
  126   HD22  LEU  19          1HD2      LEU  19   7.451  -2.806   7.946
  127   HD23  LEU  19          2HD2      LEU  19   7.058  -1.811   6.544
  128    H    GLU  20           H        GLU  20   8.917   0.599   2.564
  129    HA   GLU  20           HA       GLU  20  11.120   2.447   3.167
  130    HB2  GLU  20           1HB      GLU  20  10.631   1.055   0.530
  131    HB3  GLU  20           2HB      GLU  20  11.754   2.389   0.753
  132    HG2  GLU  20           1HG      GLU  20  12.724   0.808   2.624
  133    HG3  GLU  20           2HG      GLU  20  11.961  -0.437   1.636
  134    H    LYS  21           H        LYS  21  11.006   4.476   1.974
  135    HA   LYS  21           HA       LYS  21   8.696   5.856   2.203
  136    HB2  LYS  21           1HB      LYS  21  11.038   6.172   0.381
  137    HB3  LYS  21           2HB      LYS  21   9.636   7.202   0.121
  138    HG2  LYS  21           1HG      LYS  21   9.802   8.056   2.378
  139    HG3  LYS  21           2HG      LYS  21  11.146   6.963   2.716
  140    HD2  LYS  21           1HD      LYS  21  12.239   8.129   0.651
  141    HD3  LYS  21           2HD      LYS  21  11.069   9.406   0.995
  142    HE2  LYS  21           1HE      LYS  21  12.698   8.331   3.241
  143    HE3  LYS  21           2HE      LYS  21  13.480   9.401   2.078
  144    HZ1  LYS  21           3HZ      LYS  21  11.802  11.070   2.526
  145    HZ2  LYS  21           1HZ      LYS  21  12.574  10.620   3.963
  146    HZ3  LYS  21           2HZ      LYS  21  11.023  10.040   3.619
  147    HA   PRO  22           HA       PRO  22   6.228   3.624  -0.866
  148    HB2  PRO  22           1HB      PRO  22   3.847   4.483   0.116
  149    HB3  PRO  22           2HB      PRO  22   4.745   3.133   0.819
  150    HG2  PRO  22           1HG      PRO  22   4.611   5.987   1.711
  151    HG3  PRO  22           2HG      PRO  22   4.552   4.506   2.685
  152    HD2  PRO  22           1HD      PRO  22   6.801   5.993   2.429
  153    HD3  PRO  22           2HD      PRO  22   6.840   4.229   2.631
  154    H    LYS  23           H        LYS  23   6.108   4.485  -2.835
  155    HA   LYS  23           HA       LYS  23   5.785   7.318  -3.237
  156    HB2  LYS  23           1HB      LYS  23   6.260   4.952  -5.005
  157    HB3  LYS  23           2HB      LYS  23   5.687   6.452  -5.722
  158    HG2  LYS  23           1HG      LYS  23   7.617   7.625  -5.075
  159    HG3  LYS  23           2HG      LYS  23   8.110   6.353  -3.955
  160    HD2  LYS  23           1HD      LYS  23   8.395   4.837  -5.915
  161    HD3  LYS  23           2HD      LYS  23   8.072   6.216  -6.968
  162    HE2  LYS  23           1HE      LYS  23  10.371   6.230  -6.906
  163    HE3  LYS  23           2HE      LYS  23   9.987   7.341  -5.592
  164    HZ1  LYS  23           3HZ      LYS  23  10.247   4.515  -4.912
  165    HZ2  LYS  23           1HZ      LYS  23  10.696   5.887  -4.029
  166    HZ3  LYS  23           2HZ      LYS  23  11.670   5.343  -5.301
  167    H    TYR  24           H        TYR  24   3.838   4.414  -3.723
  168    HA   TYR  24           HA       TYR  24   1.482   6.140  -4.044
  169    HB2  TYR  24           1HB      TYR  24   1.623   3.562  -5.554
  170    HB3  TYR  24           2HB      TYR  24   0.684   5.009  -5.901
  171    HD1  TYR  24           HD1      TYR  24   4.075   3.541  -6.045
  172    HD2  TYR  24           HD2      TYR  24   1.543   6.720  -7.304
  173    HE1  TYR  24           HE1      TYR  24   5.782   4.251  -7.667
  174    HE2  TYR  24           HE2      TYR  24   3.242   7.437  -8.930
  175    HH   TYR  24           HH       TYR  24   6.150   6.932  -8.896
  176    H    ARG  25           H        ARG  25  -0.577   4.679  -3.882
  177    HA   ARG  25           HA       ARG  25  -0.181   2.664  -1.777
  178    HB2  ARG  25           1HB      ARG  25  -1.899   5.103  -1.734
  179    HB3  ARG  25           2HB      ARG  25  -2.498   3.649  -0.946
  180    HG2  ARG  25           1HG      ARG  25  -0.510   3.578   0.459
  181    HG3  ARG  25           2HG      ARG  25   0.116   5.019  -0.345
  182    HD2  ARG  25           1HD      ARG  25  -1.622   6.370   0.529
  183    HD3  ARG  25           2HD      ARG  25  -2.539   4.964   1.067
  184    HE   ARG  25           HE       ARG  25   0.044   5.169   2.296
  185   HH11  ARG  25          2HH1      ARG  25  -3.270   6.225   2.443
  186   HH12  ARG  25          1HH1      ARG  25  -3.222   6.569   4.140
  187   HH21  ARG  25          2HH2      ARG  25   0.120   5.618   4.531
  188   HH22  ARG  25          1HH2      ARG  25  -1.293   6.224   5.327
  189    H    CYS  26           H        CYS  26  -2.103   1.252  -1.480
  190    HA   CYS  26           HA       CYS  26  -2.985   0.273  -4.015
  191    HB2  CYS  26           1HB      CYS  26  -2.492  -1.221  -2.109
  192    HB3  CYS  26           2HB      CYS  26  -3.856  -0.534  -1.232
  193    HA   PRO  27           HA       PRO  27  -6.615   2.802  -4.331
  194    HB2  PRO  27           1HB      PRO  27  -7.690   1.537  -6.479
  195    HB3  PRO  27           2HB      PRO  27  -6.324   2.652  -6.605
  196    HG2  PRO  27           1HG      PRO  27  -6.327  -0.341  -6.539
  197    HG3  PRO  27           2HG      PRO  27  -5.389   0.755  -7.571
  198    HD2  PRO  27           1HD      PRO  27  -4.337  -0.439  -5.380
  199    HD3  PRO  27           2HD      PRO  27  -3.829   1.172  -5.927
  200    H    ALA  28           H        ALA  28  -6.428  -0.071  -2.928
  201    HA   ALA  28           HA       ALA  28  -9.347  -0.482  -2.851
  202    HB1  ALA  28           3HB      ALA  28  -8.853  -2.568  -3.475
  203    HB2  ALA  28           1HB      ALA  28  -7.137  -2.358  -3.124
  204    HB3  ALA  28           2HB      ALA  28  -8.256  -2.790  -1.830
  205    H    CYS  29           H        CYS  29  -6.602  -1.413  -0.775
  206    HA   CYS  29           HA       CYS  29  -8.173  -0.654   1.566
  207    HB2  CYS  29           1HB      CYS  29  -6.258  -1.761   2.809
  208    HB3  CYS  29           2HB      CYS  29  -7.206  -2.816   1.766
  209    H    ARG  30           H        ARG  30  -5.771   0.624  -0.427
  210    HA   ARG  30           HA       ARG  30  -4.602   2.579  -0.346
  211    HB2  ARG  30           1HB      ARG  30  -5.915   3.051   2.334
  212    HB3  ARG  30           2HB      ARG  30  -5.153   4.254   1.302
  213    HG2  ARG  30           1HG      ARG  30  -7.526   2.662   0.393
  214    HG3  ARG  30           2HG      ARG  30  -7.692   4.157   1.315
  215    HD2  ARG  30           1HD      ARG  30  -6.024   4.038  -1.174
  216    HD3  ARG  30           2HD      ARG  30  -7.768   4.283  -1.255
  217    HE   ARG  30           HE       ARG  30  -6.480   6.096   0.545
  218   HH11  ARG  30          2HH1      ARG  30  -7.247   5.495  -2.797
  219   HH12  ARG  30          1HH1      ARG  30  -7.189   7.167  -3.247
  220   HH21  ARG  30          2HH2      ARG  30  -6.401   8.301  -0.034
  221   HH22  ARG  30          1HH2      ARG  30  -6.707   8.762  -1.675
  222    H    VAL  31           H        VAL  31  -3.221   0.378   0.287
  223    HA   VAL  31           HA       VAL  31  -1.780   0.875   2.781
  224    HB   VAL  31           HB       VAL  31  -0.618  -1.263   2.280
  225   HG11  VAL  31          1HG1      VAL  31  -2.372  -1.620   3.716
  226   HG12  VAL  31          2HG1      VAL  31  -3.580  -1.073   2.551
  227   HG13  VAL  31          3HG1      VAL  31  -2.836  -2.663   2.372
  228   HG21  VAL  31          3HG2      VAL  31  -1.240  -0.873  -0.284
  229   HG22  VAL  31          1HG2      VAL  31  -0.930  -2.476   0.385
  230   HG23  VAL  31          2HG2      VAL  31  -2.589  -1.917   0.166
  231    HA   PRO  32           HA       PRO  32   1.623   2.867   0.836
  232    HB2  PRO  32           1HB      PRO  32   3.601   2.206   2.574
  233    HB3  PRO  32           2HB      PRO  32   2.345   3.389   2.954
  234    HG2  PRO  32           1HG      PRO  32   2.533   0.507   3.742
  235    HG3  PRO  32           2HG      PRO  32   2.052   1.906   4.720
  236    HD2  PRO  32           1HD      PRO  32   0.252   0.202   3.631
  237    HD3  PRO  32           2HD      PRO  32  -0.087   1.929   3.863
  238    H    TYR  33           H        TYR  33   2.604   2.213  -0.964
  239    HA   TYR  33           HA       TYR  33   4.314  -0.148  -0.898
  240    HB2  TYR  33           1HB      TYR  33   3.232  -1.359  -2.509
  241    HB3  TYR  33           2HB      TYR  33   1.837  -0.559  -1.794
  242    HD1  TYR  33           HD2      TYR  33   4.365  -0.034  -4.494
  243    HD2  TYR  33           HD1      TYR  33   0.353   0.526  -3.195
  244    HE1  TYR  33           HE2      TYR  33   3.794   0.918  -6.689
  245    HE2  TYR  33           HE1      TYR  33  -0.230   1.479  -5.386
  246    HH   TYR  33           HH       TYR  33   0.651   1.339  -7.747
  247    H    CYS  34           H        CYS  34   6.178   0.237  -1.898
  248    HA   CYS  34           HA       CYS  34   6.725   2.738  -3.101
  249    HB2  CYS  34           1HB      CYS  34   8.899   1.508  -3.792
  250    HB3  CYS  34           2HB      CYS  34   8.576   1.748  -2.078
  251    H    SER  35           H        SER  35   7.143  -0.459  -4.618
  252    HA   SER  35           HA       SER  35   6.194   0.729  -7.144
  253    HB2  SER  35           1HB      SER  35   8.465  -1.124  -6.554
  254    HB3  SER  35           2HB      SER  35   7.641  -1.263  -8.107
  255    HG   SER  35           HG       SER  35   8.556   1.226  -7.139
  256    H    VAL  36           H        VAL  36   5.641  -1.218  -8.732
  257    HA   VAL  36           HA       VAL  36   3.272  -2.368  -7.792
  258    HB   VAL  36           HB       VAL  36   3.987  -1.980 -10.217
  259   HG11  VAL  36          1HG1      VAL  36   5.104  -4.763  -9.955
  260   HG12  VAL  36          2HG1      VAL  36   5.143  -3.703 -11.366
  261   HG13  VAL  36          3HG1      VAL  36   6.108  -3.314  -9.941
  262   HG21  VAL  36          3HG2      VAL  36   2.874  -4.561 -10.516
  263   HG22  VAL  36          1HG2      VAL  36   2.222  -3.876  -9.028
  264   HG23  VAL  36          2HG2      VAL  36   2.045  -3.005 -10.551
  265    H    VAL  37           H        VAL  37   6.521  -3.731  -8.127
  266    HA   VAL  37           HA       VAL  37   6.165  -6.376  -7.689
  267    HB   VAL  37           HB       VAL  37   8.247  -4.657  -6.334
  268   HG11  VAL  37          1HG1      VAL  37   8.055  -6.851  -5.278
  269   HG12  VAL  37          2HG1      VAL  37   8.233  -7.629  -6.852
  270   HG13  VAL  37          3HG1      VAL  37   9.570  -6.703  -6.169
  271   HG21  VAL  37          3HG2      VAL  37   7.954  -5.776  -9.063
  272   HG22  VAL  37          1HG2      VAL  37   8.726  -4.284  -8.524
  273   HG23  VAL  37          2HG2      VAL  37   9.561  -5.826  -8.338
  274    H    CYS  38           H        CYS  38   6.678  -4.093  -4.991
  275    HA   CYS  38           HA       CYS  38   6.029  -5.865  -2.944
  276    HB2  CYS  38           1HB      CYS  38   6.058  -2.880  -3.179
  277    HB3  CYS  38           2HB      CYS  38   5.390  -3.623  -1.729
  278    H    PHE  39           H        PHE  39   3.977  -3.832  -4.938
  279    HA   PHE  39           HA       PHE  39   1.606  -4.111  -3.426
  280    HB2  PHE  39           1HB      PHE  39   1.649  -2.346  -4.999
  281    HB3  PHE  39           2HB      PHE  39   2.142  -3.415  -6.308
  282    HD1  PHE  39           HD1      PHE  39  -0.668  -3.167  -3.859
  283    HD2  PHE  39           HD2      PHE  39   0.544  -3.866  -7.879
  284    HE1  PHE  39           HE1      PHE  39  -3.023  -3.437  -4.518
  285    HE2  PHE  39           HE2      PHE  39  -1.808  -4.136  -8.545
  286    HZ   PHE  39           HZ       PHE  39  -3.596  -3.921  -6.864
  287    H    ARG  40           H        ARG  40   3.046  -6.020  -6.009
  288    HA   ARG  40           HA       ARG  40   0.874  -7.685  -6.583
  289    HB2  ARG  40           1HB      ARG  40   3.831  -8.312  -6.683
  290    HB3  ARG  40           2HB      ARG  40   2.568  -9.278  -7.434
  291    HG2  ARG  40           1HG      ARG  40   1.946  -7.240  -8.766
  292    HG3  ARG  40           2HG      ARG  40   3.414  -6.484  -8.144
  293    HD2  ARG  40           1HD      ARG  40   4.776  -8.203  -9.145
  294    HD3  ARG  40           2HD      ARG  40   3.342  -9.094  -9.652
  295    HE   ARG  40           HE       ARG  40   4.474  -6.745 -10.908
  296   HH11  ARG  40          2HH1      ARG  40   1.714  -8.844 -10.597
  297   HH12  ARG  40          1HH1      ARG  40   1.032  -8.388 -12.123
  298   HH21  ARG  40          2HH2      ARG  40   3.586  -6.137 -12.919
  299   HH22  ARG  40          1HH2      ARG  40   2.098  -6.849 -13.443
  300    H    LYS  41           H        LYS  41   3.524  -8.111  -4.253
  301    HA   LYS  41           HA       LYS  41   2.752 -10.619  -3.280
  302    HB2  LYS  41           1HB      LYS  41   4.363  -8.359  -2.141
  303    HB3  LYS  41           2HB      LYS  41   3.983  -9.760  -1.147
  304    HG2  LYS  41           1HG      LYS  41   6.074 -10.250  -2.027
  305    HG3  LYS  41           2HG      LYS  41   4.964 -11.147  -3.065
  306    HD2  LYS  41           1HD      LYS  41   5.060  -9.314  -4.709
  307    HD3  LYS  41           2HD      LYS  41   6.216  -8.468  -3.677
  308    HE2  LYS  41           1HE      LYS  41   7.909  -9.955  -4.128
  309    HE3  LYS  41           2HE      LYS  41   6.799 -11.274  -4.497
  310    HZ1  LYS  41           3HZ      LYS  41   6.752 -10.715  -6.639
  311    HZ2  LYS  41           1HZ      LYS  41   8.114  -9.762  -6.322
  312    HZ3  LYS  41           2HZ      LYS  41   6.573  -9.064  -6.315
  313    H    HIS  42           H        HIS  42   1.654  -7.389  -2.488
  314    HA   HIS  42           HA       HIS  42   0.177  -8.189  -0.162
  315    HB2  HIS  42           1HB      HIS  42   0.650  -5.962   0.031
  316    HB3  HIS  42           2HB      HIS  42   0.567  -5.684  -1.706
  317    HD1  HIS  42           HD1      HIS  42  -1.644  -5.973   1.330
  318    HD2  HIS  42           HD2      HIS  42  -1.861  -4.762  -2.638
  319    HE1  HIS  42           HE1      HIS  42  -3.884  -4.856   1.090
  320    H    LYS  43           H        LYS  43  -0.807  -7.062  -3.401
  321    HA   LYS  43           HA       LYS  43  -3.478  -7.282  -3.346
  322    HB2  LYS  43           1HB      LYS  43  -2.378  -6.694  -5.390
  323    HB3  LYS  43           2HB      LYS  43  -1.612  -8.273  -5.502
  324    HG2  LYS  43           1HG      LYS  43  -3.381  -8.226  -7.078
  325    HG3  LYS  43           2HG      LYS  43  -3.893  -9.269  -5.749
  326    HD2  LYS  43           1HD      LYS  43  -4.900  -6.986  -4.846
  327    HD3  LYS  43           2HD      LYS  43  -4.893  -6.591  -6.567
  328    HE2  LYS  43           1HE      LYS  43  -6.074  -8.816  -6.919
  329    HE3  LYS  43           2HE      LYS  43  -6.313  -8.847  -5.173
  330    HZ1  LYS  43           3HZ      LYS  43  -8.054  -7.526  -5.415
  331    HZ2  LYS  43           1HZ      LYS  43  -7.841  -7.521  -7.094
  332    HZ3  LYS  43           2HZ      LYS  43  -7.097  -6.336  -6.144
  333    H    GLU  44           H        GLU  44  -1.239 -10.006  -3.467
  334    HA   GLU  44           HA       GLU  44  -2.801 -12.141  -4.004
  335    HB2  GLU  44           1HB      GLU  44  -0.541 -11.719  -2.122
  336    HB3  GLU  44           2HB      GLU  44  -1.455 -13.211  -1.948
  337    HG2  GLU  44           1HG      GLU  44   0.415 -13.625  -3.368
  338    HG3  GLU  44           2HG      GLU  44  -1.052 -13.683  -4.345
  339    H    GLN  45           H        GLN  45  -2.646 -10.474  -0.875
  340    HA   GLN  45           HA       GLN  45  -5.225 -11.714  -0.190
  341    HB2  GLN  45           1HB      GLN  45  -4.528 -11.900   2.135
  342    HB3  GLN  45           2HB      GLN  45  -3.426 -12.793   1.095
  343    HG2  GLN  45           1HG      GLN  45  -2.753  -9.988   1.816
  344    HG3  GLN  45           2HG      GLN  45  -2.537 -11.256   3.022
  345   HE21  GLN  45          1HE2      GLN  45  -1.464 -13.294   1.978
  346   HE22  GLN  45          2HE2      GLN  45  -0.033 -12.961   1.069
  347    H    CYS  46           H        CYS  46  -4.503  -9.093  -1.353
  348    HA   CYS  46           HA       CYS  46  -4.532  -6.973   0.387
  349    HB2  CYS  46           1HB      CYS  46  -4.332  -6.364  -1.846
  350    HB3  CYS  46           2HB      CYS  46  -5.685  -7.373  -2.348
  351    H    ASN  47           H        ASN  47  -5.871  -6.299   1.920
  352    HA   ASN  47           HA       ASN  47  -8.678  -7.191   1.820
  353    HB2  ASN  47           1HB      ASN  47  -7.173  -6.477   4.336
  354    HB3  ASN  47           2HB      ASN  47  -8.710  -7.326   4.195
  355   HD21  ASN  47          1HD2      ASN  47  -8.651  -9.446   3.137
  356   HD22  ASN  47          2HD2      ASN  47  -7.260 -10.444   3.374
  357    HA   PRO  48           HA       PRO  48  -9.156  -2.717   1.390
  358    HB2  PRO  48           1HB      PRO  48 -11.725  -2.862   0.523
  359    HB3  PRO  48           2HB      PRO  48 -10.336  -3.129  -0.538
  360    HG2  PRO  48           1HG      PRO  48 -12.100  -5.134   0.815
  361    HG3  PRO  48           2HG      PRO  48 -11.472  -5.135  -0.843
  362    HD2  PRO  48           1HD      PRO  48 -10.370  -6.623   1.133
  363    HD3  PRO  48           2HD      PRO  48  -9.411  -5.940  -0.196
  364    H    GLU  49           H        GLU  49 -10.155  -4.823   3.668
  365    HA   GLU  49           HA       GLU  49 -12.327  -3.329   4.824
  366    HB2  GLU  49           1HB      GLU  49 -10.711  -5.703   5.721
  367    HB3  GLU  49           2HB      GLU  49 -11.867  -4.923   6.792
  368    HG2  GLU  49           1HG      GLU  49 -12.876  -6.835   5.730
  369    HG3  GLU  49           2HG      GLU  49 -13.650  -5.354   5.169
  370    H    THR  50           H        THR  50 -11.980  -1.430   5.758
  371    HA   THR  50           HA       THR  50  -9.509  -1.057   7.321
  372    HB   THR  50           HB       THR  50  -9.655   0.463   5.398
  373    HG1  THR  50           HG1      THR  50  -8.596   1.433   7.035
  374   HG21  THR  50          3HG2      THR  50 -11.407   2.280   5.500
  375   HG22  THR  50          1HG2      THR  50 -12.251   1.288   6.688
  376   HG23  THR  50          2HG2      THR  50 -11.999   0.680   5.052
  377    H    SER  51           H        SER  51  -9.630  -0.014   9.329
  378    HA   SER  51           HA       SER  51 -12.322   0.375  10.437
  379    HB2  SER  51           1HB      SER  51 -11.736  -0.802  12.471
  380    HB3  SER  51           2HB      SER  51 -11.447  -1.870  11.098
  381    HG   SER  51           HG       SER  51  -9.494  -2.027  11.831
  382    H    GLY  52           H        GLY  52 -12.290   1.611  12.502
  383    HA2  GLY  52           1HA      GLY  52 -10.689   2.969  13.934
  384    HA3  GLY  52           2HA      GLY  52 -10.141   3.632  12.402
  385    HA   PRO  53           HA       PRO  53 -13.479   6.368  14.154
  386    HB2  PRO  53           1HB      PRO  53 -12.065   8.673  13.915
  387    HB3  PRO  53           2HB      PRO  53 -11.972   7.633  15.341
  388    HG2  PRO  53           1HG      PRO  53 -10.100   7.826  13.013
  389    HG3  PRO  53           2HG      PRO  53  -9.726   7.700  14.742
  390    HD2  PRO  53           1HD      PRO  53  -9.607   5.576  13.067
  391    HD3  PRO  53           2HD      PRO  53 -10.060   5.420  14.776
  392    H    SER  54           H        SER  54 -14.698   7.977  13.037
  393    HA   SER  54           HA       SER  54 -14.619   7.659  10.175
  394    HB2  SER  54           1HB      SER  54 -16.442   9.354  11.899
  395    HB3  SER  54           2HB      SER  54 -16.678   9.003  10.187
  396    HG   SER  54           HG       SER  54 -16.871   7.270  12.399
  397    H    SER  55           H        SER  55 -12.606   8.661   9.687
  398    HA   SER  55           HA       SER  55 -11.555  11.034  10.316
  399    HB2  SER  55           1HB      SER  55 -11.850   9.926   7.516
  400    HB3  SER  55           2HB      SER  55 -10.769  11.253   7.944
  401    HG   SER  55           HG       SER  55 -10.041   8.864   7.952
  402    H    GLY  56           H        GLY  56 -12.147  13.101  10.360
  403    HA2  GLY  56           1HA      GLY  56 -14.318  13.968   8.556
  404    HA3  GLY  56           2HA      GLY  56 -14.317  14.404  10.258
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1  21.017  32.871  24.524
    2    HA2  GLY   1           1HA      GLY   1  21.520  30.829  22.584
    3    HA3  GLY   1           2HA      GLY   1  20.614  30.211  23.958
    4    H    SER   2           H        SER   2  18.834  29.779  22.587
    5    HA   SER   2           HA       SER   2  17.179  32.145  22.116
    6    HB2  SER   2           1HB      SER   2  18.018  30.140  20.047
    7    HB3  SER   2           2HB      SER   2  16.444  30.925  19.919
    8    HG   SER   2           HG       SER   2  17.958  32.142  18.803
    9    H    SER   3           H        SER   3  14.883  31.552  21.695
   10    HA   SER   3           HA       SER   3  13.897  29.874  23.698
   11    HB2  SER   3           1HB      SER   3  11.701  30.198  22.662
   12    HB3  SER   3           2HB      SER   3  12.597  31.717  22.691
   13    HG   SER   3           HG       SER   3  12.036  31.698  20.644
   14    H    GLY   4           H        GLY   4  14.147  27.742  23.803
   15    HA2  GLY   4           1HA      GLY   4  14.787  26.048  21.679
   16    HA3  GLY   4           2HA      GLY   4  14.126  25.523  23.221
   17    H    SER   5           H        SER   5  13.456  24.104  21.036
   18    HA   SER   5           HA       SER   5  10.744  25.013  20.337
   19    HB2  SER   5           1HB      SER   5  12.427  22.944  18.906
   20    HB3  SER   5           2HB      SER   5  10.888  23.613  18.364
   21    HG   SER   5           HG       SER   5  13.425  24.818  18.455
   22    H    SER   6           H        SER   6   9.200  23.136  19.915
   23    HA   SER   6           HA       SER   6   9.572  20.659  21.223
   24    HB2  SER   6           1HB      SER   6   9.386  22.361  23.164
   25    HB3  SER   6           2HB      SER   6   7.678  22.446  22.733
   26    HG   SER   6           HG       SER   6   8.744  20.706  24.298
   27    H    GLY   7           H        GLY   7   7.813  19.254  20.943
   28    HA2  GLY   7           1HA      GLY   7   5.214  19.772  20.325
   29    HA3  GLY   7           2HA      GLY   7   6.048  20.004  18.796
   30    H    LEU   8           H        LEU   8   4.741  18.234  18.011
   31    HA   LEU   8           HA       LEU   8   5.917  15.632  18.718
   32    HB2  LEU   8           1HB      LEU   8   3.817  14.549  18.589
   33    HB3  LEU   8           2HB      LEU   8   3.620  15.937  19.657
   34    HG   LEU   8           HG       LEU   8   2.787  17.059  17.387
   35   HD11  LEU   8          1HD1      LEU   8   1.870  14.216  17.052
   36   HD12  LEU   8          2HD1      LEU   8   3.241  14.888  16.171
   37   HD13  LEU   8          3HD1      LEU   8   1.633  15.580  15.959
   38   HD21  LEU   8          3HD2      LEU   8   0.560  15.577  18.318
   39   HD22  LEU   8          1HD2      LEU   8   1.004  17.243  18.691
   40   HD23  LEU   8          2HD2      LEU   8   1.592  15.926  19.705
   41    H    LYS   9           H        LYS   9   6.073  14.116  17.026
   42    HA   LYS   9           HA       LYS   9   6.170  15.348  14.380
   43    HB2  LYS   9           1HB      LYS   9   7.368  12.858  15.566
   44    HB3  LYS   9           2HB      LYS   9   7.326  13.104  13.825
   45    HG2  LYS   9           1HG      LYS   9   8.408  15.425  14.504
   46    HG3  LYS   9           2HG      LYS   9   8.927  14.483  15.903
   47    HD2  LYS   9           1HD      LYS   9   9.675  12.746  14.112
   48    HD3  LYS   9           2HD      LYS   9   9.611  14.125  13.012
   49    HE2  LYS   9           1HE      LYS   9  11.794  14.233  13.712
   50    HE3  LYS   9           2HE      LYS   9  11.019  15.291  14.890
   51    HZ1  LYS   9           3HZ      LYS   9  11.535  13.918  16.547
   52    HZ2  LYS   9           1HZ      LYS   9  12.596  13.159  15.470
   53    HZ3  LYS   9           2HZ      LYS   9  11.038  12.541  15.700
   54    H    CYS  10           H        CYS  10   5.439  14.091  12.499
   55    HA   CYS  10           HA       CYS  10   2.882  12.794  13.089
   56    HB2  CYS  10           1HB      CYS  10   2.842  14.697  11.536
   57    HB3  CYS  10           2HB      CYS  10   3.975  13.864  10.479
   58    HG   CYS  10           HG       CYS  10   1.287  12.014  11.086
   59    H    SER  11           H        SER  11   2.577  10.681  12.814
   60    HA   SER  11           HA       SER  11   4.770   9.013  12.012
   61    HB2  SER  11           1HB      SER  11   1.980   8.510  13.000
   62    HB3  SER  11           2HB      SER  11   2.929   7.189  12.319
   63    HG   SER  11           HG       SER  11   3.105   7.514  14.655
   64    H    THR  12           H        THR  12   5.248   9.050   9.891
   65    HA   THR  12           HA       THR  12   3.129   8.997   7.899
   66    HB   THR  12           HB       THR  12   4.951   9.185   6.245
   67    HG1  THR  12           HG1      THR  12   7.095   9.657   7.292
   68   HG21  THR  12          3HG2      THR  12   5.325  11.176   8.481
   69   HG22  THR  12          1HG2      THR  12   3.958  11.195   7.368
   70   HG23  THR  12          2HG2      THR  12   5.595  11.434   6.757
   71    H    VAL  13           H        VAL  13   2.218   7.021   7.735
   72    HA   VAL  13           HA       VAL  13   3.212   4.547   8.230
   73    HB   VAL  13           HB       VAL  13   0.870   5.141   7.448
   74   HG11  VAL  13          1HG1      VAL  13   0.478   5.758   5.348
   75   HG12  VAL  13          2HG1      VAL  13   2.225   5.831   5.107
   76   HG13  VAL  13          3HG1      VAL  13   1.341   4.356   4.716
   77   HG21  VAL  13          3HG2      VAL  13   2.376   2.700   6.601
   78   HG22  VAL  13          1HG2      VAL  13   1.179   2.891   7.883
   79   HG23  VAL  13          2HG2      VAL  13   0.669   2.872   6.195
   80    H    VAL  14           H        VAL  14   4.245   2.907   7.060
   81    HA   VAL  14           HA       VAL  14   5.687   3.791   4.647
   82    HB   VAL  14           HB       VAL  14   7.620   2.441   5.367
   83   HG11  VAL  14          1HG1      VAL  14   7.512   4.093   7.715
   84   HG12  VAL  14          2HG1      VAL  14   8.454   4.307   6.238
   85   HG13  VAL  14          3HG1      VAL  14   6.812   4.942   6.338
   86   HG21  VAL  14          3HG2      VAL  14   7.699   1.203   7.266
   87   HG22  VAL  14          1HG2      VAL  14   6.643   2.300   8.156
   88   HG23  VAL  14          2HG2      VAL  14   5.955   1.145   7.014
   89    H    CYS  15           H        CYS  15   6.419   2.027   3.250
   90    HA   CYS  15           HA       CYS  15   4.460   0.352   2.390
   91    HB2  CYS  15           1HB      CYS  15   6.691   0.838   1.282
   92    HB3  CYS  15           2HB      CYS  15   7.376  -0.424   2.302
   93    H    VAL  16           H        VAL  16   3.447  -1.369   3.171
   94    HA   VAL  16           HA       VAL  16   4.303  -2.590   5.625
   95    HB   VAL  16           HB       VAL  16   2.293  -3.999   5.390
   96   HG11  VAL  16          1HG1      VAL  16   1.641  -1.123   4.779
   97   HG12  VAL  16          2HG1      VAL  16   0.691  -2.271   5.724
   98   HG13  VAL  16          3HG1      VAL  16   2.232  -1.677   6.345
   99   HG21  VAL  16          3HG2      VAL  16   0.726  -3.368   3.478
  100   HG22  VAL  16          1HG2      VAL  16   2.146  -2.666   2.701
  101   HG23  VAL  16          2HG2      VAL  16   2.108  -4.388   3.079
  102    H    ILE  17           H        ILE  17   5.709  -2.922   2.859
  103    HA   ILE  17           HA       ILE  17   5.936  -5.858   3.001
  104    HB   ILE  17           HB       ILE  17   6.507  -4.131   0.591
  105   HG12  ILE  17          1HG1      ILE  17   4.098  -4.166   1.170
  106   HG13  ILE  17          2HG1      ILE  17   4.433  -4.990  -0.349
  107   HG21  ILE  17          1HG2      ILE  17   6.737  -7.032   1.188
  108   HG22  ILE  17          2HG2      ILE  17   6.229  -6.552  -0.430
  109   HG23  ILE  17          3HG2      ILE  17   7.773  -5.992   0.211
  110   HD11  ILE  17          3HD1      ILE  17   3.575  -6.110   2.269
  111   HD12  ILE  17          1HD1      ILE  17   2.972  -6.441   0.645
  112   HD13  ILE  17          2HD1      ILE  17   4.518  -7.113   1.166
  113    H    CYS  18           H        CYS  18   7.807  -3.007   1.942
  114    HA   CYS  18           HA       CYS  18  10.230  -4.328   2.966
  115    HB2  CYS  18           1HB      CYS  18  11.495  -2.894   1.448
  116    HB3  CYS  18           2HB      CYS  18  10.268  -3.793   0.561
  117    H    LEU  19           H        LEU  19   8.084  -1.732   3.460
  118    HA   LEU  19           HA       LEU  19   7.994  -0.113   5.059
  119    HB2  LEU  19           1HB      LEU  19  10.602  -1.201   6.096
  120    HB3  LEU  19           2HB      LEU  19   9.425  -0.222   6.968
  121    HG   LEU  19           HG       LEU  19   8.582  -2.892   5.948
  122   HD11  LEU  19          1HD1      LEU  19   9.407  -3.452   8.487
  123   HD12  LEU  19          2HD1      LEU  19  10.716  -2.431   7.893
  124   HD13  LEU  19          3HD1      LEU  19  10.272  -3.895   7.015
  125   HD21  LEU  19          3HD2      LEU  19   7.933  -1.194   8.351
  126   HD22  LEU  19          1HD2      LEU  19   7.304  -2.821   8.093
  127   HD23  LEU  19          2HD2      LEU  19   6.900  -1.530   6.960
  128    H    GLU  20           H        GLU  20   8.850   0.703   2.668
  129    HA   GLU  20           HA       GLU  20  10.989   2.617   3.325
  130    HB2  GLU  20           1HB      GLU  20  10.557   1.155   0.717
  131    HB3  GLU  20           2HB      GLU  20  11.645   2.523   0.904
  132    HG2  GLU  20           1HG      GLU  20  12.000   0.247   2.761
  133    HG3  GLU  20           2HG      GLU  20  12.460   0.003   1.077
  134    H    LYS  21           H        LYS  21  10.921   4.607   2.021
  135    HA   LYS  21           HA       LYS  21   8.617   6.015   2.211
  136    HB2  LYS  21           1HB      LYS  21  10.933   6.258   0.326
  137    HB3  LYS  21           2HB      LYS  21   9.556   7.337   0.150
  138    HG2  LYS  21           1HG      LYS  21   9.910   8.321   2.239
  139    HG3  LYS  21           2HG      LYS  21  10.962   7.010   2.776
  140    HD2  LYS  21           1HD      LYS  21  12.437   8.757   2.296
  141    HD3  LYS  21           2HD      LYS  21  12.511   7.733   0.860
  142    HE2  LYS  21           1HE      LYS  21  12.319   9.869  -0.030
  143    HE3  LYS  21           2HE      LYS  21  10.658   9.279  -0.056
  144    HZ1  LYS  21           3HZ      LYS  21  11.870  11.349   1.618
  145    HZ2  LYS  21           1HZ      LYS  21  10.634  10.416   2.298
  146    HZ3  LYS  21           2HZ      LYS  21  10.344  11.306   0.889
  147    HA   PRO  22           HA       PRO  22   6.139   3.720  -0.800
  148    HB2  PRO  22           1HB      PRO  22   3.765   4.656   0.127
  149    HB3  PRO  22           2HB      PRO  22   4.633   3.318   0.889
  150    HG2  PRO  22           1HG      PRO  22   4.540   6.206   1.671
  151    HG3  PRO  22           2HG      PRO  22   4.448   4.765   2.700
  152    HD2  PRO  22           1HD      PRO  22   6.723   6.203   2.409
  153    HD3  PRO  22           2HD      PRO  22   6.731   4.448   2.678
  154    H    LYS  23           H        LYS  23   6.274   4.596  -2.778
  155    HA   LYS  23           HA       LYS  23   5.923   7.385  -3.288
  156    HB2  LYS  23           1HB      LYS  23   6.432   4.955  -4.944
  157    HB3  LYS  23           2HB      LYS  23   5.841   6.403  -5.749
  158    HG2  LYS  23           1HG      LYS  23   7.759   7.630  -4.631
  159    HG3  LYS  23           2HG      LYS  23   8.398   6.036  -4.220
  160    HD2  LYS  23           1HD      LYS  23   8.248   5.474  -6.675
  161    HD3  LYS  23           2HD      LYS  23   7.905   7.181  -6.963
  162    HE2  LYS  23           1HE      LYS  23  10.230   6.903  -7.299
  163    HE3  LYS  23           2HE      LYS  23  10.049   7.692  -5.734
  164    HZ1  LYS  23           3HZ      LYS  23  11.070   5.057  -6.368
  165    HZ2  LYS  23           1HZ      LYS  23  10.044   5.119  -5.024
  166    HZ3  LYS  23           2HZ      LYS  23  11.436   6.078  -5.069
  167    H    TYR  24           H        TYR  24   3.918   4.514  -3.640
  168    HA   TYR  24           HA       TYR  24   1.600   6.260  -4.053
  169    HB2  TYR  24           1HB      TYR  24   1.713   3.696  -5.583
  170    HB3  TYR  24           2HB      TYR  24   0.831   5.177  -5.943
  171    HD1  TYR  24           HD1      TYR  24   4.159   3.574  -6.042
  172    HD2  TYR  24           HD2      TYR  24   1.796   6.887  -7.287
  173    HE1  TYR  24           HE1      TYR  24   5.927   4.236  -7.619
  174    HE2  TYR  24           HE2      TYR  24   3.558   7.557  -8.868
  175    HH   TYR  24           HH       TYR  24   6.148   5.536  -9.698
  176    H    ARG  25           H        ARG  25  -0.477   4.825  -3.934
  177    HA   ARG  25           HA       ARG  25  -0.137   2.779  -1.849
  178    HB2  ARG  25           1HB      ARG  25  -1.881   5.212  -1.817
  179    HB3  ARG  25           2HB      ARG  25  -2.415   3.757  -0.987
  180    HG2  ARG  25           1HG      ARG  25  -0.297   3.776   0.302
  181    HG3  ARG  25           2HG      ARG  25   0.105   5.315  -0.461
  182    HD2  ARG  25           1HD      ARG  25  -2.518   4.997   0.930
  183    HD3  ARG  25           2HD      ARG  25  -1.057   5.259   1.881
  184    HE   ARG  25           HE       ARG  25  -2.358   7.160   0.113
  185   HH11  ARG  25          2HH1      ARG  25   0.434   6.353   2.029
  186   HH12  ARG  25          1HH1      ARG  25   0.993   7.989   2.141
  187   HH21  ARG  25          2HH2      ARG  25  -1.633   9.318   0.252
  188   HH22  ARG  25          1HH2      ARG  25  -0.184   9.675   1.130
  189    H    CYS  26           H        CYS  26  -2.078   1.388  -1.597
  190    HA   CYS  26           HA       CYS  26  -2.928   0.431  -4.144
  191    HB2  CYS  26           1HB      CYS  26  -2.527  -1.048  -2.193
  192    HB3  CYS  26           2HB      CYS  26  -3.927  -0.340  -1.395
  193    HA   PRO  27           HA       PRO  27  -6.460   3.101  -4.543
  194    HB2  PRO  27           1HB      PRO  27  -7.434   1.959  -6.805
  195    HB3  PRO  27           2HB      PRO  27  -6.043   3.050  -6.801
  196    HG2  PRO  27           1HG      PRO  27  -6.103   0.058  -6.878
  197    HG3  PRO  27           2HG      PRO  27  -5.089   1.181  -7.803
  198    HD2  PRO  27           1HD      PRO  27  -4.185  -0.135  -5.616
  199    HD3  PRO  27           2HD      PRO  27  -3.618   1.488  -6.056
  200    H    ALA  28           H        ALA  28  -6.400   0.130  -3.309
  201    HA   ALA  28           HA       ALA  28  -9.332  -0.183  -3.368
  202    HB1  ALA  28           3HB      ALA  28  -8.653  -2.611  -2.623
  203    HB2  ALA  28           1HB      ALA  28  -8.650  -2.148  -4.325
  204    HB3  ALA  28           2HB      ALA  28  -7.136  -2.192  -3.419
  205    H    CYS  29           H        CYS  29  -6.636  -1.272  -1.298
  206    HA   CYS  29           HA       CYS  29  -8.280  -0.762   1.056
  207    HB2  CYS  29           1HB      CYS  29  -6.360  -1.886   2.258
  208    HB3  CYS  29           2HB      CYS  29  -7.205  -2.890   1.084
  209    H    ARG  30           H        ARG  30  -5.846   0.747  -0.754
  210    HA   ARG  30           HA       ARG  30  -4.730   2.713  -0.487
  211    HB2  ARG  30           1HB      ARG  30  -6.304   3.009   2.077
  212    HB3  ARG  30           2HB      ARG  30  -5.460   4.285   1.211
  213    HG2  ARG  30           1HG      ARG  30  -7.613   2.741  -0.161
  214    HG3  ARG  30           2HG      ARG  30  -8.032   4.028   0.971
  215    HD2  ARG  30           1HD      ARG  30  -5.996   4.592  -1.123
  216    HD3  ARG  30           2HD      ARG  30  -7.689   4.500  -1.607
  217    HE   ARG  30           HE       ARG  30  -7.844   6.177   0.449
  218   HH11  ARG  30          2HH1      ARG  30  -5.610   6.070  -2.219
  219   HH12  ARG  30          1HH1      ARG  30  -5.348   7.783  -2.238
  220   HH21  ARG  30          2HH2      ARG  30  -7.508   8.433   0.434
  221   HH22  ARG  30          1HH2      ARG  30  -6.428   9.126  -0.728
  222    H    VAL  31           H        VAL  31  -3.240   0.641   0.085
  223    HA   VAL  31           HA       VAL  31  -2.006   1.126   2.711
  224    HB   VAL  31           HB       VAL  31  -0.822  -1.049   2.298
  225   HG11  VAL  31          1HG1      VAL  31  -2.464  -1.573   3.727
  226   HG12  VAL  31          2HG1      VAL  31  -3.666  -0.641   2.833
  227   HG13  VAL  31          3HG1      VAL  31  -3.263  -2.281   2.324
  228   HG21  VAL  31          3HG2      VAL  31  -0.967  -1.164  -0.103
  229   HG22  VAL  31          1HG2      VAL  31  -1.814  -2.548   0.589
  230   HG23  VAL  31          2HG2      VAL  31  -2.730  -1.175  -0.035
  231    HA   PRO  32           HA       PRO  32   1.571   2.930   0.910
  232    HB2  PRO  32           1HB      PRO  32   3.479   2.132   2.669
  233    HB3  PRO  32           2HB      PRO  32   2.274   3.366   3.053
  234    HG2  PRO  32           1HG      PRO  32   2.306   0.461   3.774
  235    HG3  PRO  32           2HG      PRO  32   1.873   1.858   4.777
  236    HD2  PRO  32           1HD      PRO  32   0.016   0.270   3.611
  237    HD3  PRO  32           2HD      PRO  32  -0.244   2.005   3.879
  238    H    TYR  33           H        TYR  33   2.614   2.296  -0.862
  239    HA   TYR  33           HA       TYR  33   4.219  -0.124  -0.828
  240    HB2  TYR  33           1HB      TYR  33   3.112  -1.308  -2.446
  241    HB3  TYR  33           2HB      TYR  33   1.735  -0.492  -1.712
  242    HD1  TYR  33           HD2      TYR  33   4.232  -0.039  -4.451
  243    HD2  TYR  33           HD1      TYR  33   0.271   0.679  -3.072
  244    HE1  TYR  33           HE2      TYR  33   3.656   0.938  -6.633
  245    HE2  TYR  33           HE1      TYR  33  -0.316   1.657  -5.251
  246    HH   TYR  33           HH       TYR  33   0.618   2.559  -7.177
  247    H    CYS  34           H        CYS  34   6.111   0.316  -1.731
  248    HA   CYS  34           HA       CYS  34   6.684   2.777  -2.971
  249    HB2  CYS  34           1HB      CYS  34   8.846   1.503  -3.655
  250    HB3  CYS  34           2HB      CYS  34   8.526   1.787  -1.947
  251    H    SER  35           H        SER  35   7.131  -0.411  -4.491
  252    HA   SER  35           HA       SER  35   6.173   0.771  -7.017
  253    HB2  SER  35           1HB      SER  35   8.394  -1.189  -6.475
  254    HB3  SER  35           2HB      SER  35   7.645  -1.073  -8.068
  255    HG   SER  35           HG       SER  35   8.121   1.331  -7.667
  256    H    VAL  36           H        VAL  36   5.623  -1.156  -8.613
  257    HA   VAL  36           HA       VAL  36   3.270  -2.336  -7.692
  258    HB   VAL  36           HB       VAL  36   3.291  -3.677  -9.736
  259   HG11  VAL  36          1HG1      VAL  36   3.503  -1.821 -11.371
  260   HG12  VAL  36          2HG1      VAL  36   2.564  -1.392  -9.939
  261   HG13  VAL  36          3HG1      VAL  36   4.229  -0.835 -10.102
  262   HG21  VAL  36          3HG2      VAL  36   5.425  -4.464 -10.085
  263   HG22  VAL  36          1HG2      VAL  36   5.342  -3.171 -11.282
  264   HG23  VAL  36          2HG2      VAL  36   6.173  -2.902  -9.749
  265    H    VAL  37           H        VAL  37   6.510  -3.734  -8.087
  266    HA   VAL  37           HA       VAL  37   6.161  -6.359  -7.605
  267    HB   VAL  37           HB       VAL  37   8.251  -4.626  -6.279
  268   HG11  VAL  37          1HG1      VAL  37   7.953  -7.597  -6.517
  269   HG12  VAL  37          2HG1      VAL  37   9.548  -6.853  -6.385
  270   HG13  VAL  37          3HG1      VAL  37   8.359  -6.629  -5.101
  271   HG21  VAL  37          3HG2      VAL  37   8.015  -4.642  -8.833
  272   HG22  VAL  37          1HG2      VAL  37   9.607  -4.981  -8.152
  273   HG23  VAL  37          2HG2      VAL  37   8.601  -6.303  -8.744
  274    H    CYS  38           H        CYS  38   6.611  -4.019  -4.945
  275    HA   CYS  38           HA       CYS  38   6.001  -5.791  -2.871
  276    HB2  CYS  38           1HB      CYS  38   6.093  -2.826  -3.157
  277    HB3  CYS  38           2HB      CYS  38   5.293  -3.487  -1.735
  278    H    PHE  39           H        PHE  39   3.935  -3.827  -4.911
  279    HA   PHE  39           HA       PHE  39   1.564  -4.144  -3.379
  280    HB2  PHE  39           1HB      PHE  39   1.666  -2.324  -4.928
  281    HB3  PHE  39           2HB      PHE  39   2.034  -3.404  -6.268
  282    HD1  PHE  39           HD1      PHE  39  -0.593  -3.480  -3.623
  283    HD2  PHE  39           HD2      PHE  39   0.309  -3.344  -7.781
  284    HE1  PHE  39           HE1      PHE  39  -2.992  -3.642  -4.145
  285    HE2  PHE  39           HE2      PHE  39  -2.089  -3.505  -8.309
  286    HZ   PHE  39           HZ       PHE  39  -3.743  -3.653  -6.491
  287    H    ARG  40           H        ARG  40   3.067  -5.979  -5.968
  288    HA   ARG  40           HA       ARG  40   0.966  -7.622  -6.723
  289    HB2  ARG  40           1HB      ARG  40   3.892  -8.348  -6.488
  290    HB3  ARG  40           2HB      ARG  40   2.690  -9.246  -7.406
  291    HG2  ARG  40           1HG      ARG  40   2.317  -7.038  -8.671
  292    HG3  ARG  40           2HG      ARG  40   3.862  -6.552  -7.970
  293    HD2  ARG  40           1HD      ARG  40   4.502  -7.462  -9.998
  294    HD3  ARG  40           2HD      ARG  40   4.711  -8.819  -8.891
  295    HE   ARG  40           HE       ARG  40   2.150  -8.664 -10.244
  296   HH11  ARG  40          2HH1      ARG  40   5.363 -10.002 -10.186
  297   HH12  ARG  40          1HH1      ARG  40   4.964 -11.342 -11.208
  298   HH21  ARG  40          2HH2      ARG  40   1.612 -10.424 -11.591
  299   HH22  ARG  40          1HH2      ARG  40   2.831 -11.581 -12.008
  300    H    LYS  41           H        LYS  41   3.574  -8.664  -4.527
  301    HA   LYS  41           HA       LYS  41   2.459 -10.944  -3.544
  302    HB2  LYS  41           1HB      LYS  41   4.004  -8.925  -1.906
  303    HB3  LYS  41           2HB      LYS  41   3.807 -10.631  -1.526
  304    HG2  LYS  41           1HG      LYS  41   5.231 -11.308  -3.216
  305    HG3  LYS  41           2HG      LYS  41   5.037  -9.804  -4.120
  306    HD2  LYS  41           1HD      LYS  41   6.387  -8.604  -2.575
  307    HD3  LYS  41           2HD      LYS  41   6.377  -9.944  -1.426
  308    HE2  LYS  41           1HE      LYS  41   7.633 -11.310  -3.036
  309    HE3  LYS  41           2HE      LYS  41   7.662  -9.949  -4.157
  310    HZ1  LYS  41           3HZ      LYS  41   8.840  -9.901  -1.432
  311    HZ2  LYS  41           1HZ      LYS  41   8.962  -8.691  -2.608
  312    HZ3  LYS  41           2HZ      LYS  41   9.719 -10.184  -2.849
  313    H    HIS  42           H        HIS  42   1.796  -7.643  -2.473
  314    HA   HIS  42           HA       HIS  42   0.145  -8.333  -0.285
  315    HB2  HIS  42           1HB      HIS  42   0.750  -6.141  -0.098
  316    HB3  HIS  42           2HB      HIS  42   0.727  -5.875  -1.839
  317    HD1  HIS  42           HD1      HIS  42  -1.482  -5.822   1.184
  318    HD2  HIS  42           HD2      HIS  42  -1.698  -4.965  -2.876
  319    HE1  HIS  42           HE1      HIS  42  -3.657  -4.601   0.870
  320    H    LYS  43           H        LYS  43  -0.576  -7.542  -3.665
  321    HA   LYS  43           HA       LYS  43  -3.273  -7.389  -3.722
  322    HB2  LYS  43           1HB      LYS  43  -1.776  -7.307  -5.710
  323    HB3  LYS  43           2HB      LYS  43  -1.651  -9.060  -5.650
  324    HG2  LYS  43           1HG      LYS  43  -3.250  -8.449  -7.322
  325    HG3  LYS  43           2HG      LYS  43  -4.100  -9.204  -5.972
  326    HD2  LYS  43           1HD      LYS  43  -4.795  -7.044  -5.147
  327    HD3  LYS  43           2HD      LYS  43  -3.835  -6.226  -6.382
  328    HE2  LYS  43           1HE      LYS  43  -6.129  -8.095  -6.960
  329    HE3  LYS  43           2HE      LYS  43  -6.268  -6.339  -6.897
  330    HZ1  LYS  43           3HZ      LYS  43  -5.469  -6.171  -8.946
  331    HZ2  LYS  43           1HZ      LYS  43  -5.604  -7.851  -9.086
  332    HZ3  LYS  43           2HZ      LYS  43  -4.140  -7.158  -8.602
  333    H    GLU  44           H        GLU  44  -1.434 -10.436  -3.700
  334    HA   GLU  44           HA       GLU  44  -3.507 -12.241  -3.819
  335    HB2  GLU  44           1HB      GLU  44  -1.975 -13.820  -3.241
  336    HB3  GLU  44           2HB      GLU  44  -0.858 -12.496  -3.544
  337    HG2  GLU  44           1HG      GLU  44  -0.729 -12.005  -1.192
  338    HG3  GLU  44           2HG      GLU  44  -1.957 -13.219  -0.837
  339    H    GLN  45           H        GLN  45  -2.360 -10.402  -1.047
  340    HA   GLN  45           HA       GLN  45  -4.599 -11.488   0.529
  341    HB2  GLN  45           1HB      GLN  45  -3.299 -10.942   2.539
  342    HB3  GLN  45           2HB      GLN  45  -2.435 -12.065   1.496
  343    HG2  GLN  45           1HG      GLN  45  -0.783 -10.588   2.119
  344    HG3  GLN  45           2HG      GLN  45  -1.293  -9.949   0.557
  345   HE21  GLN  45          1HE2      GLN  45  -1.875  -9.618   4.030
  346   HE22  GLN  45          2HE2      GLN  45  -2.184  -7.919   3.995
  347    H    CYS  46           H        CYS  46  -4.577  -9.214  -1.369
  348    HA   CYS  46           HA       CYS  46  -4.696  -6.811   0.185
  349    HB2  CYS  46           1HB      CYS  46  -4.126  -6.546  -2.105
  350    HB3  CYS  46           2HB      CYS  46  -5.509  -7.497  -2.636
  351    H    ASN  47           H        ASN  47  -6.218  -6.654   1.713
  352    HA   ASN  47           HA       ASN  47  -8.982  -7.378   0.990
  353    HB2  ASN  47           1HB      ASN  47  -7.632  -7.385   3.696
  354    HB3  ASN  47           2HB      ASN  47  -9.359  -7.629   3.455
  355   HD21  ASN  47          1HD2      ASN  47  -7.259  -9.388   4.553
  356   HD22  ASN  47          2HD2      ASN  47  -7.351 -10.844   3.627
  357    HA   PRO  48           HA       PRO  48  -9.275  -2.870   1.317
  358    HB2  PRO  48           1HB      PRO  48 -11.611  -2.715  -0.057
  359    HB3  PRO  48           2HB      PRO  48 -10.037  -2.853  -0.850
  360    HG2  PRO  48           1HG      PRO  48 -12.069  -4.979  -0.292
  361    HG3  PRO  48           2HG      PRO  48 -11.112  -4.704  -1.759
  362    HD2  PRO  48           1HD      PRO  48 -10.463  -6.590   0.072
  363    HD3  PRO  48           2HD      PRO  48  -9.241  -5.723  -0.881
  364    H    GLU  49           H        GLU  49 -11.404  -1.519   1.805
  365    HA   GLU  49           HA       GLU  49 -12.214  -2.226   4.410
  366    HB2  GLU  49           1HB      GLU  49 -13.877  -0.338   4.105
  367    HB3  GLU  49           2HB      GLU  49 -12.185   0.080   3.872
  368    HG2  GLU  49           1HG      GLU  49 -13.792  -0.704   1.499
  369    HG3  GLU  49           2HG      GLU  49 -14.041   0.892   2.205
  370    H    THR  50           H        THR  50 -13.276  -4.138   4.596
  371    HA   THR  50           HA       THR  50 -15.849  -4.363   3.175
  372    HB   THR  50           HB       THR  50 -14.248  -6.041   2.351
  373    HG1  THR  50           HG1      THR  50 -16.169  -7.364   3.968
  374   HG21  THR  50          3HG2      THR  50 -12.771  -6.464   4.111
  375   HG22  THR  50          1HG2      THR  50 -13.737  -7.937   4.026
  376   HG23  THR  50          2HG2      THR  50 -14.076  -6.731   5.267
  377    H    SER  51           H        SER  51 -17.559  -5.420   4.315
  378    HA   SER  51           HA       SER  51 -17.862  -4.610   6.967
  379    HB2  SER  51           1HB      SER  51 -19.353  -6.457   5.153
  380    HB3  SER  51           2HB      SER  51 -19.743  -6.480   6.873
  381    HG   SER  51           HG       SER  51 -20.982  -4.864   6.293
  382    H    GLY  52           H        GLY  52 -17.210  -7.868   5.677
  383    HA2  GLY  52           1HA      GLY  52 -16.376  -9.755   6.687
  384    HA3  GLY  52           2HA      GLY  52 -15.392  -8.637   7.619
  385    HA   PRO  53           HA       PRO  53 -17.832 -10.823  10.776
  386    HB2  PRO  53           1HB      PRO  53 -15.979 -10.490  12.733
  387    HB3  PRO  53           2HB      PRO  53 -15.889 -11.786  11.534
  388    HG2  PRO  53           1HG      PRO  53 -14.456  -9.158  11.595
  389    HG3  PRO  53           2HG      PRO  53 -13.828 -10.765  11.185
  390    HD2  PRO  53           1HD      PRO  53 -14.503  -8.940   9.301
  391    HD3  PRO  53           2HD      PRO  53 -14.678 -10.688   9.043
  392    H    SER  54           H        SER  54 -18.937 -10.068  12.605
  393    HA   SER  54           HA       SER  54 -19.134  -7.167  12.760
  394    HB2  SER  54           1HB      SER  54 -20.831  -9.358  13.978
  395    HB3  SER  54           2HB      SER  54 -21.153  -7.633  14.148
  396    HG   SER  54           HG       SER  54 -22.245  -8.870  12.377
  397    H    SER  55           H        SER  55 -18.812  -9.888  15.040
  398    HA   SER  55           HA       SER  55 -17.432  -8.048  16.883
  399    HB2  SER  55           1HB      SER  55 -18.398  -9.206  18.760
  400    HB3  SER  55           2HB      SER  55 -19.710  -8.772  17.664
  401    HG   SER  55           HG       SER  55 -18.438 -11.309  17.771
  402    H    GLY  56           H        GLY  56 -16.207  -9.469  18.621
  403    HA2  GLY  56           1HA      GLY  56 -14.960 -11.540  18.937
  404    HA3  GLY  56           2HA      GLY  56 -14.799 -11.634  17.190
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1  13.660  35.033  28.083
    2    HA2  GLY   1           1HA      GLY   1  14.829  32.868  29.260
    3    HA3  GLY   1           2HA      GLY   1  13.110  32.515  29.358
    4    H    SER   2           H        SER   2  15.301  33.872  26.889
    5    HA   SER   2           HA       SER   2  13.988  33.137  24.629
    6    HB2  SER   2           1HB      SER   2  15.992  34.404  24.408
    7    HB3  SER   2           2HB      SER   2  16.956  33.150  25.187
    8    HG   SER   2           HG       SER   2  16.508  31.813  23.369
    9    H    SER   3           H        SER   3  16.137  31.077  26.551
   10    HA   SER   3           HA       SER   3  16.046  28.824  24.866
   11    HB2  SER   3           1HB      SER   3  17.541  29.401  26.977
   12    HB3  SER   3           2HB      SER   3  16.303  28.473  27.823
   13    HG   SER   3           HG       SER   3  17.187  26.737  27.064
   14    H    GLY   4           H        GLY   4  14.383  27.566  24.375
   15    HA2  GLY   4           1HA      GLY   4  12.785  26.019  25.744
   16    HA3  GLY   4           2HA      GLY   4  12.039  27.560  26.139
   17    H    SER   5           H        SER   5  12.569  25.172  23.670
   18    HA   SER   5           HA       SER   5  10.623  26.572  21.953
   19    HB2  SER   5           1HB      SER   5  11.671  25.432  20.029
   20    HB3  SER   5           2HB      SER   5  12.827  26.449  20.890
   21    HG   SER   5           HG       SER   5  12.608  23.639  20.860
   22    H    SER   6           H        SER   6   9.033  25.330  20.916
   23    HA   SER   6           HA       SER   6   8.158  23.051  22.427
   24    HB2  SER   6           1HB      SER   6   6.164  23.137  21.082
   25    HB3  SER   6           2HB      SER   6   6.615  24.795  21.478
   26    HG   SER   6           HG       SER   6   7.360  23.512  19.063
   27    H    GLY   7           H        GLY   7   7.295  21.093  21.166
   28    HA2  GLY   7           1HA      GLY   7   9.343  20.277  19.196
   29    HA3  GLY   7           2HA      GLY   7   8.706  19.191  20.423
   30    H    LEU   8           H        LEU   8   8.421  20.239  17.247
   31    HA   LEU   8           HA       LEU   8   5.623  19.626  16.909
   32    HB2  LEU   8           1HB      LEU   8   7.141  21.261  15.558
   33    HB3  LEU   8           2HB      LEU   8   7.570  19.813  14.650
   34    HG   LEU   8           HG       LEU   8   4.949  19.588  14.432
   35   HD11  LEU   8          1HD1      LEU   8   3.695  21.415  14.787
   36   HD12  LEU   8          2HD1      LEU   8   4.954  22.516  14.227
   37   HD13  LEU   8          3HD1      LEU   8   5.004  21.883  15.873
   38   HD21  LEU   8          3HD2      LEU   8   5.975  21.711  12.671
   39   HD22  LEU   8          1HD2      LEU   8   5.273  20.142  12.275
   40   HD23  LEU   8          2HD2      LEU   8   6.965  20.253  12.761
   41    H    LYS   9           H        LYS   9   5.526  17.477  17.690
   42    HA   LYS   9           HA       LYS   9   7.098  15.377  16.581
   43    HB2  LYS   9           1HB      LYS   9   4.561  15.412  18.209
   44    HB3  LYS   9           2HB      LYS   9   5.297  13.916  17.652
   45    HG2  LYS   9           1HG      LYS   9   6.974  15.866  19.148
   46    HG3  LYS   9           2HG      LYS   9   5.813  14.874  20.033
   47    HD2  LYS   9           1HD      LYS   9   7.628  13.491  20.112
   48    HD3  LYS   9           2HD      LYS   9   6.914  12.945  18.592
   49    HE2  LYS   9           1HE      LYS   9   8.534  13.944  17.316
   50    HE3  LYS   9           2HE      LYS   9   8.861  15.194  18.515
   51    HZ1  LYS   9           3HZ      LYS   9  10.474  13.134  18.081
   52    HZ2  LYS   9           1HZ      LYS   9   9.505  12.471  19.299
   53    HZ3  LYS   9           2HZ      LYS   9  10.351  13.908  19.580
   54    H    CYS  10           H        CYS  10   6.227  13.554  15.342
   55    HA   CYS  10           HA       CYS  10   3.804  13.785  13.880
   56    HB2  CYS  10           1HB      CYS  10   4.657  14.240  11.675
   57    HB3  CYS  10           2HB      CYS  10   5.182  15.535  12.744
   58    HG   CYS  10           HG       CYS  10   7.284  15.071  11.030
   59    H    SER  11           H        SER  11   3.706  12.102  12.099
   60    HA   SER  11           HA       SER  11   5.609   9.924  12.371
   61    HB2  SER  11           1HB      SER  11   3.916   8.263  12.963
   62    HB3  SER  11           2HB      SER  11   3.980   9.525  14.193
   63    HG   SER  11           HG       SER  11   1.863   8.721  12.955
   64    H    THR  12           H        THR  12   5.615   8.515  10.634
   65    HA   THR  12           HA       THR  12   3.637   8.962   8.515
   66    HB   THR  12           HB       THR  12   5.605  10.368   7.991
   67    HG1  THR  12           HG1      THR  12   5.145   9.885   5.990
   68   HG21  THR  12          3HG2      THR  12   7.690   9.138   7.262
   69   HG22  THR  12          1HG2      THR  12   7.043   7.721   8.088
   70   HG23  THR  12          2HG2      THR  12   7.403   9.187   9.001
   71    H    VAL  13           H        VAL  13   3.130   7.177   7.320
   72    HA   VAL  13           HA       VAL  13   4.032   4.631   8.359
   73    HB   VAL  13           HB       VAL  13   1.634   5.091   7.787
   74   HG11  VAL  13          1HG1      VAL  13   1.432   4.509   5.129
   75   HG12  VAL  13          2HG1      VAL  13   1.320   6.127   5.824
   76   HG13  VAL  13          3HG1      VAL  13   2.853   5.553   5.167
   77   HG21  VAL  13          3HG2      VAL  13   3.002   2.774   6.426
   78   HG22  VAL  13          1HG2      VAL  13   2.374   2.822   8.073
   79   HG23  VAL  13          2HG2      VAL  13   1.264   2.884   6.704
   80    H    VAL  14           H        VAL  14   4.829   2.910   7.017
   81    HA   VAL  14           HA       VAL  14   6.134   3.795   4.533
   82    HB   VAL  14           HB       VAL  14   8.122   2.439   5.124
   83   HG11  VAL  14          1HG1      VAL  14   8.655   4.056   7.230
   84   HG12  VAL  14          2HG1      VAL  14   8.725   4.567   5.543
   85   HG13  VAL  14          3HG1      VAL  14   7.284   4.895   6.506
   86   HG21  VAL  14          3HG2      VAL  14   7.459   0.868   6.686
   87   HG22  VAL  14          1HG2      VAL  14   8.324   2.034   7.686
   88   HG23  VAL  14          2HG2      VAL  14   6.561   2.045   7.644
   89    H    CYS  15           H        CYS  15   6.567   2.134   3.005
   90    HA   CYS  15           HA       CYS  15   4.652   0.424   2.319
   91    HB2  CYS  15           1HB      CYS  15   6.862   0.820   1.128
   92    HB3  CYS  15           2HB      CYS  15   7.536  -0.448   2.147
   93    H    VAL  16           H        VAL  16   3.610  -1.235   3.188
   94    HA   VAL  16           HA       VAL  16   4.551  -2.448   5.622
   95    HB   VAL  16           HB       VAL  16   2.460  -3.750   5.543
   96   HG11  VAL  16          1HG1      VAL  16   2.411  -1.575   6.583
   97   HG12  VAL  16          2HG1      VAL  16   2.156  -0.795   5.021
   98   HG13  VAL  16          3HG1      VAL  16   0.904  -1.832   5.705
   99   HG21  VAL  16          3HG2      VAL  16   0.831  -2.905   3.675
  100   HG22  VAL  16          1HG2      VAL  16   2.329  -2.579   2.803
  101   HG23  VAL  16          2HG2      VAL  16   1.963  -4.217   3.345
  102    H    ILE  17           H        ILE  17   5.792  -2.893   2.810
  103    HA   ILE  17           HA       ILE  17   5.857  -5.836   2.976
  104    HB   ILE  17           HB       ILE  17   6.385  -4.176   0.510
  105   HG12  ILE  17          1HG1      ILE  17   4.012  -4.072   1.240
  106   HG13  ILE  17          2HG1      ILE  17   4.215  -4.905  -0.297
  107   HG21  ILE  17          1HG2      ILE  17   6.180  -7.141   0.986
  108   HG22  ILE  17          2HG2      ILE  17   6.150  -6.405  -0.615
  109   HG23  ILE  17          3HG2      ILE  17   7.577  -6.233   0.407
  110   HD11  ILE  17          3HD1      ILE  17   3.609  -6.077   2.394
  111   HD12  ILE  17          1HD1      ILE  17   2.661  -6.171   0.910
  112   HD13  ILE  17          2HD1      ILE  17   4.180  -7.057   1.044
  113    H    CYS  18           H        CYS  18   7.806  -3.069   1.841
  114    HA   CYS  18           HA       CYS  18  10.215  -4.527   2.699
  115    HB2  CYS  18           1HB      CYS  18  11.465  -3.183   1.113
  116    HB3  CYS  18           2HB      CYS  18  10.105  -3.941   0.290
  117    H    LEU  19           H        LEU  19   8.256  -1.786   3.283
  118    HA   LEU  19           HA       LEU  19   8.330  -0.212   4.932
  119    HB2  LEU  19           1HB      LEU  19  10.980  -1.331   5.796
  120    HB3  LEU  19           2HB      LEU  19   9.812  -0.426   6.757
  121    HG   LEU  19           HG       LEU  19   9.267  -3.187   5.684
  122   HD11  LEU  19          1HD1      LEU  19  11.148  -3.465   7.093
  123   HD12  LEU  19          2HD1      LEU  19   9.734  -3.906   8.051
  124   HD13  LEU  19          3HD1      LEU  19  10.507  -2.339   8.290
  125   HD21  LEU  19          3HD2      LEU  19   7.211  -2.571   6.332
  126   HD22  LEU  19          1HD2      LEU  19   7.810  -1.210   7.281
  127   HD23  LEU  19          2HD2      LEU  19   7.821  -2.835   7.966
  128    H    GLU  20           H        GLU  20   8.965   0.693   2.559
  129    HA   GLU  20           HA       GLU  20  11.213   2.513   3.069
  130    HB2  GLU  20           1HB      GLU  20  10.644   1.107   0.454
  131    HB3  GLU  20           2HB      GLU  20  11.835   2.381   0.673
  132    HG2  GLU  20           1HG      GLU  20  12.828   0.826   2.476
  133    HG3  GLU  20           2HG      GLU  20  11.873  -0.429   1.687
  134    H    LYS  21           H        LYS  21  11.104   4.520   1.852
  135    HA   LYS  21           HA       LYS  21   8.795   5.918   2.078
  136    HB2  LYS  21           1HB      LYS  21  10.815   7.082   1.578
  137    HB3  LYS  21           2HB      LYS  21  11.001   6.237   0.046
  138    HG2  LYS  21           1HG      LYS  21   9.073   7.393  -0.858
  139    HG3  LYS  21           2HG      LYS  21   8.808   8.198   0.691
  140    HD2  LYS  21           1HD      LYS  21  10.814   9.444   0.488
  141    HD3  LYS  21           2HD      LYS  21  11.371   8.458  -0.866
  142    HE2  LYS  21           1HE      LYS  21   8.793   9.922  -1.133
  143    HE3  LYS  21           2HE      LYS  21  10.295  10.839  -1.241
  144    HZ1  LYS  21           3HZ      LYS  21   9.732  10.195  -3.422
  145    HZ2  LYS  21           1HZ      LYS  21   9.413   8.597  -2.966
  146    HZ3  LYS  21           2HZ      LYS  21  11.002   9.177  -2.960
  147    HA   PRO  22           HA       PRO  22   6.324   3.699  -0.992
  148    HB2  PRO  22           1HB      PRO  22   3.948   4.615  -0.050
  149    HB3  PRO  22           2HB      PRO  22   4.813   3.260   0.683
  150    HG2  PRO  22           1HG      PRO  22   4.720   6.129   1.531
  151    HG3  PRO  22           2HG      PRO  22   4.624   4.665   2.526
  152    HD2  PRO  22           1HD      PRO  22   6.902   6.107   2.274
  153    HD3  PRO  22           2HD      PRO  22   6.907   4.347   2.503
  154    H    LYS  23           H        LYS  23   6.135   4.497  -2.979
  155    HA   LYS  23           HA       LYS  23   5.911   7.340  -3.433
  156    HB2  LYS  23           1HB      LYS  23   6.204   4.947  -5.235
  157    HB3  LYS  23           2HB      LYS  23   5.879   6.549  -5.884
  158    HG2  LYS  23           1HG      LYS  23   7.934   7.310  -4.583
  159    HG3  LYS  23           2HG      LYS  23   8.299   5.594  -4.392
  160    HD2  LYS  23           1HD      LYS  23   8.318   5.315  -6.814
  161    HD3  LYS  23           2HD      LYS  23   7.902   7.018  -7.025
  162    HE2  LYS  23           1HE      LYS  23  10.392   6.024  -5.646
  163    HE3  LYS  23           2HE      LYS  23  10.320   6.519  -7.336
  164    HZ1  LYS  23           3HZ      LYS  23  11.060   8.206  -5.547
  165    HZ2  LYS  23           1HZ      LYS  23   9.405   8.361  -5.231
  166    HZ3  LYS  23           2HZ      LYS  23  10.009   8.713  -6.771
  167    H    TYR  24           H        TYR  24   3.865   4.503  -3.678
  168    HA   TYR  24           HA       TYR  24   1.562   6.267  -4.088
  169    HB2  TYR  24           1HB      TYR  24   1.557   3.664  -5.539
  170    HB3  TYR  24           2HB      TYR  24   0.753   5.177  -5.943
  171    HD1  TYR  24           HD1      TYR  24   3.994   3.402  -6.007
  172    HD2  TYR  24           HD2      TYR  24   1.785   6.773  -7.370
  173    HE1  TYR  24           HE1      TYR  24   5.776   3.908  -7.624
  174    HE2  TYR  24           HE2      TYR  24   3.561   7.288  -8.992
  175    HH   TYR  24           HH       TYR  24   5.756   5.266 -10.019
  176    H    ARG  25           H        ARG  25  -0.529   4.857  -3.882
  177    HA   ARG  25           HA       ARG  25  -0.159   2.893  -1.722
  178    HB2  ARG  25           1HB      ARG  25  -1.819   5.362  -1.758
  179    HB3  ARG  25           2HB      ARG  25  -2.498   3.941  -0.977
  180    HG2  ARG  25           1HG      ARG  25  -0.425   3.809   0.409
  181    HG3  ARG  25           2HG      ARG  25   0.062   5.357  -0.283
  182    HD2  ARG  25           1HD      ARG  25  -2.458   4.831   1.289
  183    HD3  ARG  25           2HD      ARG  25  -1.016   5.648   1.891
  184    HE   ARG  25           HE       ARG  25  -1.704   7.113  -0.279
  185   HH11  ARG  25          2HH1      ARG  25  -3.440   6.037   2.540
  186   HH12  ARG  25          1HH1      ARG  25  -4.504   7.404   2.568
  187   HH21  ARG  25          2HH2      ARG  25  -3.099   8.917  -0.254
  188   HH22  ARG  25          1HH2      ARG  25  -4.310   9.041   0.977
  189    H    CYS  26           H        CYS  26  -2.079   1.495  -1.396
  190    HA   CYS  26           HA       CYS  26  -2.972   0.466  -3.913
  191    HB2  CYS  26           1HB      CYS  26  -2.436  -0.978  -1.962
  192    HB3  CYS  26           2HB      CYS  26  -3.838  -0.320  -1.124
  193    HA   PRO  27           HA       PRO  27  -6.605   3.013  -4.175
  194    HB2  PRO  27           1HB      PRO  27  -7.640   1.819  -6.382
  195    HB3  PRO  27           2HB      PRO  27  -6.287   2.955  -6.450
  196    HG2  PRO  27           1HG      PRO  27  -6.253  -0.038  -6.499
  197    HG3  PRO  27           2HG      PRO  27  -5.318   1.108  -7.478
  198    HD2  PRO  27           1HD      PRO  27  -4.275  -0.157  -5.323
  199    HD3  PRO  27           2HD      PRO  27  -3.781   1.480  -5.801
  200    H    ALA  28           H        ALA  28  -6.394   0.069  -2.908
  201    HA   ALA  28           HA       ALA  28  -9.313  -0.347  -2.842
  202    HB1  ALA  28           3HB      ALA  28  -8.637  -2.313  -3.778
  203    HB2  ALA  28           1HB      ALA  28  -7.054  -2.268  -3.000
  204    HB3  ALA  28           2HB      ALA  28  -8.479  -2.738  -2.073
  205    H    CYS  29           H        CYS  29  -6.497  -1.311  -0.872
  206    HA   CYS  29           HA       CYS  29  -8.061  -0.806   1.541
  207    HB2  CYS  29           1HB      CYS  29  -6.051  -1.867   2.673
  208    HB3  CYS  29           2HB      CYS  29  -6.960  -2.910   1.584
  209    H    ARG  30           H        ARG  30  -5.770   0.742  -0.399
  210    HA   ARG  30           HA       ARG  30  -4.669   2.724  -0.205
  211    HB2  ARG  30           1HB      ARG  30  -6.183   2.994   2.399
  212    HB3  ARG  30           2HB      ARG  30  -5.332   4.285   1.562
  213    HG2  ARG  30           1HG      ARG  30  -7.486   2.795   0.140
  214    HG3  ARG  30           2HG      ARG  30  -7.914   4.030   1.327
  215    HD2  ARG  30           1HD      ARG  30  -5.985   4.541  -0.923
  216    HD3  ARG  30           2HD      ARG  30  -7.724   4.782  -1.092
  217    HE   ARG  30           HE       ARG  30  -6.576   6.138   1.170
  218   HH11  ARG  30          2HH1      ARG  30  -7.278   6.327  -2.235
  219   HH12  ARG  30          1HH1      ARG  30  -7.285   8.059  -2.270
  220   HH21  ARG  30          2HH2      ARG  30  -6.583   8.418   1.136
  221   HH22  ARG  30          1HH2      ARG  30  -6.889   9.248  -0.352
  222    H    VAL  31           H        VAL  31  -3.113   0.689   0.325
  223    HA   VAL  31           HA       VAL  31  -1.762   1.253   2.878
  224    HB   VAL  31           HB       VAL  31  -0.578  -0.925   2.469
  225   HG11  VAL  31          1HG1      VAL  31  -3.350  -0.487   3.210
  226   HG12  VAL  31          2HG1      VAL  31  -3.061  -2.130   2.634
  227   HG13  VAL  31          3HG1      VAL  31  -2.119  -1.488   3.980
  228   HG21  VAL  31          3HG2      VAL  31  -2.601  -1.123   0.242
  229   HG22  VAL  31          1HG2      VAL  31  -0.844  -1.136   0.094
  230   HG23  VAL  31          2HG2      VAL  31  -1.673  -2.486   0.867
  231    HA   PRO  32           HA       PRO  32   1.700   3.029   0.838
  232    HB2  PRO  32           1HB      PRO  32   3.700   2.312   2.528
  233    HB3  PRO  32           2HB      PRO  32   2.502   3.548   2.928
  234    HG2  PRO  32           1HG      PRO  32   2.602   0.670   3.748
  235    HG3  PRO  32           2HG      PRO  32   2.203   2.098   4.721
  236    HD2  PRO  32           1HD      PRO  32   0.308   0.452   3.705
  237    HD3  PRO  32           2HD      PRO  32   0.043   2.193   3.925
  238    H    TYR  33           H        TYR  33   2.724   2.368  -0.935
  239    HA   TYR  33           HA       TYR  33   4.300  -0.074  -0.899
  240    HB2  TYR  33           1HB      TYR  33   3.135  -1.264  -2.465
  241    HB3  TYR  33           2HB      TYR  33   1.787  -0.394  -1.743
  242    HD1  TYR  33           HD2      TYR  33   4.304   0.014  -4.476
  243    HD2  TYR  33           HD1      TYR  33   0.318   0.694  -3.153
  244    HE1  TYR  33           HE2      TYR  33   3.740   0.953  -6.678
  245    HE2  TYR  33           HE1      TYR  33  -0.258   1.635  -5.351
  246    HH   TYR  33           HH       TYR  33   1.653   1.261  -8.067
  247    H    CYS  34           H        CYS  34   6.172   0.286  -1.881
  248    HA   CYS  34           HA       CYS  34   6.775   2.736  -3.139
  249    HB2  CYS  34           1HB      CYS  34   8.883   1.386  -3.877
  250    HB3  CYS  34           2HB      CYS  34   8.626   1.723  -2.168
  251    H    SER  35           H        SER  35   7.153  -0.457  -4.662
  252    HA   SER  35           HA       SER  35   6.129   0.723  -7.162
  253    HB2  SER  35           1HB      SER  35   8.136  -1.528  -6.904
  254    HB3  SER  35           2HB      SER  35   7.619  -0.741  -8.395
  255    HG   SER  35           HG       SER  35   8.655   0.890  -6.393
  256    H    VAL  36           H        VAL  36   5.691  -1.360  -8.725
  257    HA   VAL  36           HA       VAL  36   3.285  -2.460  -7.793
  258    HB   VAL  36           HB       VAL  36   5.017  -3.482 -10.048
  259   HG11  VAL  36          1HG1      VAL  36   2.072  -3.722 -10.109
  260   HG12  VAL  36          2HG1      VAL  36   3.315  -4.824 -10.704
  261   HG13  VAL  36          3HG1      VAL  36   2.926  -4.777  -8.984
  262   HG21  VAL  36          3HG2      VAL  36   4.623  -1.389 -10.821
  263   HG22  VAL  36          1HG2      VAL  36   3.074  -2.102 -11.272
  264   HG23  VAL  36          2HG2      VAL  36   3.211  -1.155  -9.790
  265    H    VAL  37           H        VAL  37   6.522  -3.886  -8.093
  266    HA   VAL  37           HA       VAL  37   6.179  -6.484  -7.522
  267    HB   VAL  37           HB       VAL  37   8.213  -4.700  -6.178
  268   HG11  VAL  37          1HG1      VAL  37   7.882  -6.943  -5.109
  269   HG12  VAL  37          2HG1      VAL  37   8.382  -7.672  -6.637
  270   HG13  VAL  37          3HG1      VAL  37   9.505  -6.652  -5.736
  271   HG21  VAL  37          3HG2      VAL  37   8.382  -6.331  -8.711
  272   HG22  VAL  37          1HG2      VAL  37   8.269  -4.574  -8.616
  273   HG23  VAL  37          2HG2      VAL  37   9.696  -5.401  -7.992
  274    H    CYS  38           H        CYS  38   6.512  -4.052  -4.929
  275    HA   CYS  38           HA       CYS  38   5.801  -5.797  -2.840
  276    HB2  CYS  38           1HB      CYS  38   5.965  -2.822  -3.135
  277    HB3  CYS  38           2HB      CYS  38   5.215  -3.502  -1.694
  278    H    PHE  39           H        PHE  39   3.901  -3.862  -5.032
  279    HA   PHE  39           HA       PHE  39   1.468  -3.966  -3.561
  280    HB2  PHE  39           1HB      PHE  39   1.674  -2.245  -5.191
  281    HB3  PHE  39           2HB      PHE  39   2.094  -3.396  -6.456
  282    HD1  PHE  39           HD1      PHE  39  -0.689  -3.177  -3.978
  283    HD2  PHE  39           HD2      PHE  39   0.466  -3.481  -8.063
  284    HE1  PHE  39           HE1      PHE  39  -3.057  -3.311  -4.633
  285    HE2  PHE  39           HE2      PHE  39  -1.900  -3.615  -8.725
  286    HZ   PHE  39           HZ       PHE  39  -3.665  -3.530  -7.010
  287    H    ARG  40           H        ARG  40   3.019  -6.069  -5.879
  288    HA   ARG  40           HA       ARG  40   0.772  -7.658  -6.527
  289    HB2  ARG  40           1HB      ARG  40   3.704  -8.401  -6.544
  290    HB3  ARG  40           2HB      ARG  40   2.416  -9.294  -7.342
  291    HG2  ARG  40           1HG      ARG  40   1.975  -7.018  -8.542
  292    HG3  ARG  40           2HG      ARG  40   3.641  -6.679  -8.069
  293    HD2  ARG  40           1HD      ARG  40   3.968  -7.640 -10.127
  294    HD3  ARG  40           2HD      ARG  40   4.086  -9.054  -9.081
  295    HE   ARG  40           HE       ARG  40   2.272  -9.894 -10.163
  296   HH11  ARG  40          2HH1      ARG  40   2.196  -6.424 -10.438
  297   HH12  ARG  40          1HH1      ARG  40   0.779  -6.404 -11.436
  298   HH21  ARG  40          2HH2      ARG  40   0.407  -9.880 -11.476
  299   HH22  ARG  40          1HH2      ARG  40  -0.238  -8.370 -12.025
  300    H    LYS  41           H        LYS  41   3.573  -8.620  -4.539
  301    HA   LYS  41           HA       LYS  41   2.621 -10.888  -3.408
  302    HB2  LYS  41           1HB      LYS  41   4.193  -8.729  -1.990
  303    HB3  LYS  41           2HB      LYS  41   4.030 -10.388  -1.432
  304    HG2  LYS  41           1HG      LYS  41   5.452 -11.209  -3.009
  305    HG3  LYS  41           2HG      LYS  41   5.061  -9.946  -4.179
  306    HD2  LYS  41           1HD      LYS  41   7.189  -9.329  -3.564
  307    HD3  LYS  41           2HD      LYS  41   6.226  -8.386  -2.425
  308    HE2  LYS  41           1HE      LYS  41   6.537 -10.151  -0.738
  309    HE3  LYS  41           2HE      LYS  41   7.541 -11.046  -1.877
  310    HZ1  LYS  41           3HZ      LYS  41   9.255  -9.576  -1.667
  311    HZ2  LYS  41           1HZ      LYS  41   8.602  -9.467  -0.110
  312    HZ3  LYS  41           2HZ      LYS  41   8.258  -8.272  -1.256
  313    H    HIS  42           H        HIS  42   1.778  -7.597  -2.492
  314    HA   HIS  42           HA       HIS  42   0.269  -8.346  -0.184
  315    HB2  HIS  42           1HB      HIS  42   0.823  -6.154   0.056
  316    HB3  HIS  42           2HB      HIS  42   0.824  -5.856  -1.680
  317    HD1  HIS  42           HD1      HIS  42  -1.561  -6.111   1.239
  318    HD2  HIS  42           HD2      HIS  42  -1.454  -4.682  -2.661
  319    HE1  HIS  42           HE1      HIS  42  -3.701  -4.824   0.935
  320    H    LYS  43           H        LYS  43  -0.636  -7.284  -3.461
  321    HA   LYS  43           HA       LYS  43  -3.354  -7.330  -3.315
  322    HB2  LYS  43           1HB      LYS  43  -1.406  -7.946  -5.471
  323    HB3  LYS  43           2HB      LYS  43  -3.075  -8.424  -5.750
  324    HG2  LYS  43           1HG      LYS  43  -2.400  -5.645  -4.868
  325    HG3  LYS  43           2HG      LYS  43  -2.298  -6.118  -6.566
  326    HD2  LYS  43           1HD      LYS  43  -4.777  -6.711  -5.002
  327    HD3  LYS  43           2HD      LYS  43  -4.503  -5.083  -5.629
  328    HE2  LYS  43           1HE      LYS  43  -4.403  -5.883  -7.871
  329    HE3  LYS  43           2HE      LYS  43  -4.372  -7.562  -7.335
  330    HZ1  LYS  43           3HZ      LYS  43  -6.658  -6.410  -6.261
  331    HZ2  LYS  43           1HZ      LYS  43  -6.566  -7.573  -7.487
  332    HZ3  LYS  43           2HZ      LYS  43  -6.602  -5.929  -7.882
  333    H    GLU  44           H        GLU  44  -1.194 -10.097  -3.465
  334    HA   GLU  44           HA       GLU  44  -2.881 -12.159  -4.081
  335    HB2  GLU  44           1HB      GLU  44  -0.698 -12.095  -1.994
  336    HB3  GLU  44           2HB      GLU  44  -1.469 -13.569  -2.564
  337    HG2  GLU  44           1HG      GLU  44  -0.701 -13.042  -4.851
  338    HG3  GLU  44           2HG      GLU  44   0.151 -11.640  -4.208
  339    H    GLN  45           H        GLN  45  -2.555 -10.516  -0.971
  340    HA   GLN  45           HA       GLN  45  -5.035 -11.845  -0.103
  341    HB2  GLN  45           1HB      GLN  45  -4.204 -11.875   2.184
  342    HB3  GLN  45           2HB      GLN  45  -3.101 -12.745   1.126
  343    HG2  GLN  45           1HG      GLN  45  -1.607 -11.543   2.342
  344    HG3  GLN  45           2HG      GLN  45  -1.892 -10.414   1.019
  345   HE21  GLN  45          1HE2      GLN  45  -2.028  -8.417   1.716
  346   HE22  GLN  45          2HE2      GLN  45  -2.775  -7.892   3.183
  347    H    CYS  46           H        CYS  46  -4.416  -9.204  -1.394
  348    HA   CYS  46           HA       CYS  46  -4.711  -7.123   0.475
  349    HB2  CYS  46           1HB      CYS  46  -3.994  -6.441  -1.644
  350    HB3  CYS  46           2HB      CYS  46  -5.240  -7.370  -2.471
  351    H    ASN  47           H        ASN  47  -6.334  -7.011   1.885
  352    HA   ASN  47           HA       ASN  47  -9.060  -7.586   0.927
  353    HB2  ASN  47           1HB      ASN  47  -9.556  -7.891   3.417
  354    HB3  ASN  47           2HB      ASN  47  -8.582  -9.139   2.645
  355   HD21  ASN  47          1HD2      ASN  47  -8.867  -7.429   5.362
  356   HD22  ASN  47          2HD2      ASN  47  -7.220  -7.382   5.882
  357    HA   PRO  48           HA       PRO  48  -9.281  -3.103   1.538
  358    HB2  PRO  48           1HB      PRO  48 -11.519  -2.800   0.031
  359    HB3  PRO  48           2HB      PRO  48  -9.900  -2.924  -0.668
  360    HG2  PRO  48           1HG      PRO  48 -12.008  -5.031  -0.383
  361    HG3  PRO  48           2HG      PRO  48 -10.952  -4.684  -1.765
  362    HD2  PRO  48           1HD      PRO  48 -10.462  -6.703  -0.027
  363    HD3  PRO  48           2HD      PRO  48  -9.163  -5.806  -0.840
  364    H    GLU  49           H        GLU  49 -10.657  -5.469   3.098
  365    HA   GLU  49           HA       GLU  49 -13.182  -4.315   3.865
  366    HB2  GLU  49           1HB      GLU  49 -13.435  -6.195   5.302
  367    HB3  GLU  49           2HB      GLU  49 -12.693  -6.787   3.823
  368    HG2  GLU  49           1HG      GLU  49 -10.762  -7.342   4.845
  369    HG3  GLU  49           2HG      GLU  49 -10.842  -5.990   5.973
  370    H    THR  50           H        THR  50 -11.083  -2.501   4.231
  371    HA   THR  50           HA       THR  50 -10.488  -2.468   7.082
  372    HB   THR  50           HB       THR  50  -8.652  -1.842   5.671
  373    HG1  THR  50           HG1      THR  50  -9.312  -0.494   7.645
  374   HG21  THR  50          3HG2      THR  50 -10.710  -0.194   4.322
  375   HG22  THR  50          1HG2      THR  50  -9.337  -1.070   3.645
  376   HG23  THR  50          2HG2      THR  50  -9.089   0.492   4.425
  377    H    SER  51           H        SER  51 -11.317  -1.040   8.538
  378    HA   SER  51           HA       SER  51 -13.862   0.048   8.084
  379    HB2  SER  51           1HB      SER  51 -13.557   1.156  10.285
  380    HB3  SER  51           2HB      SER  51 -13.116  -0.550  10.324
  381    HG   SER  51           HG       SER  51 -11.501   1.718  10.512
  382    H    GLY  52           H        GLY  52 -14.486   2.341   8.302
  383    HA2  GLY  52           1HA      GLY  52 -13.859   4.672   8.141
  384    HA3  GLY  52           2HA      GLY  52 -12.453   4.177   7.210
  385    HA   PRO  53           HA       PRO  53 -14.752   5.297   3.622
  386    HB2  PRO  53           1HB      PRO  53 -13.176   4.093   1.769
  387    HB3  PRO  53           2HB      PRO  53 -12.715   5.583   2.600
  388    HG2  PRO  53           1HG      PRO  53 -11.887   2.763   3.168
  389    HG3  PRO  53           2HG      PRO  53 -10.900   4.235   3.145
  390    HD2  PRO  53           1HD      PRO  53 -11.797   3.119   5.443
  391    HD3  PRO  53           2HD      PRO  53 -11.572   4.870   5.257
  392    H    SER  54           H        SER  54 -16.595   4.412   2.955
  393    HA   SER  54           HA       SER  54 -16.661   1.512   2.434
  394    HB2  SER  54           1HB      SER  54 -17.924   2.118   4.480
  395    HB3  SER  54           2HB      SER  54 -18.925   3.205   3.519
  396    HG   SER  54           HG       SER  54 -19.269   0.620   3.915
  397    H    SER  55           H        SER  55 -17.411   0.880   0.502
  398    HA   SER  55           HA       SER  55 -18.004   1.043  -1.695
  399    HB2  SER  55           1HB      SER  55 -20.130   2.556  -0.223
  400    HB3  SER  55           2HB      SER  55 -20.157   2.527  -1.986
  401    HG   SER  55           HG       SER  55 -20.372   0.372  -0.176
  402    H    GLY  56           H        GLY  56 -15.892   2.724  -1.046
  403    HA2  GLY  56           1HA      GLY  56 -16.446   5.049  -2.785
  404    HA3  GLY  56           2HA      GLY  56 -15.403   5.159  -1.374
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1  14.331   8.714  40.751
    2    HA2  GLY   1           1HA      GLY   1  13.875   6.461  41.207
    3    HA3  GLY   1           2HA      GLY   1  12.521   6.960  42.209
    4    H    SER   2           H        SER   2  10.626   7.880  41.016
    5    HA   SER   2           HA       SER   2  10.094   6.190  38.692
    6    HB2  SER   2           1HB      SER   2   8.557   6.371  40.767
    7    HB3  SER   2           2HB      SER   2   8.054   7.915  40.078
    8    HG   SER   2           HG       SER   2   8.067   5.684  38.403
    9    H    SER   3           H        SER   3  10.490   7.040  36.765
   10    HA   SER   3           HA       SER   3  10.607   9.880  36.343
   11    HB2  SER   3           1HB      SER   3  11.951   7.910  35.188
   12    HB3  SER   3           2HB      SER   3  10.596   7.950  34.061
   13    HG   SER   3           HG       SER   3  12.526   9.367  33.663
   14    H    GLY   4           H        GLY   4   9.514  10.676  34.190
   15    HA2  GLY   4           1HA      GLY   4   6.660  10.363  34.626
   16    HA3  GLY   4           2HA      GLY   4   7.434  11.535  33.569
   17    H    SER   5           H        SER   5   5.167   9.602  33.179
   18    HA   SER   5           HA       SER   5   6.131   7.682  31.266
   19    HB2  SER   5           1HB      SER   5   3.292   8.558  31.853
   20    HB3  SER   5           2HB      SER   5   3.771   7.128  30.938
   21    HG   SER   5           HG       SER   5   3.831   6.151  32.787
   22    H    SER   6           H        SER   6   7.235   9.120  29.816
   23    HA   SER   6           HA       SER   6   5.953  11.213  28.426
   24    HB2  SER   6           1HB      SER   6   7.856  10.943  26.793
   25    HB3  SER   6           2HB      SER   6   8.353  11.151  28.473
   26    HG   SER   6           HG       SER   6   7.960   8.537  27.677
   27    H    GLY   7           H        GLY   7   5.696  11.184  25.981
   28    HA2  GLY   7           1HA      GLY   7   4.883   8.630  24.860
   29    HA3  GLY   7           2HA      GLY   7   3.583   9.783  25.125
   30    H    LEU   8           H        LEU   8   5.709   8.639  22.886
   31    HA   LEU   8           HA       LEU   8   6.178  11.136  21.492
   32    HB2  LEU   8           1HB      LEU   8   6.966   8.293  21.109
   33    HB3  LEU   8           2HB      LEU   8   6.991   9.365  19.710
   34    HG   LEU   8           HG       LEU   8   8.412  10.225  22.183
   35   HD11  LEU   8          1HD1      LEU   8  10.391   8.987  21.588
   36   HD12  LEU   8          2HD1      LEU   8   9.566   8.259  20.211
   37   HD13  LEU   8          3HD1      LEU   8   9.058   7.863  21.852
   38   HD21  LEU   8          3HD2      LEU   8   8.082  11.363  19.771
   39   HD22  LEU   8          1HD2      LEU   8   9.563  10.452  19.476
   40   HD23  LEU   8          2HD2      LEU   8   9.499  11.629  20.788
   41    H    LYS   9           H        LYS   9   5.501  11.471  19.273
   42    HA   LYS   9           HA       LYS   9   3.278   9.904  18.277
   43    HB2  LYS   9           1HB      LYS   9   1.778  11.876  18.094
   44    HB3  LYS   9           2HB      LYS   9   2.093  11.398  19.757
   45    HG2  LYS   9           1HG      LYS   9   3.856  13.188  19.825
   46    HG3  LYS   9           2HG      LYS   9   3.245  13.738  18.263
   47    HD2  LYS   9           1HD      LYS   9   1.972  15.063  19.597
   48    HD3  LYS   9           2HD      LYS   9   0.935  13.634  19.600
   49    HE2  LYS   9           1HE      LYS   9   3.077  14.036  21.665
   50    HE3  LYS   9           2HE      LYS   9   1.471  14.739  21.852
   51    HZ1  LYS   9           3HZ      LYS   9   2.129  11.856  21.593
   52    HZ2  LYS   9           1HZ      LYS   9   0.554  12.474  21.600
   53    HZ3  LYS   9           2HZ      LYS   9   1.535  12.643  22.967
   54    H    CYS  10           H        CYS  10   3.094  10.004  16.091
   55    HA   CYS  10           HA       CYS  10   4.157  12.181  14.555
   56    HB2  CYS  10           1HB      CYS  10   5.850  10.860  13.345
   57    HB3  CYS  10           2HB      CYS  10   6.244  11.021  15.052
   58    HG   CYS  10           HG       CYS  10   4.758   8.234  13.740
   59    H    SER  11           H        SER  11   3.591  12.073  12.349
   60    HA   SER  11           HA       SER  11   1.648   9.949  11.714
   61    HB2  SER  11           1HB      SER  11   1.632  12.839  10.808
   62    HB3  SER  11           2HB      SER  11   0.463  11.610  10.325
   63    HG   SER  11           HG       SER  11  -0.557  11.960  12.117
   64    H    THR  12           H        THR  12   2.926   8.580  10.554
   65    HA   THR  12           HA       THR  12   3.468   9.223   7.852
   66    HB   THR  12           HB       THR  12   5.395  10.405   8.576
   67    HG1  THR  12           HG1      THR  12   5.866   9.019   6.853
   68   HG21  THR  12          3HG2      THR  12   5.502   8.308  10.618
   69   HG22  THR  12          1HG2      THR  12   6.066   9.977  10.679
   70   HG23  THR  12          2HG2      THR  12   7.075   8.731   9.943
   71    H    VAL  13           H        VAL  13   3.398   7.393   6.705
   72    HA   VAL  13           HA       VAL  13   3.939   4.856   8.109
   73    HB   VAL  13           HB       VAL  13   1.519   5.244   7.591
   74   HG11  VAL  13          1HG1      VAL  13   2.555   6.005   5.085
   75   HG12  VAL  13          2HG1      VAL  13   1.615   4.535   4.822
   76   HG13  VAL  13          3HG1      VAL  13   0.866   5.937   5.586
   77   HG21  VAL  13          3HG2      VAL  13   2.000   3.011   7.921
   78   HG22  VAL  13          1HG2      VAL  13   1.322   2.989   6.293
   79   HG23  VAL  13          2HG2      VAL  13   3.069   2.924   6.521
   80    H    VAL  14           H        VAL  14   4.960   3.211   6.957
   81    HA   VAL  14           HA       VAL  14   6.147   4.025   4.384
   82    HB   VAL  14           HB       VAL  14   8.140   2.705   4.971
   83   HG11  VAL  14          1HG1      VAL  14   8.335   5.019   5.378
   84   HG12  VAL  14          2HG1      VAL  14   7.333   4.928   6.828
   85   HG13  VAL  14          3HG1      VAL  14   8.953   4.229   6.828
   86   HG21  VAL  14          3HG2      VAL  14   8.042   2.443   7.719
   87   HG22  VAL  14          1HG2      VAL  14   6.447   1.905   7.191
   88   HG23  VAL  14          2HG2      VAL  14   7.897   1.138   6.542
   89    H    CYS  15           H        CYS  15   6.771   2.238   2.966
   90    HA   CYS  15           HA       CYS  15   4.781   0.557   2.253
   91    HB2  CYS  15           1HB      CYS  15   6.983   0.960   1.053
   92    HB3  CYS  15           2HB      CYS  15   7.673  -0.289   2.085
   93    H    VAL  16           H        VAL  16   3.741  -1.075   3.171
   94    HA   VAL  16           HA       VAL  16   4.662  -2.246   5.617
   95    HB   VAL  16           HB       VAL  16   2.620  -3.600   5.522
   96   HG11  VAL  16          1HG1      VAL  16   1.119  -1.862   5.917
   97   HG12  VAL  16          2HG1      VAL  16   2.694  -1.123   6.214
   98   HG13  VAL  16          3HG1      VAL  16   1.850  -0.825   4.693
   99   HG21  VAL  16          3HG2      VAL  16   1.582  -2.273   3.111
  100   HG22  VAL  16          1HG2      VAL  16   2.848  -3.468   2.829
  101   HG23  VAL  16          2HG2      VAL  16   1.372  -3.930   3.676
  102    H    ILE  17           H        ILE  17   5.914  -2.712   2.769
  103    HA   ILE  17           HA       ILE  17   6.131  -5.639   3.045
  104    HB   ILE  17           HB       ILE  17   6.586  -4.042   0.525
  105   HG12  ILE  17          1HG1      ILE  17   4.209  -4.016   1.267
  106   HG13  ILE  17          2HG1      ILE  17   4.447  -4.869  -0.254
  107   HG21  ILE  17          1HG2      ILE  17   6.197  -6.515  -0.345
  108   HG22  ILE  17          2HG2      ILE  17   7.788  -5.939   0.151
  109   HG23  ILE  17          3HG2      ILE  17   6.817  -6.907   1.259
  110   HD11  ILE  17          3HD1      ILE  17   3.093  -6.356   0.770
  111   HD12  ILE  17          1HD1      ILE  17   4.633  -6.940   1.400
  112   HD13  ILE  17          2HD1      ILE  17   3.616  -5.891   2.388
  113    H    CYS  18           H        CYS  18   7.947  -2.815   1.836
  114    HA   CYS  18           HA       CYS  18  10.419  -4.129   2.751
  115    HB2  CYS  18           1HB      CYS  18  11.616  -2.838   1.093
  116    HB3  CYS  18           2HB      CYS  18  10.275  -3.666   0.309
  117    H    LEU  19           H        LEU  19   8.296  -1.560   3.324
  118    HA   LEU  19           HA       LEU  19   8.310   0.162   4.808
  119    HB2  LEU  19           1HB      LEU  19  10.880  -1.087   5.769
  120    HB3  LEU  19           2HB      LEU  19   9.946   0.139   6.623
  121    HG   LEU  19           HG       LEU  19   8.048  -1.596   6.620
  122   HD11  LEU  19          1HD1      LEU  19   9.375  -3.933   6.775
  123   HD12  LEU  19          2HD1      LEU  19  10.288  -3.139   5.492
  124   HD13  LEU  19          3HD1      LEU  19   8.547  -3.368   5.324
  125   HD21  LEU  19          3HD2      LEU  19  10.396  -2.439   8.270
  126   HD22  LEU  19          1HD2      LEU  19   8.694  -2.327   8.718
  127   HD23  LEU  19          2HD2      LEU  19   9.651  -0.859   8.518
  128    H    GLU  20           H        GLU  20   9.015   0.963   2.419
  129    HA   GLU  20           HA       GLU  20  11.228   2.833   2.912
  130    HB2  GLU  20           1HB      GLU  20  10.721   1.322   0.343
  131    HB3  GLU  20           2HB      GLU  20  11.895   2.617   0.533
  132    HG2  GLU  20           1HG      GLU  20  12.750   1.054   2.490
  133    HG3  GLU  20           2HG      GLU  20  11.982  -0.183   1.496
  134    H    LYS  21           H        LYS  21  11.108   4.814   1.697
  135    HA   LYS  21           HA       LYS  21   8.839   6.227   1.815
  136    HB2  LYS  21           1HB      LYS  21  11.142   6.376  -0.078
  137    HB3  LYS  21           2HB      LYS  21   9.752   7.413  -0.371
  138    HG2  LYS  21           1HG      LYS  21  10.043   8.567   1.640
  139    HG3  LYS  21           2HG      LYS  21  11.106   7.324   2.302
  140    HD2  LYS  21           1HD      LYS  21  12.706   7.914   0.409
  141    HD3  LYS  21           2HD      LYS  21  11.701   9.343   0.153
  142    HE2  LYS  21           1HE      LYS  21  12.655   8.766   2.910
  143    HE3  LYS  21           2HE      LYS  21  13.818   9.389   1.741
  144    HZ1  LYS  21           3HZ      LYS  21  11.312  10.811   1.772
  145    HZ2  LYS  21           1HZ      LYS  21  12.896  11.407   1.793
  146    HZ3  LYS  21           2HZ      LYS  21  12.162  10.904   3.231
  147    HA   PRO  22           HA       PRO  22   6.307   3.791  -1.057
  148    HB2  PRO  22           1HB      PRO  22   3.946   4.648  -0.026
  149    HB3  PRO  22           2HB      PRO  22   4.892   3.341   0.697
  150    HG2  PRO  22           1HG      PRO  22   4.737   6.226   1.482
  151    HG3  PRO  22           2HG      PRO  22   4.739   4.784   2.514
  152    HD2  PRO  22           1HD      PRO  22   6.950   6.296   2.122
  153    HD3  PRO  22           2HD      PRO  22   7.028   4.543   2.391
  154    H    LYS  23           H        LYS  23   6.245   4.631  -3.047
  155    HA   LYS  23           HA       LYS  23   5.815   7.417  -3.545
  156    HB2  LYS  23           1HB      LYS  23   6.193   4.995  -5.277
  157    HB3  LYS  23           2HB      LYS  23   5.691   6.524  -5.987
  158    HG2  LYS  23           1HG      LYS  23   7.719   7.547  -4.862
  159    HG3  LYS  23           2HG      LYS  23   8.248   5.893  -4.547
  160    HD2  LYS  23           1HD      LYS  23   7.740   5.640  -7.139
  161    HD3  LYS  23           2HD      LYS  23   8.053   7.377  -7.116
  162    HE2  LYS  23           1HE      LYS  23  10.156   6.507  -7.518
  163    HE3  LYS  23           2HE      LYS  23  10.170   6.716  -5.768
  164    HZ1  LYS  23           3HZ      LYS  23  10.651   4.576  -5.597
  165    HZ2  LYS  23           1HZ      LYS  23  10.499   4.349  -7.266
  166    HZ3  LYS  23           2HZ      LYS  23   9.146   4.188  -6.265
  167    H    TYR  24           H        TYR  24   3.889   4.476  -3.877
  168    HA   TYR  24           HA       TYR  24   1.501   6.162  -4.159
  169    HB2  TYR  24           1HB      TYR  24   1.586   3.564  -5.624
  170    HB3  TYR  24           2HB      TYR  24   0.680   5.028  -5.990
  171    HD1  TYR  24           HD1      TYR  24   4.032   3.470  -6.150
  172    HD2  TYR  24           HD2      TYR  24   1.556   6.676  -7.454
  173    HE1  TYR  24           HE1      TYR  24   5.728   4.095  -7.818
  174    HE2  TYR  24           HE2      TYR  24   3.245   7.308  -9.126
  175    HH   TYR  24           HH       TYR  24   5.486   5.493 -10.255
  176    H    ARG  25           H        ARG  25  -0.529   4.671  -3.912
  177    HA   ARG  25           HA       ARG  25  -0.043   2.667  -1.819
  178    HB2  ARG  25           1HB      ARG  25  -1.739   5.120  -1.671
  179    HB3  ARG  25           2HB      ARG  25  -2.290   3.668  -0.846
  180    HG2  ARG  25           1HG      ARG  25  -0.133   3.591   0.366
  181    HG3  ARG  25           2HG      ARG  25   0.306   5.121  -0.395
  182    HD2  ARG  25           1HD      ARG  25  -1.807   6.081   0.590
  183    HD3  ARG  25           2HD      ARG  25  -1.955   4.590   1.520
  184    HE   ARG  25           HE       ARG  25  -0.253   5.304   2.887
  185   HH11  ARG  25          2HH1      ARG  25  -0.396   7.320   0.052
  186   HH12  ARG  25          1HH1      ARG  25   0.725   8.488   0.667
  187   HH21  ARG  25          2HH2      ARG  25   1.225   6.836   3.708
  188   HH22  ARG  25          1HH2      ARG  25   1.647   8.212   2.746
  189    H    CYS  26           H        CYS  26  -1.838   1.181  -1.493
  190    HA   CYS  26           HA       CYS  26  -2.885   0.227  -3.939
  191    HB2  CYS  26           1HB      CYS  26  -2.401  -1.291  -2.102
  192    HB3  CYS  26           2HB      CYS  26  -3.598  -0.490  -1.089
  193    HA   PRO  27           HA       PRO  27  -6.453   2.860  -4.199
  194    HB2  PRO  27           1HB      PRO  27  -7.574   1.634  -6.346
  195    HB3  PRO  27           2HB      PRO  27  -6.188   2.723  -6.477
  196    HG2  PRO  27           1HG      PRO  27  -6.248  -0.269  -6.436
  197    HG3  PRO  27           2HG      PRO  27  -5.300   0.816  -7.469
  198    HD2  PRO  27           1HD      PRO  27  -4.249  -0.416  -5.299
  199    HD3  PRO  27           2HD      PRO  27  -3.715   1.189  -5.837
  200    H    ALA  28           H        ALA  28  -6.305  -0.082  -2.884
  201    HA   ALA  28           HA       ALA  28  -9.230  -0.426  -2.766
  202    HB1  ALA  28           3HB      ALA  28  -7.111  -2.504  -2.235
  203    HB2  ALA  28           1HB      ALA  28  -8.856  -2.757  -2.246
  204    HB3  ALA  28           2HB      ALA  28  -8.017  -2.337  -3.739
  205    H    CYS  29           H        CYS  29  -6.574  -1.543  -0.682
  206    HA   CYS  29           HA       CYS  29  -8.101  -0.813   1.668
  207    HB2  CYS  29           1HB      CYS  29  -6.002  -1.773   2.830
  208    HB3  CYS  29           2HB      CYS  29  -7.034  -2.879   1.929
  209    H    ARG  30           H        ARG  30  -5.634   0.545  -0.269
  210    HA   ARG  30           HA       ARG  30  -4.619   2.589  -0.175
  211    HB2  ARG  30           1HB      ARG  30  -5.918   3.027   2.511
  212    HB3  ARG  30           2HB      ARG  30  -5.322   4.242   1.388
  213    HG2  ARG  30           1HG      ARG  30  -7.478   2.427   0.457
  214    HG3  ARG  30           2HG      ARG  30  -7.891   3.691   1.617
  215    HD2  ARG  30           1HD      ARG  30  -6.301   4.336  -0.835
  216    HD3  ARG  30           2HD      ARG  30  -8.056   4.190  -0.921
  217    HE   ARG  30           HE       ARG  30  -7.781   5.898   1.103
  218   HH11  ARG  30          2HH1      ARG  30  -6.247   5.807  -2.021
  219   HH12  ARG  30          1HH1      ARG  30  -6.058   7.526  -2.123
  220   HH21  ARG  30          2HH2      ARG  30  -7.538   8.163   0.981
  221   HH22  ARG  30          1HH2      ARG  30  -6.792   8.865  -0.415
  222    H    VAL  31           H        VAL  31  -3.055   0.565   0.376
  223    HA   VAL  31           HA       VAL  31  -1.670   1.159   2.901
  224    HB   VAL  31           HB       VAL  31  -0.474  -0.992   2.516
  225   HG11  VAL  31          1HG1      VAL  31  -2.499  -0.825   3.929
  226   HG12  VAL  31          2HG1      VAL  31  -3.478  -1.264   2.529
  227   HG13  VAL  31          3HG1      VAL  31  -2.307  -2.410   3.182
  228   HG21  VAL  31          3HG2      VAL  31  -1.280  -0.759  -0.062
  229   HG22  VAL  31          1HG2      VAL  31  -0.738  -2.265   0.679
  230   HG23  VAL  31          2HG2      VAL  31  -2.462  -1.914   0.555
  231    HA   PRO  32           HA       PRO  32   1.726   3.023   0.827
  232    HB2  PRO  32           1HB      PRO  32   3.752   2.367   2.510
  233    HB3  PRO  32           2HB      PRO  32   2.524   3.574   2.910
  234    HG2  PRO  32           1HG      PRO  32   2.702   0.705   3.745
  235    HG3  PRO  32           2HG      PRO  32   2.272   2.127   4.712
  236    HD2  PRO  32           1HD      PRO  32   0.415   0.428   3.716
  237    HD3  PRO  32           2HD      PRO  32   0.106   2.163   3.927
  238    H    TYR  33           H        TYR  33   2.712   2.359  -0.965
  239    HA   TYR  33           HA       TYR  33   4.370  -0.031  -0.920
  240    HB2  TYR  33           1HB      TYR  33   3.217  -1.274  -2.449
  241    HB3  TYR  33           2HB      TYR  33   1.853  -0.420  -1.737
  242    HD1  TYR  33           HD2      TYR  33   4.358   0.022  -4.478
  243    HD2  TYR  33           HD1      TYR  33   0.348   0.583  -3.170
  244    HE1  TYR  33           HE2      TYR  33   3.765   0.910  -6.694
  245    HE2  TYR  33           HE1      TYR  33  -0.256   1.470  -5.382
  246    HH   TYR  33           HH       TYR  33   2.097   2.293  -7.737
  247    H    CYS  34           H        CYS  34   6.217   0.362  -1.938
  248    HA   CYS  34           HA       CYS  34   6.739   2.819  -3.222
  249    HB2  CYS  34           1HB      CYS  34   8.877   1.536  -3.968
  250    HB3  CYS  34           2HB      CYS  34   8.623   1.854  -2.255
  251    H    SER  35           H        SER  35   7.120  -0.397  -4.703
  252    HA   SER  35           HA       SER  35   6.082   0.747  -7.214
  253    HB2  SER  35           1HB      SER  35   8.599  -0.098  -6.919
  254    HB3  SER  35           2HB      SER  35   7.848  -1.651  -7.285
  255    HG   SER  35           HG       SER  35   6.862   0.041  -9.015
  256    H    VAL  36           H        VAL  36   5.515  -1.252  -8.753
  257    HA   VAL  36           HA       VAL  36   3.183  -2.406  -7.686
  258    HB   VAL  36           HB       VAL  36   4.734  -3.241 -10.141
  259   HG11  VAL  36          1HG1      VAL  36   2.181  -4.136  -8.959
  260   HG12  VAL  36          2HG1      VAL  36   2.180  -3.852 -10.701
  261   HG13  VAL  36          3HG1      VAL  36   3.320  -4.999  -9.994
  262   HG21  VAL  36          3HG2      VAL  36   3.695  -0.811  -9.757
  263   HG22  VAL  36          1HG2      VAL  36   3.689  -1.613 -11.328
  264   HG23  VAL  36          2HG2      VAL  36   2.245  -1.646 -10.316
  265    H    VAL  37           H        VAL  37   6.475  -3.564  -7.931
  266    HA   VAL  37           HA       VAL  37   6.187  -6.279  -7.609
  267    HB   VAL  37           HB       VAL  37   8.266  -4.509  -6.315
  268   HG11  VAL  37          1HG1      VAL  37   8.292  -6.626  -5.211
  269   HG12  VAL  37          2HG1      VAL  37   8.187  -7.491  -6.745
  270   HG13  VAL  37          3HG1      VAL  37   9.649  -6.592  -6.335
  271   HG21  VAL  37          3HG2      VAL  37   8.138  -4.297  -8.761
  272   HG22  VAL  37          1HG2      VAL  37   9.641  -5.059  -8.242
  273   HG23  VAL  37          2HG2      VAL  37   8.341  -6.042  -8.914
  274    H    CYS  38           H        CYS  38   6.490  -3.884  -4.982
  275    HA   CYS  38           HA       CYS  38   6.028  -5.725  -2.895
  276    HB2  CYS  38           1HB      CYS  38   6.032  -2.749  -3.139
  277    HB3  CYS  38           2HB      CYS  38   5.329  -3.468  -1.694
  278    H    PHE  39           H        PHE  39   3.889  -3.785  -4.877
  279    HA   PHE  39           HA       PHE  39   1.555  -4.144  -3.297
  280    HB2  PHE  39           1HB      PHE  39   1.532  -2.322  -4.812
  281    HB3  PHE  39           2HB      PHE  39   2.001  -3.342  -6.168
  282    HD1  PHE  39           HD1      PHE  39  -0.743  -3.068  -3.654
  283    HD2  PHE  39           HD2      PHE  39   0.373  -3.923  -7.672
  284    HE1  PHE  39           HE1      PHE  39  -3.113  -3.358  -4.247
  285    HE2  PHE  39           HE2      PHE  39  -1.995  -4.214  -8.271
  286    HZ   PHE  39           HZ       PHE  39  -3.742  -3.931  -6.559
  287    H    ARG  40           H        ARG  40   3.084  -5.988  -5.846
  288    HA   ARG  40           HA       ARG  40   0.978  -7.652  -6.591
  289    HB2  ARG  40           1HB      ARG  40   3.957  -8.093  -6.500
  290    HB3  ARG  40           2HB      ARG  40   2.852  -9.321  -7.104
  291    HG2  ARG  40           1HG      ARG  40   1.996  -7.325  -8.598
  292    HG3  ARG  40           2HG      ARG  40   3.621  -6.709  -8.285
  293    HD2  ARG  40           1HD      ARG  40   4.021  -7.933 -10.173
  294    HD3  ARG  40           2HD      ARG  40   4.308  -9.166  -8.946
  295    HE   ARG  40           HE       ARG  40   2.386 -10.256  -9.618
  296   HH11  ARG  40          2HH1      ARG  40   2.616  -7.149 -11.172
  297   HH12  ARG  40          1HH1      ARG  40   1.343  -7.473 -12.301
  298   HH21  ARG  40          2HH2      ARG  40   0.708 -10.695 -11.099
  299   HH22  ARG  40          1HH2      ARG  40   0.257  -9.490 -12.258
  300    H    LYS  41           H        LYS  41   3.611  -8.515  -4.340
  301    HA   LYS  41           HA       LYS  41   2.565 -10.859  -3.360
  302    HB2  LYS  41           1HB      LYS  41   4.099  -8.806  -1.755
  303    HB3  LYS  41           2HB      LYS  41   3.952 -10.519  -1.381
  304    HG2  LYS  41           1HG      LYS  41   5.400 -11.149  -3.044
  305    HG3  LYS  41           2HG      LYS  41   5.082  -9.709  -4.015
  306    HD2  LYS  41           1HD      LYS  41   6.485  -8.377  -2.722
  307    HD3  LYS  41           2HD      LYS  41   6.427  -9.483  -1.347
  308    HE2  LYS  41           1HE      LYS  41   7.697 -10.195  -3.982
  309    HE3  LYS  41           2HE      LYS  41   8.588  -9.451  -2.655
  310    HZ1  LYS  41           3HZ      LYS  41   7.937 -12.160  -3.024
  311    HZ2  LYS  41           1HZ      LYS  41   7.184 -11.616  -1.609
  312    HZ3  LYS  41           2HZ      LYS  41   8.857 -11.455  -1.792
  313    H    HIS  42           H        HIS  42   1.712  -7.570  -2.510
  314    HA   HIS  42           HA       HIS  42   0.178  -8.229  -0.202
  315    HB2  HIS  42           1HB      HIS  42   0.716  -6.008  -0.126
  316    HB3  HIS  42           2HB      HIS  42   0.615  -5.814  -1.874
  317    HD1  HIS  42           HD1      HIS  42  -1.708  -6.189   1.107
  318    HD2  HIS  42           HD2      HIS  42  -1.653  -4.587  -2.726
  319    HE1  HIS  42           HE1      HIS  42  -3.886  -4.955   0.862
  320    H    LYS  43           H        LYS  43  -0.890  -7.062  -3.403
  321    HA   LYS  43           HA       LYS  43  -3.548  -7.319  -3.284
  322    HB2  LYS  43           1HB      LYS  43  -2.248  -6.736  -5.327
  323    HB3  LYS  43           2HB      LYS  43  -1.917  -8.447  -5.566
  324    HG2  LYS  43           1HG      LYS  43  -4.017  -8.898  -6.293
  325    HG3  LYS  43           2HG      LYS  43  -4.753  -7.644  -5.291
  326    HD2  LYS  43           1HD      LYS  43  -4.176  -5.944  -6.804
  327    HD3  LYS  43           2HD      LYS  43  -3.004  -6.967  -7.638
  328    HE2  LYS  43           1HE      LYS  43  -4.789  -8.335  -8.534
  329    HE3  LYS  43           2HE      LYS  43  -5.987  -7.416  -7.624
  330    HZ1  LYS  43           3HZ      LYS  43  -4.564  -6.707 -10.065
  331    HZ2  LYS  43           1HZ      LYS  43  -4.840  -5.453  -8.963
  332    HZ3  LYS  43           2HZ      LYS  43  -6.143  -6.335  -9.585
  333    H    GLU  44           H        GLU  44  -1.305 -10.034  -3.608
  334    HA   GLU  44           HA       GLU  44  -2.872 -12.159  -4.123
  335    HB2  GLU  44           1HB      GLU  44  -0.743 -11.951  -1.993
  336    HB3  GLU  44           2HB      GLU  44  -1.452 -13.474  -2.510
  337    HG2  GLU  44           1HG      GLU  44  -0.630 -13.119  -4.764
  338    HG3  GLU  44           2HG      GLU  44   0.037 -11.558  -4.290
  339    H    GLN  45           H        GLN  45  -2.587 -10.616  -0.936
  340    HA   GLN  45           HA       GLN  45  -5.115 -11.927  -0.182
  341    HB2  GLN  45           1HB      GLN  45  -2.819 -11.269   1.670
  342    HB3  GLN  45           2HB      GLN  45  -4.329 -12.050   2.121
  343    HG2  GLN  45           1HG      GLN  45  -3.742 -13.928   0.608
  344    HG3  GLN  45           2HG      GLN  45  -2.178 -13.162   0.338
  345   HE21  GLN  45          1HE2      GLN  45  -3.648 -15.518   2.003
  346   HE22  GLN  45          2HE2      GLN  45  -2.625 -15.605   3.392
  347    H    CYS  46           H        CYS  46  -4.559  -9.283  -1.389
  348    HA   CYS  46           HA       CYS  46  -4.783  -7.232   0.520
  349    HB2  CYS  46           1HB      CYS  46  -4.167  -6.489  -1.600
  350    HB3  CYS  46           2HB      CYS  46  -5.407  -7.446  -2.405
  351    H    ASN  47           H        ASN  47  -6.346  -7.114   1.992
  352    HA   ASN  47           HA       ASN  47  -9.115  -7.634   1.127
  353    HB2  ASN  47           1HB      ASN  47  -7.947  -9.160   2.914
  354    HB3  ASN  47           2HB      ASN  47  -8.285  -7.816   4.001
  355   HD21  ASN  47          1HD2      ASN  47  -9.860  -9.883   1.596
  356   HD22  ASN  47          2HD2      ASN  47 -11.377  -9.977   2.418
  357    HA   PRO  48           HA       PRO  48  -9.258  -3.212   2.059
  358    HB2  PRO  48           1HB      PRO  48 -11.598  -2.796   0.747
  359    HB3  PRO  48           2HB      PRO  48 -10.037  -2.888  -0.078
  360    HG2  PRO  48           1HG      PRO  48 -12.144  -4.993   0.232
  361    HG3  PRO  48           2HG      PRO  48 -11.190  -4.567  -1.201
  362    HD2  PRO  48           1HD      PRO  48 -10.596  -6.695   0.364
  363    HD3  PRO  48           2HD      PRO  48  -9.351  -5.758  -0.486
  364    H    GLU  49           H        GLU  49 -10.544  -5.663   3.565
  365    HA   GLU  49           HA       GLU  49 -13.054  -4.816   4.518
  366    HB2  GLU  49           1HB      GLU  49 -12.576  -7.068   4.903
  367    HB3  GLU  49           2HB      GLU  49 -10.971  -6.721   5.530
  368    HG2  GLU  49           1HG      GLU  49 -11.734  -6.241   7.620
  369    HG3  GLU  49           2HG      GLU  49 -13.303  -5.685   7.041
  370    H    THR  50           H        THR  50 -13.529  -3.110   5.716
  371    HA   THR  50           HA       THR  50 -11.655  -2.264   7.809
  372    HB   THR  50           HB       THR  50 -12.082   0.115   7.262
  373    HG1  THR  50           HG1      THR  50 -13.945  -0.895   5.697
  374   HG21  THR  50          3HG2      THR  50 -10.575   0.252   5.382
  375   HG22  THR  50          1HG2      THR  50 -10.933  -1.413   4.924
  376   HG23  THR  50          2HG2      THR  50 -10.067  -1.078   6.424
  377    H    SER  51           H        SER  51 -12.805  -0.424   9.145
  378    HA   SER  51           HA       SER  51 -14.960  -1.574  10.473
  379    HB2  SER  51           1HB      SER  51 -13.413   0.238  11.338
  380    HB3  SER  51           2HB      SER  51 -14.375   1.391  10.415
  381    HG   SER  51           HG       SER  51 -15.504  -0.383  12.311
  382    H    GLY  52           H        GLY  52 -15.005   1.210   8.239
  383    HA2  GLY  52           1HA      GLY  52 -17.729   1.673   8.185
  384    HA3  GLY  52           2HA      GLY  52 -16.651   1.975   6.831
  385    HA   PRO  53           HA       PRO  53 -19.771  -1.471   5.919
  386    HB2  PRO  53           1HB      PRO  53 -21.253  -0.126   4.085
  387    HB3  PRO  53           2HB      PRO  53 -21.627  -0.122   5.813
  388    HG2  PRO  53           1HG      PRO  53 -20.198   1.939   4.179
  389    HG3  PRO  53           2HG      PRO  53 -21.429   2.164   5.436
  390    HD2  PRO  53           1HD      PRO  53 -18.786   2.507   5.909
  391    HD3  PRO  53           2HD      PRO  53 -19.908   1.911   7.149
  392    H    SER  54           H        SER  54 -20.020  -2.561   3.850
  393    HA   SER  54           HA       SER  54 -18.568  -1.638   1.555
  394    HB2  SER  54           1HB      SER  54 -16.938  -3.517   1.525
  395    HB3  SER  54           2HB      SER  54 -16.670  -2.406   2.867
  396    HG   SER  54           HG       SER  54 -16.994  -4.002   4.180
  397    H    SER  55           H        SER  55 -18.384  -3.572  -0.078
  398    HA   SER  55           HA       SER  55 -20.996  -4.920  -0.039
  399    HB2  SER  55           1HB      SER  55 -20.832  -5.021  -2.465
  400    HB3  SER  55           2HB      SER  55 -20.562  -3.363  -1.928
  401    HG   SER  55           HG       SER  55 -18.373  -3.635  -2.256
  402    H    GLY  56           H        GLY  56 -21.179  -7.110  -0.512
  403    HA2  GLY  56           1HA      GLY  56 -19.309  -8.869  -1.449
  404    HA3  GLY  56           2HA      GLY  56 -18.922  -8.709   0.257
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1  17.404  34.884  30.545
    2    HA2  GLY   1           1HA      GLY   1  19.231  33.233  30.510
    3    HA3  GLY   1           2HA      GLY   1  19.301  33.399  32.258
    4    H    SER   2           H        SER   2  16.584  32.939  30.003
    5    HA   SER   2           HA       SER   2  15.713  30.681  31.671
    6    HB2  SER   2           1HB      SER   2  13.489  31.034  30.576
    7    HB3  SER   2           2HB      SER   2  14.045  32.423  31.508
    8    HG   SER   2           HG       SER   2  14.145  32.089  28.693
    9    H    SER   3           H        SER   3  14.742  28.828  30.580
   10    HA   SER   3           HA       SER   3  15.753  28.400  27.853
   11    HB2  SER   3           1HB      SER   3  16.562  26.203  28.412
   12    HB3  SER   3           2HB      SER   3  17.259  27.339  29.567
   13    HG   SER   3           HG       SER   3  15.803  25.189  30.074
   14    H    GLY   4           H        GLY   4  14.787  26.277  26.946
   15    HA2  GLY   4           1HA      GLY   4  12.035  25.886  27.905
   16    HA3  GLY   4           2HA      GLY   4  12.300  26.336  26.227
   17    H    SER   5           H        SER   5  10.949  24.125  26.459
   18    HA   SER   5           HA       SER   5  12.874  21.907  26.263
   19    HB2  SER   5           1HB      SER   5  11.149  20.411  26.883
   20    HB3  SER   5           2HB      SER   5  10.942  21.802  27.948
   21    HG   SER   5           HG       SER   5   9.140  22.341  26.928
   22    H    SER   6           H        SER   6  12.239  20.184  24.669
   23    HA   SER   6           HA       SER   6  10.831  21.218  22.323
   24    HB2  SER   6           1HB      SER   6  12.701  20.407  20.851
   25    HB3  SER   6           2HB      SER   6  13.116  21.806  21.841
   26    HG   SER   6           HG       SER   6  14.261  19.379  21.784
   27    H    GLY   7           H        GLY   7  10.148  19.585  20.839
   28    HA2  GLY   7           1HA      GLY   7  10.636  16.815  21.320
   29    HA3  GLY   7           2HA      GLY   7   9.079  17.307  21.967
   30    H    LEU   8           H        LEU   8  10.759  18.346  19.016
   31    HA   LEU   8           HA       LEU   8   8.390  18.183  17.458
   32    HB2  LEU   8           1HB      LEU   8  11.285  18.626  16.835
   33    HB3  LEU   8           2HB      LEU   8  10.109  18.415  15.539
   34    HG   LEU   8           HG       LEU   8  10.643  20.784  16.026
   35   HD11  LEU   8          1HD1      LEU   8   7.814  19.876  16.523
   36   HD12  LEU   8          2HD1      LEU   8   8.551  20.284  14.974
   37   HD13  LEU   8          3HD1      LEU   8   8.281  21.542  16.181
   38   HD21  LEU   8          3HD2      LEU   8   9.638  21.764  18.090
   39   HD22  LEU   8          1HD2      LEU   8  11.027  20.717  18.383
   40   HD23  LEU   8          2HD2      LEU   8   9.395  20.121  18.688
   41    H    LYS   9           H        LYS   9   7.477  16.434  16.634
   42    HA   LYS   9           HA       LYS   9   9.191  14.159  15.889
   43    HB2  LYS   9           1HB      LYS   9   7.522  12.607  16.698
   44    HB3  LYS   9           2HB      LYS   9   7.975  13.699  18.000
   45    HG2  LYS   9           1HG      LYS   9   5.950  14.967  17.707
   46    HG3  LYS   9           2HG      LYS   9   5.514  14.004  16.293
   47    HD2  LYS   9           1HD      LYS   9   4.242  13.092  18.035
   48    HD3  LYS   9           2HD      LYS   9   5.608  11.987  17.867
   49    HE2  LYS   9           1HE      LYS   9   6.724  13.045  19.745
   50    HE3  LYS   9           2HE      LYS   9   5.422  14.225  19.882
   51    HZ1  LYS   9           3HZ      LYS   9   5.450  11.394  20.632
   52    HZ2  LYS   9           1HZ      LYS   9   3.987  12.064  20.109
   53    HZ3  LYS   9           2HZ      LYS   9   4.787  12.719  21.448
   54    H    CYS  10           H        CYS  10   7.847  12.566  14.478
   55    HA   CYS  10           HA       CYS  10   5.999  13.980  12.710
   56    HB2  CYS  10           1HB      CYS  10   8.455  14.097  11.892
   57    HB3  CYS  10           2HB      CYS  10   8.253  12.391  11.514
   58    HG   CYS  10           HG       CYS  10   6.694  12.651   9.418
   59    H    SER  11           H        SER  11   4.429  12.707  11.861
   60    HA   SER  11           HA       SER  11   4.584   9.829  12.479
   61    HB2  SER  11           1HB      SER  11   2.085   9.903  12.595
   62    HB3  SER  11           2HB      SER  11   2.877  10.876  13.835
   63    HG   SER  11           HG       SER  11   1.836  12.518  13.070
   64    H    THR  12           H        THR  12   5.047   8.779  10.658
   65    HA   THR  12           HA       THR  12   3.290   9.122   8.363
   66    HB   THR  12           HB       THR  12   6.290   9.244   8.015
   67    HG1  THR  12           HG1      THR  12   5.257  11.183   8.924
   68   HG21  THR  12          3HG2      THR  12   3.953   9.245   6.139
   69   HG22  THR  12          1HG2      THR  12   5.447   8.312   6.057
   70   HG23  THR  12          2HG2      THR  12   5.462  10.036   5.686
   71    H    VAL  13           H        VAL  13   2.935   7.256   7.266
   72    HA   VAL  13           HA       VAL  13   4.062   4.832   8.400
   73    HB   VAL  13           HB       VAL  13   1.597   5.132   7.849
   74   HG11  VAL  13          1HG1      VAL  13   0.845   5.294   5.729
   75   HG12  VAL  13          2HG1      VAL  13   2.458   5.943   5.425
   76   HG13  VAL  13          3HG1      VAL  13   2.110   4.246   5.088
   77   HG21  VAL  13          3HG2      VAL  13   1.320   2.859   7.572
   78   HG22  VAL  13          1HG2      VAL  13   2.675   2.724   6.451
   79   HG23  VAL  13          2HG2      VAL  13   2.975   2.939   8.176
   80    H    VAL  14           H        VAL  14   4.718   3.051   6.913
   81    HA   VAL  14           HA       VAL  14   5.988   4.016   4.448
   82    HB   VAL  14           HB       VAL  14   8.030   2.733   4.960
   83   HG11  VAL  14          1HG1      VAL  14   8.871   4.261   6.785
   84   HG12  VAL  14          2HG1      VAL  14   8.148   5.060   5.387
   85   HG13  VAL  14          3HG1      VAL  14   7.232   4.903   6.886
   86   HG21  VAL  14          3HG2      VAL  14   6.679   2.315   7.621
   87   HG22  VAL  14          1HG2      VAL  14   7.218   1.084   6.479
   88   HG23  VAL  14          2HG2      VAL  14   8.403   2.060   7.348
   89    H    CYS  15           H        CYS  15   6.706   2.222   3.030
   90    HA   CYS  15           HA       CYS  15   4.739   0.528   2.277
   91    HB2  CYS  15           1HB      CYS  15   6.968   0.959   1.124
   92    HB3  CYS  15           2HB      CYS  15   7.637  -0.305   2.151
   93    H    VAL  16           H        VAL  16   3.711  -1.137   3.148
   94    HA   VAL  16           HA       VAL  16   4.602  -2.304   5.613
   95    HB   VAL  16           HB       VAL  16   2.576  -3.721   5.420
   96   HG11  VAL  16          1HG1      VAL  16   1.589  -1.004   4.783
   97   HG12  VAL  16          2HG1      VAL  16   1.213  -2.058   6.147
   98   HG13  VAL  16          3HG1      VAL  16   2.725  -1.150   6.124
   99   HG21  VAL  16          3HG2      VAL  16   1.039  -2.714   3.455
  100   HG22  VAL  16          1HG2      VAL  16   2.622  -2.619   2.684
  101   HG23  VAL  16          2HG2      VAL  16   2.021  -4.168   3.274
  102    H    ILE  17           H        ILE  17   5.922  -2.739   2.802
  103    HA   ILE  17           HA       ILE  17   6.166  -5.665   3.070
  104    HB   ILE  17           HB       ILE  17   6.639  -4.086   0.543
  105   HG12  ILE  17          1HG1      ILE  17   4.243  -4.063   1.352
  106   HG13  ILE  17          2HG1      ILE  17   4.491  -4.775  -0.239
  107   HG21  ILE  17          1HG2      ILE  17   6.010  -6.862   0.193
  108   HG22  ILE  17          2HG2      ILE  17   7.449  -5.972  -0.302
  109   HG23  ILE  17          3HG2      ILE  17   7.364  -6.685   1.309
  110   HD11  ILE  17          3HD1      ILE  17   3.235  -5.904   2.024
  111   HD12  ILE  17          1HD1      ILE  17   3.483  -6.618   0.431
  112   HD13  ILE  17          2HD1      ILE  17   4.694  -6.838   1.695
  113    H    CYS  18           H        CYS  18   7.936  -2.798   1.899
  114    HA   CYS  18           HA       CYS  18  10.427  -4.077   2.815
  115    HB2  CYS  18           1HB      CYS  18  11.613  -2.781   1.161
  116    HB3  CYS  18           2HB      CYS  18  10.275  -3.607   0.368
  117    H    LEU  19           H        LEU  19   8.250  -1.572   3.409
  118    HA   LEU  19           HA       LEU  19   8.230   0.167   4.874
  119    HB2  LEU  19           1HB      LEU  19  10.750  -1.161   5.858
  120    HB3  LEU  19           2HB      LEU  19   9.938   0.172   6.678
  121    HG   LEU  19           HG       LEU  19   7.895  -1.439   6.708
  122   HD11  LEU  19          1HD1      LEU  19   9.072  -3.087   5.207
  123   HD12  LEU  19          2HD1      LEU  19   8.369  -3.755   6.679
  124   HD13  LEU  19          3HD1      LEU  19  10.107  -3.472   6.582
  125   HD21  LEU  19          3HD2      LEU  19   9.231  -0.624   8.654
  126   HD22  LEU  19          1HD2      LEU  19  10.261  -2.044   8.473
  127   HD23  LEU  19          2HD2      LEU  19   8.551  -2.239   8.862
  128    H    GLU  20           H        GLU  20   8.967   0.978   2.498
  129    HA   GLU  20           HA       GLU  20  11.167   2.855   3.026
  130    HB2  GLU  20           1HB      GLU  20  10.677   1.357   0.447
  131    HB3  GLU  20           2HB      GLU  20  11.836   2.665   0.640
  132    HG2  GLU  20           1HG      GLU  20  12.741   1.133   2.575
  133    HG3  GLU  20           2HG      GLU  20  11.942  -0.130   1.640
  134    H    LYS  21           H        LYS  21  11.075   4.821   1.730
  135    HA   LYS  21           HA       LYS  21   8.796   6.245   1.881
  136    HB2  LYS  21           1HB      LYS  21  10.803   7.362   1.262
  137    HB3  LYS  21           2HB      LYS  21  10.965   6.407  -0.207
  138    HG2  LYS  21           1HG      LYS  21   8.976   7.498  -1.128
  139    HG3  LYS  21           2HG      LYS  21   8.839   8.469   0.340
  140    HD2  LYS  21           1HD      LYS  21  11.118   9.365  -0.121
  141    HD3  LYS  21           2HD      LYS  21  11.099   8.497  -1.658
  142    HE2  LYS  21           1HE      LYS  21   9.025   9.749  -2.253
  143    HE3  LYS  21           2HE      LYS  21   9.233  10.697  -0.781
  144    HZ1  LYS  21           3HZ      LYS  21  11.654  10.742  -2.158
  145    HZ2  LYS  21           1HZ      LYS  21  10.583  12.026  -1.896
  146    HZ3  LYS  21           2HZ      LYS  21  10.440  11.076  -3.288
  147    HA   PRO  22           HA       PRO  22   6.251   3.842  -0.996
  148    HB2  PRO  22           1HB      PRO  22   3.896   4.769  -0.013
  149    HB3  PRO  22           2HB      PRO  22   4.803   3.455   0.746
  150    HG2  PRO  22           1HG      PRO  22   4.702   6.356   1.478
  151    HG3  PRO  22           2HG      PRO  22   4.657   4.933   2.535
  152    HD2  PRO  22           1HD      PRO  22   6.906   6.390   2.147
  153    HD3  PRO  22           2HD      PRO  22   6.942   4.640   2.447
  154    H    LYS  23           H        LYS  23   6.336   4.692  -2.991
  155    HA   LYS  23           HA       LYS  23   5.926   7.464  -3.538
  156    HB2  LYS  23           1HB      LYS  23   6.125   5.062  -5.361
  157    HB3  LYS  23           2HB      LYS  23   6.019   6.722  -5.934
  158    HG2  LYS  23           1HG      LYS  23   8.100   7.235  -4.693
  159    HG3  LYS  23           2HG      LYS  23   8.223   5.526  -4.267
  160    HD2  LYS  23           1HD      LYS  23   8.212   4.999  -6.711
  161    HD3  LYS  23           2HD      LYS  23   8.299   6.733  -7.031
  162    HE2  LYS  23           1HE      LYS  23  10.423   6.895  -5.952
  163    HE3  LYS  23           2HE      LYS  23  10.306   5.242  -5.349
  164    HZ1  LYS  23           3HZ      LYS  23  11.175   6.196  -7.916
  165    HZ2  LYS  23           1HZ      LYS  23  10.043   4.943  -8.027
  166    HZ3  LYS  23           2HZ      LYS  23  11.475   4.715  -7.155
  167    H    TYR  24           H        TYR  24   3.959   4.555  -3.807
  168    HA   TYR  24           HA       TYR  24   1.603   6.259  -4.179
  169    HB2  TYR  24           1HB      TYR  24   1.717   3.678  -5.677
  170    HB3  TYR  24           2HB      TYR  24   0.805   5.140  -6.035
  171    HD1  TYR  24           HD1      TYR  24   4.172   3.612  -6.163
  172    HD2  TYR  24           HD2      TYR  24   1.692   6.817  -7.458
  173    HE1  TYR  24           HE1      TYR  24   5.891   4.276  -7.791
  174    HE2  TYR  24           HE2      TYR  24   3.404   7.490  -9.091
  175    HH   TYR  24           HH       TYR  24   6.230   5.530  -9.704
  176    H    ARG  25           H        ARG  25  -0.447   4.789  -3.992
  177    HA   ARG  25           HA       ARG  25  -0.021   2.780  -1.886
  178    HB2  ARG  25           1HB      ARG  25  -1.787   5.193  -1.842
  179    HB3  ARG  25           2HB      ARG  25  -2.308   3.740  -1.001
  180    HG2  ARG  25           1HG      ARG  25  -0.256   3.766   0.323
  181    HG3  ARG  25           2HG      ARG  25   0.266   5.225  -0.521
  182    HD2  ARG  25           1HD      ARG  25  -2.315   5.048   1.015
  183    HD3  ARG  25           2HD      ARG  25  -0.798   5.572   1.744
  184    HE   ARG  25           HE       ARG  25  -0.843   7.501   0.364
  185   HH11  ARG  25          2HH1      ARG  25  -3.688   5.513   0.094
  186   HH12  ARG  25          1HH1      ARG  25  -4.657   6.767  -0.606
  187   HH21  ARG  25          2HH2      ARG  25  -2.108   9.160  -0.557
  188   HH22  ARG  25          1HH2      ARG  25  -3.757   8.841  -0.977
  189    H    CYS  26           H        CYS  26  -1.928   1.358  -1.569
  190    HA   CYS  26           HA       CYS  26  -2.808   0.329  -4.070
  191    HB2  CYS  26           1HB      CYS  26  -2.378  -1.078  -2.065
  192    HB3  CYS  26           2HB      CYS  26  -3.792  -0.366  -1.296
  193    HA   PRO  27           HA       PRO  27  -6.361   2.964  -4.518
  194    HB2  PRO  27           1HB      PRO  27  -7.337   1.757  -6.745
  195    HB3  PRO  27           2HB      PRO  27  -5.955   2.858  -6.777
  196    HG2  PRO  27           1HG      PRO  27  -5.992  -0.135  -6.777
  197    HG3  PRO  27           2HG      PRO  27  -4.992   0.971  -7.736
  198    HD2  PRO  27           1HD      PRO  27  -4.065  -0.280  -5.521
  199    HD3  PRO  27           2HD      PRO  27  -3.513   1.336  -6.006
  200    H    ALA  28           H        ALA  28  -6.269   0.013  -3.225
  201    HA   ALA  28           HA       ALA  28  -9.198  -0.327  -3.262
  202    HB1  ALA  28           3HB      ALA  28  -8.243  -2.711  -2.332
  203    HB2  ALA  28           1HB      ALA  28  -8.701  -2.379  -4.003
  204    HB3  ALA  28           2HB      ALA  28  -7.012  -2.253  -3.508
  205    H    CYS  29           H        CYS  29  -6.479  -1.295  -1.160
  206    HA   CYS  29           HA       CYS  29  -8.135  -0.732   1.178
  207    HB2  CYS  29           1HB      CYS  29  -6.162  -1.781   2.403
  208    HB3  CYS  29           2HB      CYS  29  -7.063  -2.839   1.322
  209    H    ARG  30           H        ARG  30  -5.681   0.714  -0.673
  210    HA   ARG  30           HA       ARG  30  -4.599   2.710  -0.475
  211    HB2  ARG  30           1HB      ARG  30  -6.132   3.072   2.104
  212    HB3  ARG  30           2HB      ARG  30  -5.334   4.327   1.165
  213    HG2  ARG  30           1HG      ARG  30  -7.538   4.608   0.576
  214    HG3  ARG  30           2HG      ARG  30  -6.942   3.578  -0.727
  215    HD2  ARG  30           1HD      ARG  30  -8.057   1.720   0.051
  216    HD3  ARG  30           2HD      ARG  30  -8.103   2.313   1.710
  217    HE   ARG  30           HE       ARG  30 -10.088   3.346   1.243
  218   HH11  ARG  30          2HH1      ARG  30  -8.502   2.535  -1.748
  219   HH12  ARG  30          1HH1      ARG  30  -9.852   2.984  -2.737
  220   HH21  ARG  30          2HH2      ARG  30 -11.872   3.940  -0.048
  221   HH22  ARG  30          1HH2      ARG  30 -11.768   3.784  -1.769
  222    H    VAL  31           H        VAL  31  -3.087   0.664   0.138
  223    HA   VAL  31           HA       VAL  31  -1.834   1.227   2.738
  224    HB   VAL  31           HB       VAL  31  -0.618  -0.949   2.334
  225   HG11  VAL  31          1HG1      VAL  31  -3.618  -1.208   2.423
  226   HG12  VAL  31          2HG1      VAL  31  -2.421  -2.294   3.132
  227   HG13  VAL  31          3HG1      VAL  31  -2.638  -0.670   3.786
  228   HG21  VAL  31          3HG2      VAL  31  -2.639  -1.169   0.105
  229   HG22  VAL  31          1HG2      VAL  31  -0.884  -1.113  -0.061
  230   HG23  VAL  31          2HG2      VAL  31  -1.653  -2.500   0.710
  231    HA   PRO  32           HA       PRO  32   1.730   2.995   0.880
  232    HB2  PRO  32           1HB      PRO  32   3.670   2.186   2.598
  233    HB3  PRO  32           2HB      PRO  32   2.478   3.424   3.009
  234    HG2  PRO  32           1HG      PRO  32   2.514   0.517   3.724
  235    HG3  PRO  32           2HG      PRO  32   2.107   1.914   4.738
  236    HD2  PRO  32           1HD      PRO  32   0.219   0.336   3.608
  237    HD3  PRO  32           2HD      PRO  32  -0.028   2.072   3.884
  238    H    TYR  33           H        TYR  33   2.763   2.372  -0.901
  239    HA   TYR  33           HA       TYR  33   4.367  -0.041  -0.911
  240    HB2  TYR  33           1HB      TYR  33   3.214  -1.261  -2.464
  241    HB3  TYR  33           2HB      TYR  33   1.853  -0.436  -1.711
  242    HD1  TYR  33           HD2      TYR  33   4.285  -0.003  -4.513
  243    HD2  TYR  33           HD1      TYR  33   0.343   0.678  -3.065
  244    HE1  TYR  33           HE2      TYR  33   3.650   0.928  -6.699
  245    HE2  TYR  33           HE1      TYR  33  -0.304   1.610  -5.248
  246    HH   TYR  33           HH       TYR  33   1.702   2.697  -7.451
  247    H    CYS  34           H        CYS  34   6.219   0.400  -1.894
  248    HA   CYS  34           HA       CYS  34   6.710   2.859  -3.186
  249    HB2  CYS  34           1HB      CYS  34   8.879   1.615  -3.901
  250    HB3  CYS  34           2HB      CYS  34   8.599   1.929  -2.191
  251    H    SER  35           H        SER  35   7.106  -0.376  -4.628
  252    HA   SER  35           HA       SER  35   6.122   0.749  -7.169
  253    HB2  SER  35           1HB      SER  35   8.415  -1.051  -6.550
  254    HB3  SER  35           2HB      SER  35   7.539  -1.334  -8.054
  255    HG   SER  35           HG       SER  35   7.877   1.214  -8.028
  256    H    VAL  36           H        VAL  36   5.397  -1.111  -8.694
  257    HA   VAL  36           HA       VAL  36   3.078  -2.244  -7.688
  258    HB   VAL  36           HB       VAL  36   3.784  -1.941 -10.136
  259   HG11  VAL  36          1HG1      VAL  36   5.851  -3.240 -10.013
  260   HG12  VAL  36          2HG1      VAL  36   4.920  -4.694  -9.649
  261   HG13  VAL  36          3HG1      VAL  36   4.748  -3.905 -11.217
  262   HG21  VAL  36          3HG2      VAL  36   1.700  -2.802 -10.091
  263   HG22  VAL  36          1HG2      VAL  36   2.514  -4.275 -10.619
  264   HG23  VAL  36          2HG2      VAL  36   2.125  -4.045  -8.914
  265    H    VAL  37           H        VAL  37   6.299  -3.672  -8.021
  266    HA   VAL  37           HA       VAL  37   5.897  -6.299  -7.501
  267    HB   VAL  37           HB       VAL  37   8.035  -4.591  -6.220
  268   HG11  VAL  37          1HG1      VAL  37   7.573  -6.974  -5.324
  269   HG12  VAL  37          2HG1      VAL  37   8.297  -7.508  -6.842
  270   HG13  VAL  37          3HG1      VAL  37   9.229  -6.516  -5.720
  271   HG21  VAL  37          3HG2      VAL  37   9.415  -5.278  -8.123
  272   HG22  VAL  37          1HG2      VAL  37   8.038  -6.139  -8.810
  273   HG23  VAL  37          2HG2      VAL  37   7.991  -4.383  -8.651
  274    H    CYS  38           H        CYS  38   6.691  -4.081  -4.825
  275    HA   CYS  38           HA       CYS  38   6.013  -5.716  -2.732
  276    HB2  CYS  38           1HB      CYS  38   6.003  -2.743  -3.077
  277    HB3  CYS  38           2HB      CYS  38   5.365  -3.434  -1.588
  278    H    PHE  39           H        PHE  39   3.889  -3.884  -4.815
  279    HA   PHE  39           HA       PHE  39   1.556  -4.244  -3.182
  280    HB2  PHE  39           1HB      PHE  39   1.532  -2.331  -4.581
  281    HB3  PHE  39           2HB      PHE  39   1.992  -3.266  -6.000
  282    HD1  PHE  39           HD1      PHE  39  -0.694  -3.644  -3.437
  283    HD2  PHE  39           HD2      PHE  39   0.309  -3.244  -7.554
  284    HE1  PHE  39           HE1      PHE  39  -3.068  -3.892  -4.036
  285    HE2  PHE  39           HE2      PHE  39  -2.063  -3.490  -8.159
  286    HZ   PHE  39           HZ       PHE  39  -3.755  -3.814  -6.399
  287    H    ARG  40           H        ARG  40   3.150  -6.013  -5.706
  288    HA   ARG  40           HA       ARG  40   1.023  -7.597  -6.613
  289    HB2  ARG  40           1HB      ARG  40   3.983  -8.176  -6.446
  290    HB3  ARG  40           2HB      ARG  40   2.830  -9.220  -7.266
  291    HG2  ARG  40           1HG      ARG  40   2.207  -7.174  -8.648
  292    HG3  ARG  40           2HG      ARG  40   3.672  -6.437  -7.994
  293    HD2  ARG  40           1HD      ARG  40   4.252  -7.400 -10.086
  294    HD3  ARG  40           2HD      ARG  40   4.933  -8.437  -8.834
  295    HE   ARG  40           HE       ARG  40   2.359  -9.336  -9.639
  296   HH11  ARG  40          2HH1      ARG  40   5.707  -9.276 -10.593
  297   HH12  ARG  40          1HH1      ARG  40   5.598 -10.724 -11.539
  298   HH21  ARG  40          2HH2      ARG  40   2.204 -11.243 -10.881
  299   HH22  ARG  40          1HH2      ARG  40   3.605 -11.841 -11.703
  300    H    LYS  41           H        LYS  41   3.599  -8.567  -4.341
  301    HA   LYS  41           HA       LYS  41   2.521 -10.955  -3.500
  302    HB2  LYS  41           1HB      LYS  41   4.023  -9.002  -1.749
  303    HB3  LYS  41           2HB      LYS  41   3.883 -10.738  -1.499
  304    HG2  LYS  41           1HG      LYS  41   5.398 -11.238  -3.125
  305    HG3  LYS  41           2HG      LYS  41   5.034  -9.789  -4.066
  306    HD2  LYS  41           1HD      LYS  41   7.127  -9.290  -3.228
  307    HD3  LYS  41           2HD      LYS  41   6.075  -8.542  -2.024
  308    HE2  LYS  41           1HE      LYS  41   6.940 -11.369  -1.638
  309    HE3  LYS  41           2HE      LYS  41   8.088 -10.073  -1.306
  310    HZ1  LYS  41           3HZ      LYS  41   6.901  -9.350   0.470
  311    HZ2  LYS  41           1HZ      LYS  41   6.445 -10.978   0.524
  312    HZ3  LYS  41           2HZ      LYS  41   5.409  -9.832  -0.164
  313    H    HIS  42           H        HIS  42   1.753  -7.699  -2.409
  314    HA   HIS  42           HA       HIS  42   0.105  -8.512  -0.230
  315    HB2  HIS  42           1HB      HIS  42   0.708  -6.344   0.119
  316    HB3  HIS  42           2HB      HIS  42   0.761  -5.971  -1.601
  317    HD1  HIS  42           HD1      HIS  42  -1.446  -5.840   1.371
  318    HD2  HIS  42           HD2      HIS  42  -1.732  -5.189  -2.722
  319    HE1  HIS  42           HE1      HIS  42  -3.622  -4.624   1.034
  320    H    LYS  43           H        LYS  43  -0.539  -7.521  -3.570
  321    HA   LYS  43           HA       LYS  43  -3.247  -7.345  -3.642
  322    HB2  LYS  43           1HB      LYS  43  -1.794  -7.049  -5.607
  323    HB3  LYS  43           2HB      LYS  43  -1.529  -8.787  -5.671
  324    HG2  LYS  43           1HG      LYS  43  -3.147  -8.450  -7.283
  325    HG3  LYS  43           2HG      LYS  43  -4.096  -8.942  -5.879
  326    HD2  LYS  43           1HD      LYS  43  -4.123  -6.321  -5.457
  327    HD3  LYS  43           2HD      LYS  43  -3.888  -6.291  -7.207
  328    HE2  LYS  43           1HE      LYS  43  -6.168  -6.321  -7.128
  329    HE3  LYS  43           2HE      LYS  43  -5.853  -8.055  -7.142
  330    HZ1  LYS  43           3HZ      LYS  43  -5.974  -6.735  -4.540
  331    HZ2  LYS  43           1HZ      LYS  43  -6.484  -8.284  -4.993
  332    HZ3  LYS  43           2HZ      LYS  43  -7.434  -6.936  -5.372
  333    H    GLU  44           H        GLU  44  -1.364 -10.352  -3.716
  334    HA   GLU  44           HA       GLU  44  -3.410 -12.174  -4.081
  335    HB2  GLU  44           1HB      GLU  44  -1.882 -13.776  -3.547
  336    HB3  GLU  44           2HB      GLU  44  -0.775 -12.423  -3.732
  337    HG2  GLU  44           1HG      GLU  44  -0.755 -12.070  -1.339
  338    HG3  GLU  44           2HG      GLU  44  -1.937 -13.359  -1.119
  339    H    GLN  45           H        GLN  45  -2.427 -10.487  -1.162
  340    HA   GLN  45           HA       GLN  45  -4.732 -11.682   0.231
  341    HB2  GLN  45           1HB      GLN  45  -1.990 -10.984   1.231
  342    HB3  GLN  45           2HB      GLN  45  -3.355 -11.035   2.338
  343    HG2  GLN  45           1HG      GLN  45  -3.709 -13.399   1.194
  344    HG3  GLN  45           2HG      GLN  45  -1.975 -13.237   0.917
  345   HE21  GLN  45          1HE2      GLN  45  -3.998 -14.700   2.853
  346   HE22  GLN  45          2HE2      GLN  45  -3.156 -14.628   4.360
  347    H    CYS  46           H        CYS  46  -4.526  -9.234  -1.438
  348    HA   CYS  46           HA       CYS  46  -4.569  -6.955   0.252
  349    HB2  CYS  46           1HB      CYS  46  -4.130  -6.523  -2.021
  350    HB3  CYS  46           2HB      CYS  46  -5.506  -7.482  -2.559
  351    H    ASN  47           H        ASN  47  -5.981  -6.962   1.911
  352    HA   ASN  47           HA       ASN  47  -8.818  -7.445   1.278
  353    HB2  ASN  47           1HB      ASN  47  -7.455  -8.922   3.011
  354    HB3  ASN  47           2HB      ASN  47  -7.826  -7.580   4.090
  355   HD21  ASN  47          1HD2      ASN  47  -8.749 -10.467   3.793
  356   HD22  ASN  47          2HD2      ASN  47 -10.471 -10.355   3.885
  357    HA   PRO  48           HA       PRO  48  -8.871  -3.015   2.167
  358    HB2  PRO  48           1HB      PRO  48 -11.325  -2.611   1.079
  359    HB3  PRO  48           2HB      PRO  48  -9.851  -2.719   0.110
  360    HG2  PRO  48           1HG      PRO  48 -11.922  -4.813   0.649
  361    HG3  PRO  48           2HG      PRO  48 -11.109  -4.410  -0.874
  362    HD2  PRO  48           1HD      PRO  48 -10.372  -6.518   0.657
  363    HD3  PRO  48           2HD      PRO  48  -9.212  -5.597  -0.322
  364    H    GLU  49           H        GLU  49 -10.337  -5.568   3.595
  365    HA   GLU  49           HA       GLU  49 -12.433  -4.153   4.999
  366    HB2  GLU  49           1HB      GLU  49 -11.350  -6.957   5.133
  367    HB3  GLU  49           2HB      GLU  49 -12.505  -6.362   6.318
  368    HG2  GLU  49           1HG      GLU  49 -13.136  -6.071   3.426
  369    HG3  GLU  49           2HG      GLU  49 -13.295  -7.655   4.184
  370    H    THR  50           H        THR  50  -9.564  -5.964   6.108
  371    HA   THR  50           HA       THR  50  -9.267  -3.976   8.264
  372    HB   THR  50           HB       THR  50  -8.713  -6.943   8.464
  373    HG1  THR  50           HG1      THR  50 -10.453  -6.483  10.200
  374   HG21  THR  50          3HG2      THR  50  -8.674  -4.933  10.702
  375   HG22  THR  50          1HG2      THR  50  -7.227  -5.331   9.777
  376   HG23  THR  50          2HG2      THR  50  -8.057  -6.585  10.698
  377    H    SER  51           H        SER  51  -7.714  -2.805   7.109
  378    HA   SER  51           HA       SER  51  -5.038  -3.712   7.414
  379    HB2  SER  51           1HB      SER  51  -5.315  -4.975   5.431
  380    HB3  SER  51           2HB      SER  51  -6.230  -3.689   4.643
  381    HG   SER  51           HG       SER  51  -3.750  -4.102   4.296
  382    H    GLY  52           H        GLY  52  -3.914  -1.954   7.912
  383    HA2  GLY  52           1HA      GLY  52  -3.184   0.223   7.958
  384    HA3  GLY  52           2HA      GLY  52  -3.914   0.419   6.372
  385    HA   PRO  53           HA       PRO  53  -6.378   2.477   9.955
  386    HB2  PRO  53           1HB      PRO  53  -5.265   4.953   9.980
  387    HB3  PRO  53           2HB      PRO  53  -4.705   3.638  11.020
  388    HG2  PRO  53           1HG      PRO  53  -3.565   4.624   8.433
  389    HG3  PRO  53           2HG      PRO  53  -2.722   4.160   9.923
  390    HD2  PRO  53           1HD      PRO  53  -2.905   2.516   7.779
  391    HD3  PRO  53           2HD      PRO  53  -2.858   1.909   9.447
  392    H    SER  54           H        SER  54  -8.240   2.806   8.898
  393    HA   SER  54           HA       SER  54  -8.244   4.630   6.588
  394    HB2  SER  54           1HB      SER  54 -10.116   2.386   7.358
  395    HB3  SER  54           2HB      SER  54 -10.475   3.540   6.073
  396    HG   SER  54           HG       SER  54  -9.285   2.349   4.835
  397    H    SER  55           H        SER  55  -8.922   6.610   7.028
  398    HA   SER  55           HA       SER  55 -10.586   7.116   9.356
  399    HB2  SER  55           1HB      SER  55 -10.151   9.483   8.901
  400    HB3  SER  55           2HB      SER  55  -8.642   8.570   8.899
  401    HG   SER  55           HG       SER  55  -9.150   8.447   6.490
  402    H    GLY  56           H        GLY  56 -10.765   7.357   5.840
  403    HA2  GLY  56           1HA      GLY  56 -12.696   7.185   4.539
  404    HA3  GLY  56           2HA      GLY  56 -13.664   7.324   5.999
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1   6.051  23.381  34.714
    2    HA2  GLY   1           1HA      GLY   1   4.336  21.842  36.503
    3    HA3  GLY   1           2HA      GLY   1   4.218  21.912  34.751
    4    H    SER   2           H        SER   2   3.918  19.520  35.265
    5    HA   SER   2           HA       SER   2   6.546  18.192  35.385
    6    HB2  SER   2           1HB      SER   2   5.290  16.170  36.126
    7    HB3  SER   2           2HB      SER   2   5.135  17.525  37.244
    8    HG   SER   2           HG       SER   2   3.113  17.987  36.129
    9    H    SER   3           H        SER   3   7.194  16.981  33.709
   10    HA   SER   3           HA       SER   3   5.279  16.577  31.506
   11    HB2  SER   3           1HB      SER   3   6.959  18.053  30.719
   12    HB3  SER   3           2HB      SER   3   8.247  17.118  31.480
   13    HG   SER   3           HG       SER   3   8.097  15.611  29.924
   14    H    GLY   4           H        GLY   4   5.566  14.646  30.201
   15    HA2  GLY   4           1HA      GLY   4   6.465  12.389  31.862
   16    HA3  GLY   4           2HA      GLY   4   5.282  12.293  30.566
   17    H    SER   5           H        SER   5   6.123  12.733  28.346
   18    HA   SER   5           HA       SER   5   8.941  11.953  28.054
   19    HB2  SER   5           1HB      SER   5   6.648  10.769  26.469
   20    HB3  SER   5           2HB      SER   5   8.357  10.383  26.273
   21    HG   SER   5           HG       SER   5   8.127   8.991  27.813
   22    H    SER   6           H        SER   6   9.992  12.743  26.236
   23    HA   SER   6           HA       SER   6   8.927  15.173  25.167
   24    HB2  SER   6           1HB      SER   6  11.057  15.284  23.913
   25    HB3  SER   6           2HB      SER   6  11.318  14.961  25.627
   26    HG   SER   6           HG       SER   6  11.460  12.704  25.022
   27    H    GLY   7           H        GLY   7   8.295  15.641  23.075
   28    HA2  GLY   7           1HA      GLY   7   7.004  13.548  21.651
   29    HA3  GLY   7           2HA      GLY   7   7.181  15.211  21.109
   30    H    LEU   8           H        LEU   8   7.358  12.919  19.444
   31    HA   LEU   8           HA       LEU   8  10.065  13.322  18.415
   32    HB2  LEU   8           1HB      LEU   8   8.823  10.696  19.141
   33    HB3  LEU   8           2HB      LEU   8  10.026  10.796  17.857
   34    HG   LEU   8           HG       LEU   8  10.505  11.678  20.701
   35   HD11  LEU   8          1HD1      LEU   8  12.051   9.519  20.430
   36   HD12  LEU   8          2HD1      LEU   8  10.713   9.039  19.386
   37   HD13  LEU   8          3HD1      LEU   8  10.410   9.449  21.074
   38   HD21  LEU   8          3HD2      LEU   8  12.304  11.319  18.311
   39   HD22  LEU   8          1HD2      LEU   8  12.888  11.525  19.963
   40   HD23  LEU   8          2HD2      LEU   8  11.962  12.811  19.188
   41    H    LYS   9           H        LYS   9  10.208  13.329  16.216
   42    HA   LYS   9           HA       LYS   9   7.775  13.611  14.742
   43    HB2  LYS   9           1HB      LYS   9  10.659  13.544  13.839
   44    HB3  LYS   9           2HB      LYS   9   9.299  13.924  12.790
   45    HG2  LYS   9           1HG      LYS   9   8.800  15.900  14.048
   46    HG3  LYS   9           2HG      LYS   9  10.007  15.482  15.266
   47    HD2  LYS   9           1HD      LYS   9  10.817  15.794  12.404
   48    HD3  LYS   9           2HD      LYS   9  10.582  17.223  13.414
   49    HE2  LYS   9           1HE      LYS   9  12.263  14.976  14.427
   50    HE3  LYS   9           2HE      LYS   9  12.936  16.078  13.228
   51    HZ1  LYS   9           3HZ      LYS   9  13.510  17.167  15.118
   52    HZ2  LYS   9           1HZ      LYS   9  12.194  16.585  16.009
   53    HZ3  LYS   9           2HZ      LYS   9  11.975  17.846  14.903
   54    H    CYS  10           H        CYS  10   6.595  11.848  14.322
   55    HA   CYS  10           HA       CYS  10   7.984   9.448  13.332
   56    HB2  CYS  10           1HB      CYS  10   5.458   9.813  14.910
   57    HB3  CYS  10           2HB      CYS  10   5.686   8.368  13.933
   58    HG   CYS  10           HG       CYS  10   6.904   7.098  15.789
   59    H    SER  11           H        SER  11   7.867   9.192  11.211
   60    HA   SER  11           HA       SER  11   6.301  10.669   9.464
   61    HB2  SER  11           1HB      SER  11   6.857   8.913   7.776
   62    HB3  SER  11           2HB      SER  11   8.260   9.480   8.681
   63    HG   SER  11           HG       SER  11   7.873   7.598  10.071
   64    H    THR  12           H        THR  12   4.737   9.589   7.841
   65    HA   THR  12           HA       THR  12   2.406   8.846   9.270
   66    HB   THR  12           HB       THR  12   1.455   8.395   6.963
   67    HG1  THR  12           HG1      THR  12   3.717   9.654   5.889
   68   HG21  THR  12          3HG2      THR  12   1.054  10.628   6.621
   69   HG22  THR  12          1HG2      THR  12   2.729  11.088   6.922
   70   HG23  THR  12          2HG2      THR  12   1.671  10.680   8.273
   71    H    VAL  13           H        VAL  13   4.105   7.007   6.725
   72    HA   VAL  13           HA       VAL  13   4.299   4.618   8.203
   73    HB   VAL  13           HB       VAL  13   1.871   4.544   8.015
   74   HG11  VAL  13          1HG1      VAL  13   0.789   4.345   5.814
   75   HG12  VAL  13          2HG1      VAL  13   1.580   5.908   6.029
   76   HG13  VAL  13          3HG1      VAL  13   2.340   4.663   5.037
   77   HG21  VAL  13          3HG2      VAL  13   1.732   2.368   6.627
   78   HG22  VAL  13          1HG2      VAL  13   3.476   2.559   6.450
   79   HG23  VAL  13          2HG2      VAL  13   2.765   2.399   8.056
   80    H    VAL  14           H        VAL  14   5.474   3.060   7.123
   81    HA   VAL  14           HA       VAL  14   6.425   3.841   4.450
   82    HB   VAL  14           HB       VAL  14   8.411   2.461   4.921
   83   HG11  VAL  14          1HG1      VAL  14   9.119   4.503   5.494
   84   HG12  VAL  14          2HG1      VAL  14   7.643   4.861   6.392
   85   HG13  VAL  14          3HG1      VAL  14   8.944   3.952   7.160
   86   HG21  VAL  14          3HG2      VAL  14   8.732   1.817   7.377
   87   HG22  VAL  14          1HG2      VAL  14   6.982   1.984   7.518
   88   HG23  VAL  14          2HG2      VAL  14   7.667   0.803   6.402
   89    H    CYS  15           H        CYS  15   7.004   2.068   2.972
   90    HA   CYS  15           HA       CYS  15   4.944   0.453   2.269
   91    HB2  CYS  15           1HB      CYS  15   7.120   0.873   1.011
   92    HB3  CYS  15           2HB      CYS  15   7.809  -0.443   1.957
   93    H    VAL  16           H        VAL  16   3.968  -1.294   3.051
   94    HA   VAL  16           HA       VAL  16   4.938  -2.531   5.462
   95    HB   VAL  16           HB       VAL  16   2.890  -3.869   5.382
   96   HG11  VAL  16          1HG1      VAL  16   1.480  -1.499   4.804
   97   HG12  VAL  16          2HG1      VAL  16   1.980  -2.107   6.383
   98   HG13  VAL  16          3HG1      VAL  16   3.033  -1.015   5.483
   99   HG21  VAL  16          3HG2      VAL  16   1.671  -4.211   3.537
  100   HG22  VAL  16          1HG2      VAL  16   1.703  -2.504   3.095
  101   HG23  VAL  16          2HG2      VAL  16   3.051  -3.554   2.658
  102    H    ILE  17           H        ILE  17   6.258  -2.870   2.701
  103    HA   ILE  17           HA       ILE  17   6.439  -5.809   2.822
  104    HB   ILE  17           HB       ILE  17   6.830  -4.171   0.320
  105   HG12  ILE  17          1HG1      ILE  17   4.484  -4.046   1.128
  106   HG13  ILE  17          2HG1      ILE  17   4.633  -4.910  -0.399
  107   HG21  ILE  17          1HG2      ILE  17   6.127  -6.879  -0.156
  108   HG22  ILE  17          2HG2      ILE  17   7.634  -6.049  -0.541
  109   HG23  ILE  17          3HG2      ILE  17   7.442  -6.850   1.019
  110   HD11  ILE  17          3HD1      ILE  17   3.562  -5.795   2.116
  111   HD12  ILE  17          1HD1      ILE  17   3.462  -6.544   0.522
  112   HD13  ILE  17          2HD1      ILE  17   4.847  -6.869   1.565
  113    H    CYS  18           H        CYS  18   8.174  -2.917   1.659
  114    HA   CYS  18           HA       CYS  18  10.697  -4.239   2.406
  115    HB2  CYS  18           1HB      CYS  18  11.808  -2.837   0.777
  116    HB3  CYS  18           2HB      CYS  18  10.452  -3.650   0.002
  117    H    LEU  19           H        LEU  19   8.553  -1.816   3.292
  118    HA   LEU  19           HA       LEU  19   8.609  -0.181   4.871
  119    HB2  LEU  19           1HB      LEU  19  11.264  -1.434   5.553
  120    HB3  LEU  19           2HB      LEU  19  10.430  -0.231   6.535
  121    HG   LEU  19           HG       LEU  19   8.526  -1.916   6.697
  122   HD11  LEU  19          1HD1      LEU  19   9.782  -4.302   6.520
  123   HD12  LEU  19          2HD1      LEU  19  10.509  -3.448   5.159
  124   HD13  LEU  19          3HD1      LEU  19   8.757  -3.624   5.255
  125   HD21  LEU  19          3HD2      LEU  19   9.376  -2.700   8.666
  126   HD22  LEU  19          1HD2      LEU  19  10.513  -1.388   8.353
  127   HD23  LEU  19          2HD2      LEU  19  10.960  -3.051   7.973
  128    H    GLU  20           H        GLU  20   9.119   0.783   2.484
  129    HA   GLU  20           HA       GLU  20  11.289   2.714   2.943
  130    HB2  GLU  20           1HB      GLU  20  10.638   1.350   0.325
  131    HB3  GLU  20           2HB      GLU  20  11.770   2.681   0.508
  132    HG2  GLU  20           1HG      GLU  20  12.202   0.294   2.202
  133    HG3  GLU  20           2HG      GLU  20  12.534   0.140   0.478
  134    H    LYS  21           H        LYS  21  11.044   4.692   1.575
  135    HA   LYS  21           HA       LYS  21   8.668   5.991   2.038
  136    HB2  LYS  21           1HB      LYS  21  10.648   7.233   1.476
  137    HB3  LYS  21           2HB      LYS  21  10.730   6.484  -0.113
  138    HG2  LYS  21           1HG      LYS  21   8.687   7.620  -0.776
  139    HG3  LYS  21           2HG      LYS  21   8.553   8.340   0.831
  140    HD2  LYS  21           1HD      LYS  21  10.829   9.365   0.417
  141    HD3  LYS  21           2HD      LYS  21  10.658   8.848  -1.262
  142    HE2  LYS  21           1HE      LYS  21   8.503  10.121  -1.338
  143    HE3  LYS  21           2HE      LYS  21   8.890  10.757   0.260
  144    HZ1  LYS  21           3HZ      LYS  21  11.098  11.427  -0.914
  145    HZ2  LYS  21           1HZ      LYS  21   9.717  12.388  -1.089
  146    HZ3  LYS  21           2HZ      LYS  21  10.166  11.321  -2.322
  147    HA   PRO  22           HA       PRO  22   6.139   3.773  -0.967
  148    HB2  PRO  22           1HB      PRO  22   3.780   4.676   0.028
  149    HB3  PRO  22           2HB      PRO  22   4.677   3.336   0.751
  150    HG2  PRO  22           1HG      PRO  22   4.579   6.213   1.574
  151    HG3  PRO  22           2HG      PRO  22   4.522   4.757   2.585
  152    HD2  PRO  22           1HD      PRO  22   6.779   6.219   2.259
  153    HD3  PRO  22           2HD      PRO  22   6.807   4.461   2.505
  154    H    LYS  23           H        LYS  23   6.015   4.593  -2.954
  155    HA   LYS  23           HA       LYS  23   5.690   7.417  -3.416
  156    HB2  LYS  23           1HB      LYS  23   5.966   5.041  -5.254
  157    HB3  LYS  23           2HB      LYS  23   5.715   6.676  -5.852
  158    HG2  LYS  23           1HG      LYS  23   7.782   7.408  -4.851
  159    HG3  LYS  23           2HG      LYS  23   8.016   5.824  -4.106
  160    HD2  LYS  23           1HD      LYS  23   7.750   6.150  -7.080
  161    HD3  LYS  23           2HD      LYS  23   9.304   6.328  -6.262
  162    HE2  LYS  23           1HE      LYS  23   9.046   4.067  -5.328
  163    HE3  LYS  23           2HE      LYS  23   7.520   3.895  -6.193
  164    HZ1  LYS  23           3HZ      LYS  23   8.720   3.089  -7.860
  165    HZ2  LYS  23           1HZ      LYS  23  10.183   3.550  -7.147
  166    HZ3  LYS  23           2HZ      LYS  23   9.327   4.648  -8.106
  167    H    TYR  24           H        TYR  24   3.729   4.512  -3.753
  168    HA   TYR  24           HA       TYR  24   1.374   6.226  -4.112
  169    HB2  TYR  24           1HB      TYR  24   1.508   3.630  -5.593
  170    HB3  TYR  24           2HB      TYR  24   0.559   5.070  -5.946
  171    HD1  TYR  24           HD1      TYR  24   3.977   3.647  -6.073
  172    HD2  TYR  24           HD2      TYR  24   1.374   6.734  -7.415
  173    HE1  TYR  24           HE1      TYR  24   5.664   4.345  -7.721
  174    HE2  TYR  24           HE2      TYR  24   3.053   7.439  -9.068
  175    HH   TYR  24           HH       TYR  24   6.077   6.852  -8.981
  176    H    ARG  25           H        ARG  25  -0.686   4.881  -3.812
  177    HA   ARG  25           HA       ARG  25  -0.270   2.826  -1.747
  178    HB2  ARG  25           1HB      ARG  25  -1.981   5.281  -1.657
  179    HB3  ARG  25           2HB      ARG  25  -2.495   3.840  -0.789
  180    HG2  ARG  25           1HG      ARG  25  -0.315   3.843   0.397
  181    HG3  ARG  25           2HG      ARG  25   0.063   5.374  -0.395
  182    HD2  ARG  25           1HD      ARG  25  -2.387   4.935   1.301
  183    HD3  ARG  25           2HD      ARG  25  -0.866   5.561   1.935
  184    HE   ARG  25           HE       ARG  25  -2.775   6.963   0.280
  185   HH11  ARG  25          2HH1      ARG  25   0.487   6.846   1.492
  186   HH12  ARG  25          1HH1      ARG  25   0.779   8.535   1.240
  187   HH21  ARG  25          2HH2      ARG  25  -2.402   9.188  -0.056
  188   HH22  ARG  25          1HH2      ARG  25  -0.865   9.867   0.361
  189    H    CYS  26           H        CYS  26  -2.212   1.460  -1.389
  190    HA   CYS  26           HA       CYS  26  -3.197   0.497  -3.887
  191    HB2  CYS  26           1HB      CYS  26  -2.704  -0.983  -1.961
  192    HB3  CYS  26           2HB      CYS  26  -4.047  -0.259  -1.083
  193    HA   PRO  27           HA       PRO  27  -6.756   3.131  -4.147
  194    HB2  PRO  27           1HB      PRO  27  -7.931   1.865  -6.241
  195    HB3  PRO  27           2HB      PRO  27  -6.534   2.932  -6.425
  196    HG2  PRO  27           1HG      PRO  27  -6.632  -0.058  -6.305
  197    HG3  PRO  27           2HG      PRO  27  -5.689   0.988  -7.383
  198    HD2  PRO  27           1HD      PRO  27  -4.615  -0.202  -5.200
  199    HD3  PRO  27           2HD      PRO  27  -4.070   1.382  -5.790
  200    H    ALA  28           H        ALA  28  -6.622   0.236  -2.743
  201    HA   ALA  28           HA       ALA  28  -9.550   0.016  -2.480
  202    HB1  ALA  28           3HB      ALA  28  -7.469  -2.078  -2.803
  203    HB2  ALA  28           1HB      ALA  28  -8.848  -2.432  -1.761
  204    HB3  ALA  28           2HB      ALA  28  -9.107  -1.998  -3.451
  205    H    CYS  29           H        CYS  29  -6.775  -1.335  -0.705
  206    HA   CYS  29           HA       CYS  29  -8.064  -0.678   1.809
  207    HB2  CYS  29           1HB      CYS  29  -6.113  -1.890   2.806
  208    HB3  CYS  29           2HB      CYS  29  -7.050  -2.853   1.670
  209    H    ARG  30           H        ARG  30  -5.725   0.675  -0.271
  210    HA   ARG  30           HA       ARG  30  -4.520   2.605  -0.157
  211    HB2  ARG  30           1HB      ARG  30  -5.789   3.033   2.551
  212    HB3  ARG  30           2HB      ARG  30  -5.029   4.249   1.533
  213    HG2  ARG  30           1HG      ARG  30  -7.430   2.703   0.621
  214    HG3  ARG  30           2HG      ARG  30  -7.572   4.172   1.588
  215    HD2  ARG  30           1HD      ARG  30  -6.149   5.314  -0.151
  216    HD3  ARG  30           2HD      ARG  30  -6.340   3.868  -1.141
  217    HE   ARG  30           HE       ARG  30  -8.884   4.502  -0.593
  218   HH11  ARG  30          2HH1      ARG  30  -6.208   6.421  -1.724
  219   HH12  ARG  30          1HH1      ARG  30  -7.206   7.522  -2.615
  220   HH21  ARG  30          2HH2      ARG  30 -10.208   5.944  -1.763
  221   HH22  ARG  30          1HH2      ARG  30  -9.481   7.250  -2.636
  222    H    VAL  31           H        VAL  31  -3.074   0.476   0.314
  223    HA   VAL  31           HA       VAL  31  -1.625   0.853   2.834
  224    HB   VAL  31           HB       VAL  31  -0.489  -1.274   2.270
  225   HG11  VAL  31          1HG1      VAL  31  -2.729  -2.659   2.293
  226   HG12  VAL  31          2HG1      VAL  31  -2.241  -1.690   3.685
  227   HG13  VAL  31          3HG1      VAL  31  -3.444  -1.069   2.554
  228   HG21  VAL  31          3HG2      VAL  31  -2.359  -2.120   0.230
  229   HG22  VAL  31          1HG2      VAL  31  -1.393  -0.743  -0.302
  230   HG23  VAL  31          2HG2      VAL  31  -0.598  -2.217   0.253
  231    HA   PRO  32           HA       PRO  32   1.751   2.895   0.891
  232    HB2  PRO  32           1HB      PRO  32   3.750   2.191   2.587
  233    HB3  PRO  32           2HB      PRO  32   2.500   3.367   3.011
  234    HG2  PRO  32           1HG      PRO  32   2.696   0.467   3.729
  235    HG3  PRO  32           2HG      PRO  32   2.228   1.842   4.746
  236    HD2  PRO  32           1HD      PRO  32   0.413   0.165   3.640
  237    HD3  PRO  32           2HD      PRO  32   0.078   1.886   3.917
  238    H    TYR  33           H        TYR  33   2.598   2.225  -0.975
  239    HA   TYR  33           HA       TYR  33   4.375  -0.090  -0.977
  240    HB2  TYR  33           1HB      TYR  33   3.260  -1.317  -2.561
  241    HB3  TYR  33           2HB      TYR  33   1.881  -0.572  -1.760
  242    HD1  TYR  33           HD2      TYR  33   4.233   0.032  -4.598
  243    HD2  TYR  33           HD1      TYR  33   0.299   0.518  -3.052
  244    HE1  TYR  33           HE2      TYR  33   3.513   0.992  -6.745
  245    HE2  TYR  33           HE1      TYR  33  -0.432   1.479  -5.195
  246    HH   TYR  33           HH       TYR  33   1.154   1.161  -7.987
  247    H    CYS  34           H        CYS  34   6.191   0.345  -2.040
  248    HA   CYS  34           HA       CYS  34   6.600   2.855  -3.298
  249    HB2  CYS  34           1HB      CYS  34   8.819   1.718  -3.996
  250    HB3  CYS  34           2HB      CYS  34   8.513   1.977  -2.282
  251    H    SER  35           H        SER  35   7.086  -0.377  -4.721
  252    HA   SER  35           HA       SER  35   6.083   0.708  -7.272
  253    HB2  SER  35           1HB      SER  35   8.240  -1.353  -6.772
  254    HB3  SER  35           2HB      SER  35   7.559  -1.013  -8.363
  255    HG   SER  35           HG       SER  35   9.553   0.150  -7.725
  256    H    VAL  36           H        VAL  36   5.596  -1.350  -8.781
  257    HA   VAL  36           HA       VAL  36   3.241  -2.494  -7.770
  258    HB   VAL  36           HB       VAL  36   3.205  -3.871  -9.776
  259   HG11  VAL  36          1HG1      VAL  36   4.101  -1.689 -11.282
  260   HG12  VAL  36          2HG1      VAL  36   2.456  -2.007 -10.728
  261   HG13  VAL  36          3HG1      VAL  36   3.540  -1.014  -9.752
  262   HG21  VAL  36          3HG2      VAL  36   5.355  -4.688 -10.084
  263   HG22  VAL  36          1HG2      VAL  36   5.200  -3.510 -11.388
  264   HG23  VAL  36          2HG2      VAL  36   6.092  -3.094  -9.925
  265    H    VAL  37           H        VAL  37   6.475  -3.888  -8.247
  266    HA   VAL  37           HA       VAL  37   6.165  -6.493  -7.665
  267    HB   VAL  37           HB       VAL  37   8.290  -4.712  -6.465
  268   HG11  VAL  37          1HG1      VAL  37   8.122  -7.706  -6.740
  269   HG12  VAL  37          2HG1      VAL  37   9.628  -6.840  -6.429
  270   HG13  VAL  37          3HG1      VAL  37   8.307  -6.763  -5.262
  271   HG21  VAL  37          3HG2      VAL  37   7.957  -6.049  -9.111
  272   HG22  VAL  37          1HG2      VAL  37   8.565  -4.437  -8.732
  273   HG23  VAL  37          2HG2      VAL  37   9.577  -5.852  -8.441
  274    H    CYS  38           H        CYS  38   6.614  -4.029  -5.121
  275    HA   CYS  38           HA       CYS  38   6.126  -5.747  -2.959
  276    HB2  CYS  38           1HB      CYS  38   6.079  -2.778  -3.333
  277    HB3  CYS  38           2HB      CYS  38   5.463  -3.462  -1.833
  278    H    PHE  39           H        PHE  39   3.958  -3.777  -4.915
  279    HA   PHE  39           HA       PHE  39   1.650  -4.138  -3.317
  280    HB2  PHE  39           1HB      PHE  39   1.660  -2.330  -4.876
  281    HB3  PHE  39           2HB      PHE  39   2.015  -3.408  -6.222
  282    HD1  PHE  39           HD1      PHE  39  -0.579  -2.865  -3.600
  283    HD2  PHE  39           HD2      PHE  39   0.289  -4.053  -7.594
  284    HE1  PHE  39           HE1      PHE  39  -2.988  -3.078  -4.056
  285    HE2  PHE  39           HE2      PHE  39  -2.118  -4.267  -8.057
  286    HZ   PHE  39           HZ       PHE  39  -3.760  -3.779  -6.287
  287    H    ARG  40           H        ARG  40   3.159  -6.040  -5.823
  288    HA   ARG  40           HA       ARG  40   1.046  -7.694  -6.562
  289    HB2  ARG  40           1HB      ARG  40   3.990  -8.341  -6.334
  290    HB3  ARG  40           2HB      ARG  40   2.807  -9.353  -7.153
  291    HG2  ARG  40           1HG      ARG  40   2.317  -7.165  -8.502
  292    HG3  ARG  40           2HG      ARG  40   3.938  -6.722  -7.963
  293    HD2  ARG  40           1HD      ARG  40   3.194  -9.228  -9.468
  294    HD3  ARG  40           2HD      ARG  40   3.985  -7.809 -10.153
  295    HE   ARG  40           HE       ARG  40   5.398  -8.964  -7.932
  296   HH11  ARG  40          2HH1      ARG  40   4.896  -9.066 -11.376
  297   HH12  ARG  40          1HH1      ARG  40   6.438  -9.783 -11.710
  298   HH21  ARG  40          2HH2      ARG  40   7.430  -9.908  -8.360
  299   HH22  ARG  40          1HH2      ARG  40   7.878 -10.262  -9.994
  300    H    LYS  41           H        LYS  41   3.636  -8.575  -4.270
  301    HA   LYS  41           HA       LYS  41   2.537 -10.869  -3.250
  302    HB2  LYS  41           1HB      LYS  41   4.106  -8.785  -1.720
  303    HB3  LYS  41           2HB      LYS  41   3.864 -10.452  -1.213
  304    HG2  LYS  41           1HG      LYS  41   5.079 -11.233  -3.180
  305    HG3  LYS  41           2HG      LYS  41   5.316  -9.563  -3.698
  306    HD2  LYS  41           1HD      LYS  41   6.766  -9.097  -1.924
  307    HD3  LYS  41           2HD      LYS  41   6.226 -10.498  -0.996
  308    HE2  LYS  41           1HE      LYS  41   7.642 -10.762  -3.634
  309    HE3  LYS  41           2HE      LYS  41   8.514 -10.647  -2.106
  310    HZ1  LYS  41           3HZ      LYS  41   8.213 -12.812  -1.858
  311    HZ2  LYS  41           1HZ      LYS  41   7.271 -12.898  -3.261
  312    HZ3  LYS  41           2HZ      LYS  41   6.541 -12.571  -1.771
  313    H    HIS  42           H        HIS  42   1.800  -7.541  -2.369
  314    HA   HIS  42           HA       HIS  42   0.187  -8.143  -0.119
  315    HB2  HIS  42           1HB      HIS  42   0.789  -5.932  -0.081
  316    HB3  HIS  42           2HB      HIS  42   0.668  -5.757  -1.829
  317    HD1  HIS  42           HD1      HIS  42  -1.556  -5.941   1.230
  318    HD2  HIS  42           HD2      HIS  42  -1.656  -4.623  -2.709
  319    HE1  HIS  42           HE1      HIS  42  -3.733  -4.705   0.989
  320    H    LYS  43           H        LYS  43  -0.844  -6.945  -3.319
  321    HA   LYS  43           HA       LYS  43  -3.507  -7.203  -3.207
  322    HB2  LYS  43           1HB      LYS  43  -2.188  -6.560  -5.228
  323    HB3  LYS  43           2HB      LYS  43  -1.882  -8.267  -5.523
  324    HG2  LYS  43           1HG      LYS  43  -3.993  -8.665  -6.255
  325    HG3  LYS  43           2HG      LYS  43  -4.706  -7.425  -5.221
  326    HD2  LYS  43           1HD      LYS  43  -4.123  -5.701  -6.693
  327    HD3  LYS  43           2HD      LYS  43  -2.936  -6.701  -7.535
  328    HE2  LYS  43           1HE      LYS  43  -5.015  -8.162  -8.129
  329    HE3  LYS  43           2HE      LYS  43  -5.917  -6.694  -7.755
  330    HZ1  LYS  43           3HZ      LYS  43  -3.809  -7.019  -9.817
  331    HZ2  LYS  43           1HZ      LYS  43  -4.472  -5.526  -9.378
  332    HZ3  LYS  43           2HZ      LYS  43  -5.453  -6.715 -10.074
  333    H    GLU  44           H        GLU  44  -1.252  -9.897  -3.579
  334    HA   GLU  44           HA       GLU  44  -2.785 -12.019  -4.181
  335    HB2  GLU  44           1HB      GLU  44  -0.752 -11.881  -1.949
  336    HB3  GLU  44           2HB      GLU  44  -1.396 -13.377  -2.610
  337    HG2  GLU  44           1HG      GLU  44  -0.513 -12.686  -4.837
  338    HG3  GLU  44           2HG      GLU  44   0.271 -11.324  -4.039
  339    H    GLN  45           H        GLN  45  -2.625 -10.528  -0.963
  340    HA   GLN  45           HA       GLN  45  -5.167 -11.866  -0.319
  341    HB2  GLN  45           1HB      GLN  45  -4.477 -12.228   1.928
  342    HB3  GLN  45           2HB      GLN  45  -3.175 -12.816   0.901
  343    HG2  GLN  45           1HG      GLN  45  -1.840 -10.906   1.360
  344    HG3  GLN  45           2HG      GLN  45  -3.180 -10.088   2.161
  345   HE21  GLN  45          1HE2      GLN  45  -0.638 -12.379   2.464
  346   HE22  GLN  45          2HE2      GLN  45  -0.828 -12.697   4.151
  347    H    CYS  46           H        CYS  46  -4.539  -9.179  -1.410
  348    HA   CYS  46           HA       CYS  46  -4.813  -7.199   0.563
  349    HB2  CYS  46           1HB      CYS  46  -4.120  -6.387  -1.508
  350    HB3  CYS  46           2HB      CYS  46  -5.343  -7.300  -2.386
  351    H    ASN  47           H        ASN  47  -6.410  -7.361   2.030
  352    HA   ASN  47           HA       ASN  47  -9.162  -7.679   1.026
  353    HB2  ASN  47           1HB      ASN  47  -8.147  -9.437   2.636
  354    HB3  ASN  47           2HB      ASN  47  -8.352  -8.202   3.875
  355   HD21  ASN  47          1HD2      ASN  47  -9.628 -10.796   3.632
  356   HD22  ASN  47          2HD2      ASN  47 -11.329 -10.496   3.578
  357    HA   PRO  48           HA       PRO  48  -9.246  -3.374   2.405
  358    HB2  PRO  48           1HB      PRO  48 -11.532  -2.771   1.070
  359    HB3  PRO  48           2HB      PRO  48  -9.946  -2.814   0.290
  360    HG2  PRO  48           1HG      PRO  48 -12.104  -4.889   0.313
  361    HG3  PRO  48           2HG      PRO  48 -11.094  -4.340  -1.037
  362    HD2  PRO  48           1HD      PRO  48 -10.596  -6.632   0.317
  363    HD3  PRO  48           2HD      PRO  48  -9.304  -5.642  -0.392
  364    H    GLU  49           H        GLU  49 -10.939  -6.028   3.315
  365    HA   GLU  49           HA       GLU  49 -12.984  -4.541   4.804
  366    HB2  GLU  49           1HB      GLU  49 -12.662  -7.498   4.272
  367    HB3  GLU  49           2HB      GLU  49 -13.920  -6.811   5.291
  368    HG2  GLU  49           1HG      GLU  49 -14.567  -5.425   3.244
  369    HG3  GLU  49           2HG      GLU  49 -13.557  -6.544   2.330
  370    H    THR  50           H        THR  50 -11.911  -3.704   6.539
  371    HA   THR  50           HA       THR  50 -10.512  -5.616   8.293
  372    HB   THR  50           HB       THR  50  -9.019  -3.858   7.524
  373    HG1  THR  50           HG1      THR  50  -8.219  -3.503   9.496
  374   HG21  THR  50          3HG2      THR  50 -11.173  -2.033   8.559
  375   HG22  THR  50          1HG2      THR  50 -10.430  -2.059   6.961
  376   HG23  THR  50          2HG2      THR  50  -9.509  -1.489   8.353
  377    H    SER  51           H        SER  51 -10.988  -5.662  10.475
  378    HA   SER  51           HA       SER  51 -13.331  -4.084  11.318
  379    HB2  SER  51           1HB      SER  51 -14.042  -6.020  12.677
  380    HB3  SER  51           2HB      SER  51 -13.975  -6.420  10.960
  381    HG   SER  51           HG       SER  51 -12.879  -8.054  11.805
  382    H    GLY  52           H        GLY  52 -13.350  -3.289  13.407
  383    HA2  GLY  52           1HA      GLY  52 -12.546  -2.850  15.548
  384    HA3  GLY  52           2HA      GLY  52 -11.219  -3.964  15.250
  385    HA   PRO  53           HA       PRO  53  -9.135   0.056  15.296
  386    HB2  PRO  53           1HB      PRO  53  -6.696  -0.981  15.886
  387    HB3  PRO  53           2HB      PRO  53  -7.933  -0.678  17.111
  388    HG2  PRO  53           1HG      PRO  53  -7.200  -3.244  15.754
  389    HG3  PRO  53           2HG      PRO  53  -7.559  -2.946  17.465
  390    HD2  PRO  53           1HD      PRO  53  -9.373  -4.009  15.759
  391    HD3  PRO  53           2HD      PRO  53  -9.838  -2.969  17.120
  392    H    SER  54           H        SER  54  -8.959   0.761  13.240
  393    HA   SER  54           HA       SER  54  -7.862  -0.784  11.119
  394    HB2  SER  54           1HB      SER  54  -8.506   2.164  11.331
  395    HB3  SER  54           2HB      SER  54  -7.980   1.379   9.842
  396    HG   SER  54           HG       SER  54 -10.387   1.614  10.470
  397    H    SER  55           H        SER  55  -5.809  -1.403  11.983
  398    HA   SER  55           HA       SER  55  -3.809   0.755  12.045
  399    HB2  SER  55           1HB      SER  55  -3.897  -1.960  13.347
  400    HB3  SER  55           2HB      SER  55  -2.382  -1.076  13.167
  401    HG   SER  55           HG       SER  55  -4.142   0.621  14.141
  402    H    GLY  56           H        GLY  56  -3.745   0.783   9.709
  403    HA2  GLY  56           1HA      GLY  56  -1.636  -0.168   8.442
  404    HA3  GLY  56           2HA      GLY  56  -2.653  -1.601   8.415
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1   8.132  19.359  38.538
    2    HA2  GLY   1           1HA      GLY   1  10.260  17.364  38.525
    3    HA3  GLY   1           2HA      GLY   1   8.888  17.049  37.473
    4    H    SER   2           H        SER   2  10.822  17.111  35.938
    5    HA   SER   2           HA       SER   2  12.030  19.580  35.284
    6    HB2  SER   2           1HB      SER   2  12.702  18.448  33.183
    7    HB3  SER   2           2HB      SER   2  13.029  17.459  34.606
    8    HG   SER   2           HG       SER   2  11.760  16.665  32.543
    9    H    SER   3           H        SER   3  11.539  21.118  33.771
   10    HA   SER   3           HA       SER   3   9.022  20.823  32.287
   11    HB2  SER   3           1HB      SER   3   8.182  22.915  32.979
   12    HB3  SER   3           2HB      SER   3   8.790  22.181  34.463
   13    HG   SER   3           HG       SER   3  10.093  23.805  34.641
   14    H    GLY   4           H        GLY   4   9.197  21.375  30.210
   15    HA2  GLY   4           1HA      GLY   4  10.059  23.315  28.774
   16    HA3  GLY   4           2HA      GLY   4  11.631  22.820  29.385
   17    H    SER   5           H        SER   5   9.278  22.352  26.992
   18    HA   SER   5           HA       SER   5  10.933  20.699  25.427
   19    HB2  SER   5           1HB      SER   5  10.393  18.871  26.854
   20    HB3  SER   5           2HB      SER   5   8.689  19.321  26.904
   21    HG   SER   5           HG       SER   5   9.906  17.688  25.202
   22    H    SER   6           H        SER   6  10.185  20.500  23.326
   23    HA   SER   6           HA       SER   6   7.467  21.121  22.630
   24    HB2  SER   6           1HB      SER   6   8.767  23.357  23.065
   25    HB3  SER   6           2HB      SER   6   9.477  23.029  21.485
   26    HG   SER   6           HG       SER   6   7.433  24.316  21.614
   27    H    GLY   7           H        GLY   7   6.987  20.694  20.442
   28    HA2  GLY   7           1HA      GLY   7   8.411  20.334  18.244
   29    HA3  GLY   7           2HA      GLY   7   8.951  18.943  19.172
   30    H    LEU   8           H        LEU   8   6.729  20.025  16.945
   31    HA   LEU   8           HA       LEU   8   4.459  18.470  17.666
   32    HB2  LEU   8           1HB      LEU   8   5.360  19.892  15.201
   33    HB3  LEU   8           2HB      LEU   8   3.998  18.778  15.112
   34    HG   LEU   8           HG       LEU   8   3.345  21.160  15.363
   35   HD11  LEU   8          1HD1      LEU   8   1.668  19.697  15.999
   36   HD12  LEU   8          2HD1      LEU   8   1.863  20.704  17.433
   37   HD13  LEU   8          3HD1      LEU   8   2.578  19.093  17.384
   38   HD21  LEU   8          3HD2      LEU   8   4.007  21.164  18.229
   39   HD22  LEU   8          1HD2      LEU   8   4.025  22.479  17.054
   40   HD23  LEU   8          2HD2      LEU   8   5.377  21.350  17.133
   41    H    LYS   9           H        LYS   9   4.255  16.342  17.587
   42    HA   LYS   9           HA       LYS   9   6.214  14.719  16.222
   43    HB2  LYS   9           1HB      LYS   9   5.469  13.990  18.396
   44    HB3  LYS   9           2HB      LYS   9   3.788  14.016  17.880
   45    HG2  LYS   9           1HG      LYS   9   4.145  12.157  16.414
   46    HG3  LYS   9           2HG      LYS   9   5.883  12.196  16.716
   47    HD2  LYS   9           1HD      LYS   9   5.072  11.931  19.227
   48    HD3  LYS   9           2HD      LYS   9   3.670  11.206  18.437
   49    HE2  LYS   9           1HE      LYS   9   5.002   9.360  18.710
   50    HE3  LYS   9           2HE      LYS   9   5.502   9.885  17.102
   51    HZ1  LYS   9           3HZ      LYS   9   7.435  10.903  18.008
   52    HZ2  LYS   9           1HZ      LYS   9   7.361   9.330  18.627
   53    HZ3  LYS   9           2HZ      LYS   9   6.918  10.643  19.597
   54    H    CYS  10           H        CYS  10   5.816  13.263  14.547
   55    HA   CYS  10           HA       CYS  10   3.252  13.579  13.141
   56    HB2  CYS  10           1HB      CYS  10   4.446  13.588  10.995
   57    HB3  CYS  10           2HB      CYS  10   4.938  14.944  12.002
   58    HG   CYS  10           HG       CYS  10   7.054  12.696  12.776
   59    H    SER  11           H        SER  11   2.415  11.763  12.198
   60    HA   SER  11           HA       SER  11   3.842   9.257  12.775
   61    HB2  SER  11           1HB      SER  11   1.655   9.522  13.895
   62    HB3  SER  11           2HB      SER  11   0.881   9.702  12.320
   63    HG   SER  11           HG       SER  11   0.900   7.526  13.339
   64    H    THR  12           H        THR  12   5.083   9.179  10.895
   65    HA   THR  12           HA       THR  12   3.680   9.142   8.330
   66    HB   THR  12           HB       THR  12   6.648   9.012   8.899
   67    HG1  THR  12           HG1      THR  12   6.607  11.197   8.251
   68   HG21  THR  12          3HG2      THR  12   5.533   8.089   6.673
   69   HG22  THR  12          1HG2      THR  12   7.047   8.993   6.646
   70   HG23  THR  12          2HG2      THR  12   5.528   9.803   6.260
   71    H    VAL  13           H        VAL  13   3.553   7.367   7.018
   72    HA   VAL  13           HA       VAL  13   4.412   4.815   8.214
   73    HB   VAL  13           HB       VAL  13   1.906   5.306   7.802
   74   HG11  VAL  13          1HG1      VAL  13   2.529   6.057   5.388
   75   HG12  VAL  13          2HG1      VAL  13   2.465   4.329   5.034
   76   HG13  VAL  13          3HG1      VAL  13   1.040   5.154   5.668
   77   HG21  VAL  13          3HG2      VAL  13   2.209   2.785   6.500
   78   HG22  VAL  13          1HG2      VAL  13   3.470   2.956   7.721
   79   HG23  VAL  13          2HG2      VAL  13   1.774   3.121   8.176
   80    H    VAL  14           H        VAL  14   5.243   3.180   6.843
   81    HA   VAL  14           HA       VAL  14   6.172   4.116   4.209
   82    HB   VAL  14           HB       VAL  14   8.289   2.894   4.566
   83   HG11  VAL  14          1HG1      VAL  14   9.176   4.817   5.245
   84   HG12  VAL  14          2HG1      VAL  14   7.539   5.382   5.583
   85   HG13  VAL  14          3HG1      VAL  14   8.493   4.628   6.860
   86   HG21  VAL  14          3HG2      VAL  14   8.888   1.892   6.574
   87   HG22  VAL  14          1HG2      VAL  14   7.649   2.753   7.487
   88   HG23  VAL  14          2HG2      VAL  14   7.192   1.438   6.405
   89    H    CYS  15           H        CYS  15   6.914   2.275   2.807
   90    HA   CYS  15           HA       CYS  15   4.936   0.530   2.193
   91    HB2  CYS  15           1HB      CYS  15   7.091   0.973   0.913
   92    HB3  CYS  15           2HB      CYS  15   7.841  -0.246   1.938
   93    H    VAL  16           H        VAL  16   3.993  -1.139   3.151
   94    HA   VAL  16           HA       VAL  16   5.054  -2.229   5.590
   95    HB   VAL  16           HB       VAL  16   3.028  -3.672   5.556
   96   HG11  VAL  16          1HG1      VAL  16   1.697  -2.009   6.352
   97   HG12  VAL  16          2HG1      VAL  16   3.214  -1.112   6.255
   98   HG13  VAL  16          3HG1      VAL  16   2.008  -0.949   4.978
   99   HG21  VAL  16          3HG2      VAL  16   3.034  -3.502   2.918
  100   HG22  VAL  16          1HG2      VAL  16   1.541  -3.751   3.822
  101   HG23  VAL  16          2HG2      VAL  16   1.962  -2.140   3.240
  102    H    ILE  17           H        ILE  17   6.239  -2.710   2.754
  103    HA   ILE  17           HA       ILE  17   6.483  -5.634   3.039
  104    HB   ILE  17           HB       ILE  17   6.858  -4.105   0.468
  105   HG12  ILE  17          1HG1      ILE  17   4.533  -3.880   1.166
  106   HG13  ILE  17          2HG1      ILE  17   4.646  -4.991  -0.194
  107   HG21  ILE  17          1HG2      ILE  17   7.389  -6.061  -0.487
  108   HG22  ILE  17          2HG2      ILE  17   7.707  -6.602   1.160
  109   HG23  ILE  17          3HG2      ILE  17   6.150  -6.943   0.406
  110   HD11  ILE  17          3HD1      ILE  17   3.788  -5.463   2.570
  111   HD12  ILE  17          1HD1      ILE  17   3.301  -6.256   1.072
  112   HD13  ILE  17          2HD1      ILE  17   4.806  -6.719   1.868
  113    H    CYS  18           H        CYS  18   8.202  -2.808   1.698
  114    HA   CYS  18           HA       CYS  18  10.735  -4.083   2.483
  115    HB2  CYS  18           1HB      CYS  18  11.820  -2.714   0.804
  116    HB3  CYS  18           2HB      CYS  18  10.467  -3.567   0.068
  117    H    LEU  19           H        LEU  19   8.622  -1.498   3.151
  118    HA   LEU  19           HA       LEU  19   8.679   0.144   4.729
  119    HB2  LEU  19           1HB      LEU  19  11.407  -0.869   5.495
  120    HB3  LEU  19           2HB      LEU  19  10.295   0.084   6.478
  121    HG   LEU  19           HG       LEU  19   9.749  -2.746   5.593
  122   HD11  LEU  19          1HD1      LEU  19  11.564  -3.045   6.991
  123   HD12  LEU  19          2HD1      LEU  19  10.207  -3.145   8.112
  124   HD13  LEU  19          3HD1      LEU  19  11.150  -1.659   8.000
  125   HD21  LEU  19          3HD2      LEU  19   7.799  -2.604   6.699
  126   HD22  LEU  19          1HD2      LEU  19   7.998  -0.867   6.468
  127   HD23  LEU  19          2HD2      LEU  19   8.484  -1.616   7.990
  128    H    GLU  20           H        GLU  20   9.208   0.981   2.282
  129    HA   GLU  20           HA       GLU  20  11.359   2.946   2.670
  130    HB2  GLU  20           1HB      GLU  20  10.760   1.456   0.108
  131    HB3  GLU  20           2HB      GLU  20  11.903   2.783   0.262
  132    HG2  GLU  20           1HG      GLU  20  13.050   1.326   2.033
  133    HG3  GLU  20           2HG      GLU  20  12.091   0.007   1.362
  134    H    LYS  21           H        LYS  21  11.095   4.915   1.417
  135    HA   LYS  21           HA       LYS  21   8.749   6.214   1.708
  136    HB2  LYS  21           1HB      LYS  21  10.682   7.439   1.036
  137    HB3  LYS  21           2HB      LYS  21  10.809   6.542  -0.471
  138    HG2  LYS  21           1HG      LYS  21   8.938   7.634  -1.398
  139    HG3  LYS  21           2HG      LYS  21   8.454   8.293   0.166
  140    HD2  LYS  21           1HD      LYS  21  10.680   9.532   0.152
  141    HD3  LYS  21           2HD      LYS  21  10.796   9.080  -1.550
  142    HE2  LYS  21           1HE      LYS  21   8.367  10.090  -1.637
  143    HE3  LYS  21           2HE      LYS  21   8.910  10.950  -0.197
  144    HZ1  LYS  21           3HZ      LYS  21   9.728  12.411  -1.653
  145    HZ2  LYS  21           1HZ      LYS  21   9.653  11.331  -2.954
  146    HZ3  LYS  21           2HZ      LYS  21  10.973  11.292  -1.898
  147    HA   PRO  22           HA       PRO  22   6.212   3.751  -1.120
  148    HB2  PRO  22           1HB      PRO  22   3.855   4.559  -0.042
  149    HB3  PRO  22           2HB      PRO  22   4.845   3.277   0.665
  150    HG2  PRO  22           1HG      PRO  22   4.642   6.160   1.444
  151    HG3  PRO  22           2HG      PRO  22   4.698   4.723   2.481
  152    HD2  PRO  22           1HD      PRO  22   6.865   6.284   2.036
  153    HD3  PRO  22           2HD      PRO  22   6.988   4.534   2.309
  154    H    LYS  23           H        LYS  23   6.241   4.660  -3.098
  155    HA   LYS  23           HA       LYS  23   5.686   7.406  -3.595
  156    HB2  LYS  23           1HB      LYS  23   6.107   4.991  -5.323
  157    HB3  LYS  23           2HB      LYS  23   5.536   6.494  -6.037
  158    HG2  LYS  23           1HG      LYS  23   7.509   7.611  -5.589
  159    HG3  LYS  23           2HG      LYS  23   7.974   6.486  -4.310
  160    HD2  LYS  23           1HD      LYS  23   7.759   5.625  -7.180
  161    HD3  LYS  23           2HD      LYS  23   9.236   6.340  -6.530
  162    HE2  LYS  23           1HE      LYS  23   7.875   3.945  -5.312
  163    HE3  LYS  23           2HE      LYS  23   9.148   3.822  -6.526
  164    HZ1  LYS  23           3HZ      LYS  23  10.243   3.638  -4.494
  165    HZ2  LYS  23           1HZ      LYS  23   9.336   4.868  -3.769
  166    HZ3  LYS  23           2HZ      LYS  23  10.499   5.250  -4.936
  167    H    TYR  24           H        TYR  24   3.814   4.428  -3.888
  168    HA   TYR  24           HA       TYR  24   1.389   6.065  -4.143
  169    HB2  TYR  24           1HB      TYR  24   1.541   3.466  -5.614
  170    HB3  TYR  24           2HB      TYR  24   0.550   4.882  -5.946
  171    HD1  TYR  24           HD1      TYR  24   3.899   3.404  -6.317
  172    HD2  TYR  24           HD2      TYR  24   1.373   6.681  -7.310
  173    HE1  TYR  24           HE1      TYR  24   5.516   4.125  -8.025
  174    HE2  TYR  24           HE2      TYR  24   2.982   7.410  -9.021
  175    HH   TYR  24           HH       TYR  24   4.997   5.854 -10.435
  176    H    ARG  25           H        ARG  25  -0.607   4.532  -3.867
  177    HA   ARG  25           HA       ARG  25  -0.058   2.519  -1.804
  178    HB2  ARG  25           1HB      ARG  25  -1.760   4.964  -1.564
  179    HB3  ARG  25           2HB      ARG  25  -2.255   3.500  -0.725
  180    HG2  ARG  25           1HG      ARG  25  -0.156   3.444   0.480
  181    HG3  ARG  25           2HG      ARG  25   0.413   4.859  -0.408
  182    HD2  ARG  25           1HD      ARG  25  -1.456   6.163   0.537
  183    HD3  ARG  25           2HD      ARG  25  -1.945   4.749   1.469
  184    HE   ARG  25           HE       ARG  25   0.584   5.053   2.262
  185   HH11  ARG  25          2HH1      ARG  25  -1.997   7.362   1.909
  186   HH12  ARG  25          1HH1      ARG  25  -1.423   8.393   3.178
  187   HH21  ARG  25          2HH2      ARG  25   1.350   6.401   3.934
  188   HH22  ARG  25          1HH2      ARG  25   0.481   7.846   4.329
  189    H    CYS  26           H        CYS  26  -1.882   1.060  -1.414
  190    HA   CYS  26           HA       CYS  26  -2.997   0.125  -3.842
  191    HB2  CYS  26           1HB      CYS  26  -2.458  -1.364  -1.956
  192    HB3  CYS  26           2HB      CYS  26  -3.723  -0.605  -0.996
  193    HA   PRO  27           HA       PRO  27  -6.535   2.809  -3.986
  194    HB2  PRO  27           1HB      PRO  27  -7.708   1.634  -6.134
  195    HB3  PRO  27           2HB      PRO  27  -6.314   2.713  -6.271
  196    HG2  PRO  27           1HG      PRO  27  -6.403  -0.280  -6.285
  197    HG3  PRO  27           2HG      PRO  27  -5.464   0.817  -7.315
  198    HD2  PRO  27           1HD      PRO  27  -4.384  -0.466  -5.189
  199    HD3  PRO  27           2HD      PRO  27  -3.845   1.144  -5.707
  200    H    ALA  28           H        ALA  28  -6.391  -0.135  -2.700
  201    HA   ALA  28           HA       ALA  28  -9.314  -0.487  -2.570
  202    HB1  ALA  28           3HB      ALA  28  -8.105  -2.783  -1.529
  203    HB2  ALA  28           1HB      ALA  28  -8.915  -2.609  -3.086
  204    HB3  ALA  28           2HB      ALA  28  -7.172  -2.365  -2.966
  205    H    CYS  29           H        CYS  29  -6.533  -1.364  -0.512
  206    HA   CYS  29           HA       CYS  29  -8.102  -0.605   1.837
  207    HB2  CYS  29           1HB      CYS  29  -6.042  -1.677   3.014
  208    HB3  CYS  29           2HB      CYS  29  -7.204  -2.721   2.202
  209    H    ARG  30           H        ARG  30  -5.667   0.614  -0.167
  210    HA   ARG  30           HA       ARG  30  -4.501   2.574  -0.107
  211    HB2  ARG  30           1HB      ARG  30  -5.766   3.041   2.598
  212    HB3  ARG  30           2HB      ARG  30  -4.997   4.243   1.570
  213    HG2  ARG  30           1HG      ARG  30  -7.436   2.699   0.735
  214    HG3  ARG  30           2HG      ARG  30  -7.511   4.244   1.585
  215    HD2  ARG  30           1HD      ARG  30  -5.924   5.058  -0.307
  216    HD3  ARG  30           2HD      ARG  30  -6.520   3.642  -1.171
  217    HE   ARG  30           HE       ARG  30  -8.804   4.793  -0.421
  218   HH11  ARG  30          2HH1      ARG  30  -5.936   6.139  -1.864
  219   HH12  ARG  30          1HH1      ARG  30  -6.787   7.400  -2.693
  220   HH21  ARG  30          2HH2      ARG  30  -9.936   6.449  -1.507
  221   HH22  ARG  30          1HH2      ARG  30  -9.062   7.577  -2.488
  222    H    VAL  31           H        VAL  31  -3.049   0.453   0.397
  223    HA   VAL  31           HA       VAL  31  -1.576   0.894   2.894
  224    HB   VAL  31           HB       VAL  31  -0.380  -1.251   2.181
  225   HG11  VAL  31          1HG1      VAL  31  -1.858  -2.490   3.403
  226   HG12  VAL  31          2HG1      VAL  31  -2.437  -0.871   3.796
  227   HG13  VAL  31          3HG1      VAL  31  -3.268  -1.833   2.573
  228   HG21  VAL  31          3HG2      VAL  31  -1.752  -0.834  -0.174
  229   HG22  VAL  31          1HG2      VAL  31  -0.946  -2.327   0.308
  230   HG23  VAL  31          2HG2      VAL  31  -2.671  -2.119   0.611
  231    HA   PRO  32           HA       PRO  32   1.800   2.855   0.874
  232    HB2  PRO  32           1HB      PRO  32   3.824   2.140   2.536
  233    HB3  PRO  32           2HB      PRO  32   2.598   3.334   2.975
  234    HG2  PRO  32           1HG      PRO  32   2.770   0.438   3.712
  235    HG3  PRO  32           2HG      PRO  32   2.341   1.828   4.727
  236    HD2  PRO  32           1HD      PRO  32   0.482   0.166   3.672
  237    HD3  PRO  32           2HD      PRO  32   0.176   1.894   3.941
  238    H    TYR  33           H        TYR  33   2.725   2.222  -0.962
  239    HA   TYR  33           HA       TYR  33   4.436  -0.129  -0.993
  240    HB2  TYR  33           1HB      TYR  33   3.271  -1.385  -2.504
  241    HB3  TYR  33           2HB      TYR  33   1.908  -0.579  -1.736
  242    HD1  TYR  33           HD2      TYR  33   4.280  -0.135  -4.586
  243    HD2  TYR  33           HD1      TYR  33   0.355   0.501  -3.071
  244    HE1  TYR  33           HE2      TYR  33   3.588   0.762  -6.769
  245    HE2  TYR  33           HE1      TYR  33  -0.347   1.399  -5.250
  246    HH   TYR  33           HH       TYR  33   1.333   2.585  -7.379
  247    H    CYS  34           H        CYS  34   6.249   0.355  -2.027
  248    HA   CYS  34           HA       CYS  34   6.653   2.825  -3.322
  249    HB2  CYS  34           1HB      CYS  34   8.819   1.618  -4.117
  250    HB3  CYS  34           2HB      CYS  34   8.592   1.929  -2.399
  251    H    SER  35           H        SER  35   7.130  -0.370  -4.821
  252    HA   SER  35           HA       SER  35   5.987   0.736  -7.303
  253    HB2  SER  35           1HB      SER  35   8.368  -1.011  -6.819
  254    HB3  SER  35           2HB      SER  35   7.472  -1.193  -8.327
  255    HG   SER  35           HG       SER  35   9.174   0.338  -8.496
  256    H    VAL  36           H        VAL  36   5.341  -1.170  -8.833
  257    HA   VAL  36           HA       VAL  36   3.116  -2.435  -7.760
  258    HB   VAL  36           HB       VAL  36   3.743  -2.065 -10.232
  259   HG11  VAL  36          1HG1      VAL  36   4.802  -4.866 -10.020
  260   HG12  VAL  36          2HG1      VAL  36   4.894  -3.750 -11.384
  261   HG13  VAL  36          3HG1      VAL  36   5.864  -3.461  -9.939
  262   HG21  VAL  36          3HG2      VAL  36   1.736  -3.031 -10.323
  263   HG22  VAL  36          1HG2      VAL  36   2.580  -4.563 -10.549
  264   HG23  VAL  36          2HG2      VAL  36   2.090  -4.056  -8.933
  265    H    VAL  37           H        VAL  37   6.419  -3.615  -8.132
  266    HA   VAL  37           HA       VAL  37   6.201  -6.285  -7.675
  267    HB   VAL  37           HB       VAL  37   8.237  -4.452  -6.402
  268   HG11  VAL  37          1HG1      VAL  37   8.876  -7.261  -7.087
  269   HG12  VAL  37          2HG1      VAL  37   9.464  -6.252  -5.764
  270   HG13  VAL  37          3HG1      VAL  37   7.865  -6.990  -5.668
  271   HG21  VAL  37          3HG2      VAL  37   9.610  -5.367  -8.388
  272   HG22  VAL  37          1HG2      VAL  37   8.040  -5.766  -9.087
  273   HG23  VAL  37          2HG2      VAL  37   8.431  -4.092  -8.693
  274    H    CYS  38           H        CYS  38   6.607  -3.898  -5.050
  275    HA   CYS  38           HA       CYS  38   6.113  -5.696  -2.955
  276    HB2  CYS  38           1HB      CYS  38   6.090  -2.718  -3.224
  277    HB3  CYS  38           2HB      CYS  38   5.436  -3.441  -1.758
  278    H    PHE  39           H        PHE  39   3.963  -3.881  -5.011
  279    HA   PHE  39           HA       PHE  39   1.634  -4.122  -3.405
  280    HB2  PHE  39           1HB      PHE  39   1.675  -2.426  -5.095
  281    HB3  PHE  39           2HB      PHE  39   2.019  -3.607  -6.355
  282    HD1  PHE  39           HD1      PHE  39  -0.537  -3.413  -3.642
  283    HD2  PHE  39           HD2      PHE  39   0.256  -3.770  -7.809
  284    HE1  PHE  39           HE1      PHE  39  -2.948  -3.641  -4.078
  285    HE2  PHE  39           HE2      PHE  39  -2.153  -3.998  -8.251
  286    HZ   PHE  39           HZ       PHE  39  -3.759  -3.933  -6.385
  287    H    ARG  40           H        ARG  40   2.986  -6.048  -6.044
  288    HA   ARG  40           HA       ARG  40   0.893  -7.807  -6.476
  289    HB2  ARG  40           1HB      ARG  40   3.861  -8.382  -6.554
  290    HB3  ARG  40           2HB      ARG  40   2.615  -9.406  -7.257
  291    HG2  ARG  40           1HG      ARG  40   1.952  -7.441  -8.678
  292    HG3  ARG  40           2HG      ARG  40   3.410  -6.633  -8.097
  293    HD2  ARG  40           1HD      ARG  40   3.316  -9.271  -9.557
  294    HD3  ARG  40           2HD      ARG  40   3.772  -7.721 -10.263
  295    HE   ARG  40           HE       ARG  40   5.361  -8.389  -7.985
  296   HH11  ARG  40          2HH1      ARG  40   4.951  -8.954 -11.396
  297   HH12  ARG  40          1HH1      ARG  40   6.614  -9.359 -11.661
  298   HH21  ARG  40          2HH2      ARG  40   7.553  -8.921  -8.322
  299   HH22  ARG  40          1HH2      ARG  40   8.094  -9.341  -9.912
  300    H    LYS  41           H        LYS  41   3.527  -8.042  -4.107
  301    HA   LYS  41           HA       LYS  41   2.873 -10.531  -3.031
  302    HB2  LYS  41           1HB      LYS  41   4.335  -8.131  -2.017
  303    HB3  LYS  41           2HB      LYS  41   3.932  -9.413  -0.883
  304    HG2  LYS  41           1HG      LYS  41   6.080  -9.941  -1.599
  305    HG3  LYS  41           2HG      LYS  41   5.040 -10.994  -2.562
  306    HD2  LYS  41           1HD      LYS  41   5.126  -9.037  -4.284
  307    HD3  LYS  41           2HD      LYS  41   6.573  -8.563  -3.392
  308    HE2  LYS  41           1HE      LYS  41   7.505 -10.814  -3.764
  309    HE3  LYS  41           2HE      LYS  41   6.075 -11.234  -4.705
  310    HZ1  LYS  41           3HZ      LYS  41   7.194  -8.830  -5.676
  311    HZ2  LYS  41           1HZ      LYS  41   6.969 -10.300  -6.485
  312    HZ3  LYS  41           2HZ      LYS  41   8.393 -10.022  -5.615
  313    H    HIS  42           H        HIS  42   1.612  -7.322  -2.323
  314    HA   HIS  42           HA       HIS  42   0.048  -8.187  -0.077
  315    HB2  HIS  42           1HB      HIS  42   0.457  -5.952   0.161
  316    HB3  HIS  42           2HB      HIS  42   0.443  -5.654  -1.574
  317    HD1  HIS  42           HD1      HIS  42  -1.944  -6.164   1.314
  318    HD2  HIS  42           HD2      HIS  42  -1.911  -4.659  -2.559
  319    HE1  HIS  42           HE1      HIS  42  -4.187  -5.070   0.998
  320    H    LYS  43           H        LYS  43  -0.904  -6.895  -3.266
  321    HA   LYS  43           HA       LYS  43  -3.542  -7.261  -3.332
  322    HB2  LYS  43           1HB      LYS  43  -2.254  -6.544  -5.285
  323    HB3  LYS  43           2HB      LYS  43  -1.654  -8.182  -5.508
  324    HG2  LYS  43           1HG      LYS  43  -3.358  -7.984  -7.075
  325    HG3  LYS  43           2HG      LYS  43  -4.115  -8.850  -5.736
  326    HD2  LYS  43           1HD      LYS  43  -5.356  -7.005  -5.078
  327    HD3  LYS  43           2HD      LYS  43  -4.270  -5.865  -5.876
  328    HE2  LYS  43           1HE      LYS  43  -6.350  -6.006  -7.099
  329    HE3  LYS  43           2HE      LYS  43  -5.046  -6.698  -8.061
  330    HZ1  LYS  43           3HZ      LYS  43  -6.289  -8.506  -8.251
  331    HZ2  LYS  43           1HZ      LYS  43  -7.436  -7.920  -7.154
  332    HZ3  LYS  43           2HZ      LYS  43  -6.094  -8.784  -6.594
  333    H    GLU  44           H        GLU  44  -1.186  -9.860  -3.348
  334    HA   GLU  44           HA       GLU  44  -2.571 -12.054  -4.110
  335    HB2  GLU  44           1HB      GLU  44  -0.699 -11.705  -1.777
  336    HB3  GLU  44           2HB      GLU  44  -1.347 -13.278  -2.221
  337    HG2  GLU  44           1HG      GLU  44  -0.419 -12.754  -4.565
  338    HG3  GLU  44           2HG      GLU  44   0.534 -11.521  -3.741
  339    H    GLN  45           H        GLN  45  -2.767 -10.555  -0.892
  340    HA   GLN  45           HA       GLN  45  -5.373 -11.873  -0.539
  341    HB2  GLN  45           1HB      GLN  45  -3.163 -11.596   1.499
  342    HB3  GLN  45           2HB      GLN  45  -4.816 -12.026   1.916
  343    HG2  GLN  45           1HG      GLN  45  -4.458 -13.906   0.137
  344    HG3  GLN  45           2HG      GLN  45  -2.753 -13.607   0.467
  345   HE21  GLN  45          1HE2      GLN  45  -5.803 -14.072   2.220
  346   HE22  GLN  45          2HE2      GLN  45  -5.138 -15.082   3.454
  347    H    CYS  46           H        CYS  46  -4.577  -9.164  -1.428
  348    HA   CYS  46           HA       CYS  46  -4.764  -7.158   0.403
  349    HB2  CYS  46           1HB      CYS  46  -4.504  -6.452  -1.804
  350    HB3  CYS  46           2HB      CYS  46  -5.856  -7.422  -2.378
  351    H    ASN  47           H        ASN  47  -6.110  -6.826   2.034
  352    HA   ASN  47           HA       ASN  47  -8.945  -7.557   1.689
  353    HB2  ASN  47           1HB      ASN  47  -9.061  -8.055   4.052
  354    HB3  ASN  47           2HB      ASN  47  -7.723  -8.960   3.351
  355   HD21  ASN  47          1HD2      ASN  47  -8.595  -7.307   5.974
  356   HD22  ASN  47          2HD2      ASN  47  -7.062  -6.704   6.495
  357    HA   PRO  48           HA       PRO  48  -9.156  -3.056   2.143
  358    HB2  PRO  48           1HB      PRO  48 -11.657  -2.860   1.104
  359    HB3  PRO  48           2HB      PRO  48 -10.208  -2.990   0.101
  360    HG2  PRO  48           1HG      PRO  48 -12.161  -5.117   0.891
  361    HG3  PRO  48           2HG      PRO  48 -11.412  -4.817  -0.688
  362    HD2  PRO  48           1HD      PRO  48 -10.532  -6.743   1.000
  363    HD3  PRO  48           2HD      PRO  48  -9.446  -5.864  -0.094
  364    H    GLU  49           H        GLU  49 -10.223  -5.424   3.989
  365    HA   GLU  49           HA       GLU  49 -12.528  -5.073   5.223
  366    HB2  GLU  49           1HB      GLU  49 -10.335  -6.306   6.007
  367    HB3  GLU  49           2HB      GLU  49 -10.155  -4.888   7.031
  368    HG2  GLU  49           1HG      GLU  49 -12.696  -6.472   6.989
  369    HG3  GLU  49           2HG      GLU  49 -11.329  -6.940   7.999
  370    H    THR  50           H        THR  50  -9.769  -2.955   6.016
  371    HA   THR  50           HA       THR  50 -11.027  -1.194   7.709
  372    HB   THR  50           HB       THR  50  -8.618  -1.114   7.279
  373    HG1  THR  50           HG1      THR  50  -9.424   0.760   8.164
  374   HG21  THR  50          3HG2      THR  50  -7.786  -0.996   5.217
  375   HG22  THR  50          1HG2      THR  50  -8.571   0.562   4.964
  376   HG23  THR  50          2HG2      THR  50  -9.427  -0.931   4.575
  377    H    SER  51           H        SER  51 -12.375   0.517   7.527
  378    HA   SER  51           HA       SER  51 -14.136   0.746   5.409
  379    HB2  SER  51           1HB      SER  51 -13.343   2.710   7.557
  380    HB3  SER  51           2HB      SER  51 -14.602   3.075   6.376
  381    HG   SER  51           HG       SER  51 -14.619   0.746   7.989
  382    H    GLY  52           H        GLY  52 -14.466   2.554   3.909
  383    HA2  GLY  52           1HA      GLY  52 -12.662   4.505   3.216
  384    HA3  GLY  52           2HA      GLY  52 -12.086   3.058   2.401
  385    HA   PRO  53           HA       PRO  53 -14.894   3.648  -0.905
  386    HB2  PRO  53           1HB      PRO  53 -15.808   1.144  -1.418
  387    HB3  PRO  53           2HB      PRO  53 -14.160   1.661  -1.793
  388    HG2  PRO  53           1HG      PRO  53 -15.166   0.091   0.549
  389    HG3  PRO  53           2HG      PRO  53 -13.711  -0.169  -0.430
  390    HD2  PRO  53           1HD      PRO  53 -13.640   1.036   1.994
  391    HD3  PRO  53           2HD      PRO  53 -12.518   1.458   0.685
  392    H    SER  54           H        SER  54 -16.142   1.904   1.876
  393    HA   SER  54           HA       SER  54 -18.766   1.562   1.449
  394    HB2  SER  54           1HB      SER  54 -19.183   2.095   3.810
  395    HB3  SER  54           2HB      SER  54 -17.686   1.179   3.630
  396    HG   SER  54           HG       SER  54 -18.083   3.800   4.436
  397    H    SER  55           H        SER  55 -17.307   4.699   2.272
  398    HA   SER  55           HA       SER  55 -19.832   6.030   1.627
  399    HB2  SER  55           1HB      SER  55 -17.290   7.077   2.892
  400    HB3  SER  55           2HB      SER  55 -18.720   8.056   2.569
  401    HG   SER  55           HG       SER  55 -18.934   7.377   4.642
  402    H    GLY  56           H        GLY  56 -16.369   6.602   0.955
  403    HA2  GLY  56           1HA      GLY  56 -16.579   8.425  -1.072
  404    HA3  GLY  56           2HA      GLY  56 -15.313   7.208  -1.001