*HEADER    APOPTOSIS                               14-FEB-07   2ECY              
*TITLE     SOLUTION STRUCTURE OF THE ZINC FINGER, C3HC4 TYPE (RING               
*TITLE    2 FINGER)" DOMAIN OF TNF RECEPTOR-ASSOCIATED FACTOR 3                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TNF RECEPTOR-ASSOCIATED FACTOR 3;                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RING-TYPE, RESIDUES 8-66;                                  
*COMPND   5 SYNONYM: CD40 RECEPTOR-ASSOCIATED FACTOR 1, CRAF1, CD40-             
*COMPND   6 BINDING PROTEIN, CD40BP, LMP1-ASSOCIATED PROTEIN, LAP1,              
*COMPND   7 CAP-1;                                                               
*COMPND   8 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: TRAF3;                                                         
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P060515-13;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    METAL BINDING PROTEIN, STRUCTURAL GENOMICS, NPPSFA,                   
*KEYWDS   2 NATIONAL PROJECT ON PROTEIN STRUCTURAL AND FUNCTIONAL                
*KEYWDS   3 ANALYSES, RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE,           
*KEYWDS   4 RSGI, APOPTOSIS                                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    H.ABE, K.MIYAMOTO, N.TOCHIO, M.YONEYAMA, T.KIGAWA,                    
*AUTHOR   2 S.YOKOYAMA, RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE          
*AUTHOR   3 (RSGI)                                                               
*REVDAT   1   12-MAY-09 2ECY    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.
**************************************************************

18 CYSS SG   201 ZN   ZN   2.19  5.00E+00
18 CYSS CB   201 ZN   ZN   3.25  5.00E+00
21 CYSS SG   201 ZN   ZN   2.19  5.00E+00
21 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
41 CYSS SG   201 ZN   ZN   2.19  5.00E+00
41 CYSS CB   201 ZN   ZN   3.25  5.00E+00
18 CYSS SG  21 CYSS SG   3.56  5.00E+00
18 CYSS SG  38 CYSS SG   3.56  5.00E+00
18 CYSS SG  41 CYSS SG   3.56  5.00E+00
21 CYSS SG  38 CYSS SG   3.56  5.00E+00
21 CYSS SG  41 CYSS SG   3.56  5.00E+00
38 CYSS SG  41 CYSS SG   3.56  5.00E+00

33 CYSS SG   401 ZN   ZN   2.19  5.00E+00
33 CYSS CB   401 ZN   ZN   3.25  5.00E+00
35 HIST ND1   401  ZN   ZN   1.90  5.00E+00
53 CYSS SG   401 ZN   ZN   2.19  5.00E+00
53 CYSS CB   401 ZN   ZN   3.25  5.00E+00
56 CYSS SG   401 ZN   ZN   2.19  5.00E+00
56 CYSS CB   401 ZN   ZN   3.25  5.00E+00
33 CYSS SG  35 HIST ND1   3.32  5.00E+00
33 CYSS SG  53 CYSS SG   3.56  5.00E+00
33 CYSS SG  56 CYSS SG   3.56  5.00E+00
35 HIST ND1  53 CYSS SG   3.32  5.00E+00
35 HIST ND1  56 CYSS SG   3.32  5.00E+00
53 CYSS SG  56 CYSS SG   3.56  5.00E+00
18 CYSS SG   201 ZN   ZN   2.35  5.00E+00
18 CYSS CB   201 ZN   ZN   3.51  5.00E+00
21 CYSS SG   201 ZN   ZN   2.35  5.00E+00
21 CYSS CB   201 ZN   ZN   3.51  5.00E+00
38 CYSS SG   201 ZN   ZN   2.35  5.00E+00
38 CYSS CB   201 ZN   ZN   3.51  5.00E+00
41 CYSS SG   201 ZN   ZN   2.35  5.00E+00
41 CYSS CB   201 ZN   ZN   3.51  5.00E+00
18 CYSS SG  21 CYSS SG   3.96  5.00E+00
18 CYSS SG  38 CYSS SG   3.96  5.00E+00
18 CYSS SG  41 CYSS SG   3.96  5.00E+00
21 CYSS SG  38 CYSS SG   3.96  5.00E+00
21 CYSS SG  41 CYSS SG   3.96  5.00E+00
38 CYSS SG  41 CYSS SG   3.96  5.00E+00

33 CYSS SG   401 ZN   ZN   2.35  5.00E+00
33 CYSS CB   401 ZN   ZN   3.51  5.00E+00
35 HIST ND1   401  ZN   ZN   2.10  5.00E+00
53 CYSS SG   401 ZN   ZN   2.35  5.00E+00
53 CYSS CB   401 ZN   ZN   3.51  5.00E+00
56 CYSS SG   401 ZN   ZN   2.35  5.00E+00
56 CYSS CB   401 ZN   ZN   3.51  5.00E+00
33 CYSS SG  35 HIST ND1   3.72  5.00E+00
33 CYSS SG  53 CYSS SG   3.96  5.00E+00
33 CYSS SG  56 CYSS SG   3.96  5.00E+00
35 HIST ND1  53 CYSS SG   3.72  5.00E+00
35 HIST ND1  56 CYSS SG   3.72  5.00E+00
53 CYSS SG  56 CYSS SG   3.96  5.00E+00
 13 GLU  HN     14 ASP  HN      4.49            #peak     1 #SUP  0.93  #QF  0.93
 12 VAL  HN     13 GLU  HN      4.44            #peak     2 #SUP  1.00
 12 VAL  HA     13 GLU  HN      2.92            #peak     3 #SUP  0.96  #QF  0.96
 13 GLU  HN     13 GLU  QG      3.96            #peak     4 #SUP  0.99  #QF  0.99
 13 GLU  HN     13 GLU  HB2     3.76            #peak     5 #SUP  0.98  #QF  0.98
 13 GLU  HN     13 GLU  HB3     3.76            #peak     6 #SUP  0.98  #QF  0.98
 61 VAL  HN     61 VAL  HB      3.11            #peak     9 #SUP  0.99  #QF  0.99
 61 VAL  HN     62 LYS  HN      4.33            #peak    13 #SUP  0.78  #QF  0.78
 52 LYS  HN     59 SER  HA      4.58            #peak    14 #SUP  0.94  #QF  0.94
 52 LYS  HN     53 CYSS HN      4.65            #peak    16 #SUP  0.99  #QF  0.99
 52 LYS  HN     52 LYS  HB2     3.72            #peak    20 #SUP  0.93  #QF  0.64
 52 LYS  HN     60 ILE  HG13    4.07            #peak    20 #SUP  0.93  #QF  0.64
 52 LYS  HN     52 LYS  HG2     4.34            #peak    21 #SUP  1.00
 30 GLN  HE22   34 GLY  HA1     4.83            #peak    29 #SUP  0.80  #QF  0.80
 30 GLN  HE21   34 GLY  HA1     4.83            #peak    32 #SUP  0.92  #QF  0.92
 52 LYS  HG2    53 CYSS HN      4.85            #peak    33 #SUP  0.98  #QF  0.98
 53 CYSS HN     58 GLU  HN      3.78            #peak    34 #SUP  0.95  #QF  0.95
 52 LYS  HB2    53 CYSS HN      3.46            #peak    35 #SUP  0.85  #QF  0.85
 53 CYSS HN     60 ILE  HG12    4.41            #peak    36 #SUP  0.99  #QF  0.99
 53 CYSS HN     53 CYSS HB3     3.34            #peak    41 #SUP  0.98  #QF  0.98
 53 CYSS HN     53 CYSS HB2     3.92            #peak    42 #SUP  0.98  #QF  0.98
 52 LYS  HB3    53 CYSS HN      4.01            #peak    43 #SUP  0.98  #QF  0.98
 51 PRO  HB2    60 ILE  HN      4.06            #peak    46 #SUP  1.00
 59 SER  HA     60 ILE  HN      2.78            #peak    50 #SUP  0.97  #QF  0.97
 60 ILE  HN     60 ILE  HB      3.25            #peak    53 #SUP  0.98  #QF  0.98
 60 ILE  HN     60 ILE  HG13    3.31            #peak    54 #SUP  0.99  #QF  0.99
 60 ILE  HN     60 ILE  HG12    3.51            #peak    55 #SUP  1.00
  8 PHE  HA      9 VAL  HN      2.96            #peak    58 #SUP  0.75  #QF  0.75
  9 VAL  HN      9 VAL  HB      3.57            #peak    60 #SUP  0.94  #QF  0.94
  9 VAL  HN     10 LYS  HN      4.82            #peak    62 #SUP  0.94  #QF  0.94
 31 THR  QG2    32 GLU  HN      4.45            #peak    66 #SUP  0.99  #QF  0.99
 30 GLN  HN     66 PHE  HN      4.26            #peak    76 #SUP  0.92  #QF  0.92
 29 LYS  HA     30 GLN  HN      3.02            #peak    78 #SUP  0.92  #QF  0.92
 30 GLN  HN     30 GLN  HG2     4.52            #peak    79 #SUP  0.98  #QF  0.98
 30 GLN  HN     30 GLN  HG3     4.49            #peak    80 #SUP  0.96  #QF  0.94
 30 GLN  HN     30 GLN  HB3     3.54            #peak    81 #SUP  0.93  #QF  0.93
 30 GLN  HN     30 GLN  HB2     3.64            #peak    82 #SUP  0.92  #QF  0.92
 29 LYS  HG2    30 GLN  HN      5.21            #peak    83 #SUP  0.99  #QF  0.99
 30 GLN  HN     36 ARG  HG3     5.09            #peak    85 #SUP  0.60  #QF  0.60
 30 GLN  HN     31 THR  QG2     5.39            #peak    86 #SUP  0.86  #QF  0.86
 24 VAL  HN     24 VAL  HB      3.08            #peak    89 #SUP  0.43  #QF  0.43
 11 THR  HA     12 VAL  HN      2.83            #peak    91 #SUP  0.89  #QF  0.89
 12 VAL  HN     12 VAL  HB      3.37            #peak    93 #SUP  0.94  #QF  0.94
 11 THR  QG2    12 VAL  HN      4.03            #peak    94 #SUP  0.99  #QF  0.99
 33 CYSS HB3    34 GLY  HN      4.33            #peak    97 #SUP  0.98  #QF  0.98
 31 THR  HG1    34 GLY  HN      4.42            #peak    98 #SUP  0.97  #QF  0.97
 32 GLU  HA     34 GLY  HN      4.29            #peak   100 #SUP  0.89  #QF  0.89
 34 GLY  HN     34 GLY  HA1     2.95            #peak   102 #SUP  0.99  #QF  0.99
 33 CYSS HB2    34 GLY  HN      4.25            #peak   103 #SUP  0.82  #QF  0.82
 30 GLN  HG2    34 GLY  HN      4.81            #peak   104 #SUP  1.00
 13 GLU  HA     14 ASP  HN      3.04            #peak   109 #SUP  0.95  #QF  0.95
 14 ASP  HN     14 ASP  QB      3.36            #peak   110 #SUP  0.95  #QF  0.95
 13 GLU  HB2    14 ASP  HN      4.53            #peak   111 #SUP  0.97  #QF  0.97
 19 GLU  HN     38 CYSS HN      4.62            #peak   113 #SUP  0.99  #QF  0.99
 37 PHE  QD     38 CYSS HN      4.59            #peak   114 #SUP  0.95  #QF  0.95
 18 CYSS HA     38 CYSS HN      4.21            #peak   116 #SUP  0.92  #QF  0.92
 38 CYSS HN     38 CYSS HB3     3.69            #peak   119 #SUP  0.99  #QF  0.99
 18 CYSS HB2    38 CYSS HN      3.54            #peak   120 #SUP  0.95  #QF  0.95
 37 PHE  HB2    38 CYSS HN      4.09            #peak   121 #SUP  0.99  #QF  0.99
 25 LEU  QD2    38 CYSS HN      4.20            #peak   122 #SUP  0.98  #QF  0.98
 13 GLU  QG     14 ASP  HN      4.92            #peak   123 #SUP  1.00
 13 GLU  HB3    14 ASP  HN      4.53            #peak   124 #SUP  0.99  #QF  0.99
 31 THR  HG1    35 HIST HN      4.15            #peak   129 #SUP  0.77  #QF  0.77
 31 THR  QG2    35 HIST HN      5.00            #peak   132 #SUP  0.99  #QF  0.99
 31 THR  HN     35 HIST HN      5.24            #peak   133 #SUP  0.95  #QF  0.95
 65 VAL  HN     65 VAL  HB      3.56            #peak   137 #SUP  0.99  #QF  0.99
 63 ASP  HA     65 VAL  HN      4.73            #peak   139 #SUP  0.75  #QF  0.75
 65 VAL  HN     66 PHE  HN      4.88            #peak   140 #SUP  1.00
 45 LEU  HN     45 LEU  HB2     3.43            #peak   145 #SUP  0.98  #QF  0.98
 45 LEU  HN     45 LEU  HB3     3.92            #peak   148 #SUP  1.00
 19 GLU  HB3    20 LYS  HN      4.46            #peak   158 #SUP  0.95  #QF  0.95
 20 LYS  HN     37 PHE  QE      4.22            #peak   160 #SUP  0.94  #QF  0.94
 20 LYS  HN     37 PHE  QD      3.86            #peak   161 #SUP  0.97  #QF  0.97
 18 CYSS HA     20 LYS  HN      4.30            #peak   163 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HB3     3.58            #peak   166 #SUP  0.88  #QF  0.88
 20 LYS  HN     20 LYS  HB2     3.47            #peak   167 #SUP  0.99  #QF  0.99
 19 GLU  HB2    20 LYS  HN      4.29            #peak   168 #SUP  0.69  #QF  0.69
 20 LYS  HN     20 LYS  HG3     4.64            #peak   170 #SUP  0.97  #QF  0.97
 20 LYS  HN     20 LYS  HD2     4.94            #peak   171 #SUP  0.97  #QF  0.97
 53 CYSS HA     58 GLU  HN      4.99            #peak   174 #SUP  1.00
 58 GLU  HN     59 SER  QB      5.50            #peak   174 #SUP  1.00
 33 CYSS HB2    58 GLU  HN      5.45            #peak   175 #SUP  0.80  #QF  0.80
 53 CYSS HB3    58 GLU  HN      3.39            #peak   176 #SUP  0.98  #QF  0.98
 58 GLU  HN     58 GLU  HB3     3.61            #peak   179 #SUP  0.98  #QF  0.98
 58 GLU  HN     59 SER  HN      4.12            #peak   180 #SUP  0.99  #QF  0.99
 44 ALA  HN     45 LEU  HN      3.11            #peak   185 #SUP  0.98  #QF  0.98
 43 ALA  HN     44 ALA  HN      3.09            #peak   186 #SUP  0.99  #QF  0.99
 40 SER  HA     44 ALA  HN      4.56            #peak   187 #SUP  0.98  #QF  0.98
 44 ALA  HN     45 LEU  HG      4.48            #peak   189 #SUP  0.92  #QF  0.92
 44 ALA  HN     44 ALA  QB      2.48            #peak   190 #SUP  0.93  #QF  0.93
 44 ALA  HN     45 LEU  QD2     5.50            #peak   191 #SUP  0.99  #QF  0.99
 44 ALA  HN     45 LEU  HB2     4.97            #peak   192 #SUP  0.90  #QF  0.90
 35 HIST HB2    36 ARG  HN      3.92            #peak   195 #SUP  0.99  #QF  0.99
 35 HIST HB3    36 ARG  HN      3.53            #peak   196 #SUP  0.94  #QF  0.94
 19 GLU  HG2    36 ARG  HN      4.05            #peak   197 #SUP  0.93  #QF  0.93
 19 GLU  HG3    36 ARG  HN      4.10            #peak   198 #SUP  0.98  #QF  0.98
 36 ARG  HN     36 ARG  HB2     3.40            #peak   199 #SUP  0.98  #QF  0.98
 36 ARG  HN     36 ARG  HG3     3.75            #peak   200 #SUP  0.98  #QF  0.98
 36 ARG  HN     36 ARG  HB3     3.97            #peak   201 #SUP  0.98  #QF  0.98
 16 TYR  QD     17 LYS  HN      4.25            #peak   202 #SUP  0.96  #QF  0.96
 16 TYR  HB2    17 LYS  HN      4.06            #peak   203 #SUP  0.98  #QF  0.97
 17 LYS  HN     18 CYSS HN      4.71            #peak   207 #SUP  1.00
 16 TYR  HA     17 LYS  HN      2.93            #peak   208 #SUP  0.89  #QF  0.89
 16 TYR  HB3    17 LYS  HN      3.59            #peak   209 #SUP  0.99  #QF  0.99
 17 LYS  HN     17 LYS  HB3     3.29            #peak   210 #SUP  0.82  #QF  0.82
 17 LYS  HN     17 LYS  HG2     4.36            #peak   211 #SUP  0.94  #QF  0.94
 43 ALA  HN     45 LEU  HN      4.94            #peak   213 #SUP  0.98  #QF  0.98
 40 SER  HA     43 ALA  HN      3.81            #peak   214 #SUP  0.98  #QF  0.98
 42 MET  HG2    43 ALA  HN      4.19            #peak   216 #SUP  0.99  #QF  0.99
 42 MET  HB3    43 ALA  HN      3.42            #peak   217 #SUP  0.93  #QF  0.93
 42 MET  HB2    43 ALA  HN      4.05            #peak   218 #SUP  0.99  #QF  0.99
 16 TYR  HN     16 TYR  HB3     3.82            #peak   220 #SUP  0.98  #QF  0.98
 15 LYS  HG2    16 TYR  HN      4.93            #peak   221 #SUP  0.64  #QF  0.64
 15 LYS  HA     16 TYR  HN      2.96            #peak   225 #SUP  0.97  #QF  0.97
 16 TYR  HN     16 TYR  HB2     3.50            #peak   226 #SUP  0.95  #QF  0.95
 15 LYS  HB2    16 TYR  HN      3.90            #peak   227 #SUP  0.92  #QF  0.65
 16 TYR  HN     24 VAL  QG1     4.62            #peak   228 #SUP  0.93  #QF  0.93
 42 MET  HG3    43 ALA  HN      4.42            #peak   229 #SUP  0.98  #QF  0.98
 43 ALA  HN     46 LEU  QD1     4.80            #peak   231 #SUP  0.98  #QF  0.98
 15 LYS  HN     16 TYR  HN      4.51            #peak   232 #SUP  1.00
 14 ASP  HN     15 LYS  HN      4.34            #peak   233 #SUP  1.00
 14 ASP  HA     15 LYS  HN      2.85            #peak   234 #SUP  0.91  #QF  0.91
 14 ASP  QB     15 LYS  HN      3.67            #peak   236 #SUP  0.99  #QF  0.99
 15 LYS  HN     15 LYS  HB3     4.08            #peak   238 #SUP  1.00
 15 LYS  HN     15 LYS  HG2     4.39            #peak   239 #SUP  0.98  #QF  0.98
 63 ASP  HN     64 LYS  HN      3.55            #peak   240 #SUP  0.96  #QF  0.96
 64 LYS  HN     65 VAL  HN      3.39            #peak   241 #SUP  0.81  #QF  0.81
 63 ASP  HB3    64 LYS  HN      4.61            #peak   244 #SUP  0.67  #QF  0.67
 64 LYS  HN     64 LYS  HB3     3.85            #peak   246 #SUP  0.99  #QF  0.99
 64 LYS  HN     64 LYS  HB2     3.35            #peak   247 #SUP  0.98  #QF  0.98
 64 LYS  HN     64 LYS  HG2     4.16            #peak   248 #SUP  0.99  #QF  0.99
 64 LYS  HN     64 LYS  HG3     4.16            #peak   249 #SUP  0.98  #QF  0.98
 61 VAL  QG1    64 LYS  HN      3.61            #peak   250 #SUP  0.83  #QF  0.83
 39 GLU  HN     40 SER  QB      4.94            #peak   252 #SUP  0.95  #QF  0.95
 38 CYSS HB2    39 GLU  HN      3.18            #peak   254 #SUP  0.97  #QF  0.97
 29 LYS  QE     39 GLU  HN      4.43            #peak   255 #SUP  0.99  #QF  0.39
 39 GLU  HN     39 GLU  HG3     3.86            #peak   256 #SUP  0.91  #QF  0.91
 39 GLU  HN     39 GLU  HG2     3.92            #peak   257 #SUP  1.00
 39 GLU  HN     39 GLU  HB2     3.11            #peak   258 #SUP  0.77  #QF  0.77
 18 CYSS HB2    39 GLU  HN      5.50            #peak   260 #SUP  0.89  #QF  0.89
 38 CYSS HN     39 GLU  HN      4.74            #peak   261 #SUP  0.99  #QF  0.99
 38 CYSS HB3    42 MET  HN      5.50            #peak   262 #SUP  0.83  #QF  0.83
 38 CYSS HN     42 MET  HN      4.55            #peak   263 #SUP  0.99  #QF  0.99
 41 CYSS HN     42 MET  HN      3.31            #peak   265 #SUP  0.96  #QF  0.96
 40 SER  HN     42 MET  HN      4.33            #peak   266 #SUP  0.74  #QF  0.74
 42 MET  HN     43 ALA  HN      3.25            #peak   267 #SUP  1.00
 42 MET  HN     44 ALA  HN      4.34            #peak   268 #SUP  1.00
 39 GLU  HA     42 MET  HN      4.24            #peak   270 #SUP  0.97  #QF  0.97
 37 PHE  HB3    42 MET  HN      3.74            #peak   271 #SUP  1.00
 41 CYSS HB3    42 MET  HN      3.78            #peak   272 #SUP  0.98  #QF  0.98
 42 MET  HN     42 MET  HG3     4.55            #peak   274 #SUP  0.99  #QF  0.99
 42 MET  HN     42 MET  HB3     3.14            #peak   275 #SUP  0.97  #QF  0.97
 42 MET  HN     42 MET  HB2     3.18            #peak   276 #SUP  0.99  #QF  0.99
 42 MET  HN     42 MET  QE      4.19            #peak   277 #SUP  1.00
 21 CYSS HN     37 PHE  QE      5.50            #peak   279 #SUP  0.85  #QF  0.85
 21 CYSS HN     22 HIST HN      2.98            #peak   280 #SUP  1.00
 21 CYSS HN     37 PHE  QD      4.56            #peak   281 #SUP  0.97  #QF  0.97
 18 CYSS HA     21 CYSS HN      5.18            #peak   283 #SUP  0.81  #QF  0.81
 18 CYSS HB3    21 CYSS HN      3.59            #peak   284 #SUP  0.95  #QF  0.95
 21 CYSS HN     21 CYSS HB2     3.69            #peak   285 #SUP  0.98  #QF  0.98
 21 CYSS HN     38 CYSS HB3     5.20            #peak   286 #SUP  0.92  #QF  0.92
 20 LYS  HB3    21 CYSS HN      3.09            #peak   287 #SUP  0.81  #QF  0.81
 21 CYSS HN     21 CYSS HB3     3.55            #peak   288 #SUP  0.96  #QF  0.96
 20 LYS  HB2    21 CYSS HN      3.50            #peak   289 #SUP  0.99  #QF  0.99
 20 LYS  HD3    21 CYSS HN      5.01            #peak   291 #SUP  0.92  #QF  0.92
 20 LYS  HG2    21 CYSS HN      4.59            #peak   292 #SUP  0.97  #QF  0.97
 62 LYS  QB     63 ASP  HN      3.73            #peak   302 #SUP  0.97  #QF  0.97
 63 ASP  HN     63 ASP  HB3     3.72            #peak   303 #SUP  0.94  #QF  0.94
 62 LYS  HG3    63 ASP  HN      4.82            #peak   304 #SUP  0.97  #QF  0.97
 29 LYS  HA     66 PHE  HN      4.36            #peak   307 #SUP  1.00  #QF  0.59
 65 VAL  HB     66 PHE  HN      4.61            #peak   313 #SUP  1.00
 48 SER  HN     51 PRO  HA      5.00            #peak   314 #SUP  0.90  #QF  0.90
 48 SER  HN     48 SER  HB2     3.37            #peak   315 #SUP  0.94  #QF  0.94
 46 LEU  HA     48 SER  HN      3.55            #peak   316 #SUP  0.94  #QF  0.94
 48 SER  HN     48 SER  HB3     3.36            #peak   317 #SUP  0.99  #QF  0.99
 46 LEU  HN     48 SER  HN      4.85            #peak   318 #SUP  1.00
 48 SER  HN     51 PRO  HB3     4.14            #peak   320 #SUP  0.88  #QF  0.88
 45 LEU  QD2    48 SER  HN      5.50            #peak   321 #SUP  1.00  #QF  0.35
 46 LEU  QD2    48 SER  HN      5.50            #peak   321 #SUP  1.00  #QF  0.35
 10 LYS  HA     11 THR  HN      3.53            #peak   323 #SUP  0.94  #QF  0.78
 42 MET  HA     46 LEU  HN      4.30            #peak   324 #SUP  0.94  #QF  0.94
 45 LEU  HG     46 LEU  HN      4.50            #peak   325 #SUP  1.00
 45 LEU  QD1    46 LEU  HN      4.89            #peak   326 #SUP  0.96  #QF  0.96
 44 ALA  HN     46 LEU  HN      4.57            #peak   328 #SUP  0.98  #QF  0.98
 45 LEU  HB2    46 LEU  HN      3.39            #peak   331 #SUP  0.97  #QF  0.97
 46 LEU  HN     46 LEU  HB3     3.61            #peak   332 #SUP  0.99  #QF  0.99
 45 LEU  HB3    46 LEU  HN      3.95            #peak   333 #SUP  1.00
 46 LEU  HN     46 LEU  QD1     3.93            #peak   334 #SUP  1.00
 19 GLU  HN     19 GLU  HG3     4.58            #peak   342 #SUP  0.99  #QF  0.43
 19 GLU  HN     20 LYS  HB2     4.84            #peak   342 #SUP  0.99  #QF  0.43
 18 CYSS HB3    19 GLU  HN      4.82            #peak   344 #SUP  1.00
 18 CYSS HB2    19 GLU  HN      4.29            #peak   345 #SUP  0.88  #QF  0.88
 36 ARG  HA     37 PHE  HN      3.05            #peak   347 #SUP  0.92  #QF  0.92
 37 PHE  HN     37 PHE  HB2     3.61            #peak   348 #SUP  0.97  #QF  0.97
 28 PRO  QB     37 PHE  HN      4.20            #peak   349 #SUP  0.94  #QF  0.94
 36 ARG  HB2    37 PHE  HN      4.25            #peak   350 #SUP  0.99  #QF  0.99
 36 ARG  HB3    37 PHE  HN      3.86            #peak   351 #SUP  1.00
 37 PHE  HN     37 PHE  QD      3.79            #peak   352 #SUP  0.98  #QF  0.98
 37 PHE  HN     37 PHE  HB3     3.98            #peak   353 #SUP  0.97  #QF  0.97
 36 ARG  HG2    37 PHE  HN      4.36            #peak   354 #SUP  0.90  #QF  0.90
 25 LEU  QD1    37 PHE  HN      4.90            #peak   355 #SUP  0.96  #QF  0.96
 53 CYSS HB3    56 CYSS HN      4.72            #peak   356 #SUP  0.53  #QF  0.53
 55 ALA  HN     57 GLN  HN      4.40            #peak   357 #SUP  0.79  #QF  0.79
 53 CYSS HN     57 GLN  HN      4.67            #peak   358 #SUP  0.99  #QF  0.99
 53 CYSS HB2    57 GLN  HN      4.21            #peak   361 #SUP  0.90  #QF  0.90
 52 LYS  HB2    57 GLN  HN      4.55            #peak   363 #SUP  0.88  #QF  0.88
 57 GLN  HN     57 GLN  HA      2.86            #peak   364 #SUP  0.97  #QF  0.97
 56 CYSS HB2    57 GLN  HN      4.66            #peak   365 #SUP  1.00
 55 ALA  QB     57 GLN  HN      4.36            #peak   367 #SUP  0.97  #QF  0.97
 40 SER  HN     41 CYSS HN      3.39            #peak   368 #SUP  0.97  #QF  0.97
 39 GLU  HN     40 SER  HN      3.42            #peak   369 #SUP  0.99  #QF  0.99
 40 SER  HN     40 SER  QB      2.95            #peak   371 #SUP  0.95  #QF  0.95
 38 CYSS HB2    40 SER  HN      3.97            #peak   373 #SUP  0.98  #QF  0.98
 40 SER  HN     41 CYSS HB2     5.41            #peak   374 #SUP  0.97  #QF  0.97
 39 GLU  HG2    40 SER  HN      5.02            #peak   376 #SUP  0.99  #QF  0.99
 39 GLU  HB3    40 SER  HN      3.45            #peak   377 #SUP  0.89  #QF  0.89
 40 SER  HN     43 ALA  QB      4.81            #peak   378 #SUP  0.99  #QF  0.99
 18 CYSS HN     22 HIST HN      4.40            #peak   379 #SUP  0.99  #QF  0.99
 22 HIST HN     23 LEU  HN      3.42            #peak   380 #SUP  1.00
 22 HIST HN     22 HIST HA      2.68            #peak   381 #SUP  0.91  #QF  0.91
 18 CYSS HB3    22 HIST HN      3.26            #peak   382 #SUP  0.83  #QF  0.83
 17 LYS  QE     22 HIST HN      4.72            #peak   383 #SUP  0.98  #QF  0.91
 21 CYSS HB3    22 HIST HN      4.60            #peak   384 #SUP  0.94  #QF  0.94
 20 LYS  HB2    22 HIST HN      4.69            #peak   385 #SUP  0.94  #QF  0.94
 17 LYS  HG3    22 HIST HN      4.82            #peak   386 #SUP  0.96  #QF  0.96
 21 CYSS HB2    22 HIST HN      4.44            #peak   387 #SUP  0.99  #QF  0.99
 20 LYS  HN     22 HIST HN      3.90            #peak   389 #SUP  0.99  #QF  0.99
 22 HIST HN     22 HIST HD2     3.99            #peak   391 #SUP  0.91  #QF  0.91
 18 CYSS HA     22 HIST HN      5.11            #peak   392 #SUP  0.86  #QF  0.86
 22 HIST HN     22 HIST HB2     3.97            #peak   393 #SUP  0.97  #QF  0.97
 22 HIST HN     23 LEU  HB2     4.52            #peak   394 #SUP  0.87  #QF  0.87
 17 LYS  HG2    22 HIST HN      4.86            #peak   395 #SUP  0.99  #QF  0.99
 40 SER  QB     41 CYSS HN      3.38            #peak   397 #SUP  1.00  #QF  0.92
 38 CYSS HB2    41 CYSS HN      4.92            #peak   400 #SUP  0.94  #QF  0.94
 24 VAL  QG2    25 LEU  HN      4.11            #peak   401 #SUP  0.87  #QF  0.87
 16 TYR  HB2    25 LEU  HN      4.78            #peak   402 #SUP  0.97  #QF  0.97
 25 LEU  HN     25 LEU  HG      3.50            #peak   407 #SUP  0.97  #QF  0.97
 25 LEU  HN     25 LEU  HB3     3.94            #peak   408 #SUP  0.98  #QF  0.98
 46 LEU  QD2    62 LYS  HN      4.85            #peak   410 #SUP  0.95  #QF  0.95
 61 VAL  HA     62 LYS  HN      3.04            #peak   412 #SUP  0.96  #QF  0.96
 62 LYS  HN     62 LYS  QB      3.31            #peak   414 #SUP  0.97  #QF  0.97
 62 LYS  HN     62 LYS  HG2     4.62            #peak   415 #SUP  0.88  #QF  0.65
 61 VAL  QG1    62 LYS  HN      3.78            #peak   416 #SUP  0.90  #QF  0.90
 30 GLN  HG3    31 THR  HN      4.20            #peak   419 #SUP  0.98  #QF  0.98
 31 THR  HN     34 GLY  HN      4.09            #peak   420 #SUP  0.96  #QF  0.96
 31 THR  HN     31 THR  HG1     4.98            #peak   421 #SUP  0.93  #QF  0.93
 30 GLN  HA     31 THR  HN      3.14            #peak   422 #SUP  0.86  #QF  0.86
 30 GLN  HB3    31 THR  HN      4.16            #peak   424 #SUP  0.88  #QF  0.88
 30 GLN  HB2    31 THR  HN      4.66            #peak   425 #SUP  0.98  #QF  0.98
  9 VAL  HA     10 LYS  HN      3.04            #peak   428 #SUP  0.83  #QF  0.83
  9 VAL  HB     10 LYS  HN      4.55            #peak   429 #SUP  0.98  #QF  0.98
 10 LYS  HN     10 LYS  HB2     4.01            #peak   430 #SUP  0.95  #QF  0.95
 10 LYS  HN     10 LYS  HB3     4.01            #peak   433 #SUP  0.84  #QF  0.84
 54 THR  HA     57 GLN  HE21    4.23            #peak   442 #SUP  0.97  #QF  0.97
 54 THR  HN     55 ALA  HN      4.40            #peak   445 #SUP  1.00
 55 ALA  HN     56 CYSS HN      3.89            #peak   447 #SUP  0.96  #QF  0.92
 18 CYSS HN     22 HIST HA      4.65            #peak   451 #SUP  0.98  #QF  0.98
 57 GLN  HN     57 GLN  HE21    4.79            #peak   455 #SUP  0.82  #QF  0.82
 46 LEU  HN     47 SER  HN      3.16            #peak   461 #SUP  0.98  #QF  0.98
 47 SER  HN     47 SER  HB3     3.24            #peak   463 #SUP  0.96  #QF  0.96
 47 SER  HN     51 PRO  HB3     4.80            #peak   464 #SUP  0.79  #QF  0.79
 46 LEU  HB2    47 SER  HN      3.61            #peak   465 #SUP  0.95  #QF  0.95
 46 LEU  HB3    47 SER  HN      4.08            #peak   466 #SUP  0.98  #QF  0.98
 46 LEU  QD1    47 SER  HN      4.92            #peak   467 #SUP  1.00
 46 LEU  QD2    47 SER  HN      4.96            #peak   468 #SUP  0.98  #QF  0.98
 33 CYSS HN     34 GLY  HA2     4.84            #peak   469 #SUP  0.99  #QF  0.99
 32 GLU  HN     33 CYSS HN      3.67            #peak   470 #SUP  0.94  #QF  0.94
 31 THR  HG1    33 CYSS HN      3.76            #peak   471 #SUP  0.81  #QF  0.81
 33 CYSS HN     33 CYSS HB2     3.87            #peak   475 #SUP  0.94  #QF  0.94
 33 CYSS HN     33 CYSS HB3     3.43            #peak   476 #SUP  0.96  #QF  0.96
 31 THR  QG2    33 CYSS HN      4.25            #peak   479 #SUP  0.99  #QF  0.99
 52 LYS  HN     60 ILE  HN      4.71            #peak   481 #SUP  1.00  #QF  0.94
 60 ILE  HN     61 VAL  HN      5.07            #peak   481 #SUP  1.00  #QF  0.94
 37 PHE  QE     54 THR  HN      4.70            #peak   486 #SUP  0.99  #QF  0.99
 51 PRO  HG3    60 ILE  HN      5.23            #peak   487 #SUP  1.00
 29 LYS  HN     30 GLN  HN      4.45            #peak   488 #SUP  0.99  #QF  0.99
 57 GLN  HA     57 GLN  HE21    4.71            #peak   489 #SUP  0.96  #QF  0.96
 18 CYSS HN     23 LEU  HN      4.09            #peak   494 #SUP  1.00
 15 LYS  HN     16 TYR  QD      5.50            #peak   496 #SUP  1.00
 16 TYR  HN     17 LYS  HN      4.76            #peak   497 #SUP  0.99  #QF  0.99
 17 LYS  HN     24 VAL  HA      5.14            #peak   498 #SUP  0.98  #QF  0.98
 17 LYS  HN     25 LEU  HN      4.30            #peak   499 #SUP  0.81  #QF  0.81
 17 LYS  HN     17 LYS  HG3     5.21            #peak   500 #SUP  1.00
 18 CYSS HN     23 LEU  HB2     3.99            #peak   501 #SUP  0.96  #QF  0.96
 19 GLU  HN     20 LYS  HN      3.76            #peak   504 #SUP  1.00
 33 CYSS HN     35 HIST HN      4.47            #peak   506 #SUP  0.95  #QF  0.95
 21 CYSS HN     23 LEU  HN      4.23            #peak   507 #SUP  0.99  #QF  0.99
 19 GLU  HN     21 CYSS HN      5.13            #peak   508 #SUP  0.96  #QF  0.96
 20 LYS  HN     21 CYSS HN      3.11            #peak   509 #SUP  0.98  #QF  0.98
 24 VAL  HN     25 LEU  HN      5.17            #peak   514 #SUP  1.00  #QF  0.98
 18 CYSS HN     25 LEU  HN      4.59            #peak   515 #SUP  0.99  #QF  0.99
 33 CYSS HN     34 GLY  HN      3.02            #peak   519 #SUP  0.99  #QF  0.99
 36 ARG  HN     36 ARG  HG2     4.65            #peak   521 #SUP  0.90  #QF  0.90
 35 HIST HN     36 ARG  HN      4.82            #peak   522 #SUP  0.99  #QF  0.99
 39 GLU  HN     41 CYSS HN      5.50            #peak   523 #SUP  0.99  #QF  0.99
 41 CYSS HB2    42 MET  HN      3.53            #peak   525 #SUP  0.93  #QF  0.93
 41 CYSS HN     43 ALA  HN      4.84            #peak   527 #SUP  0.95  #QF  0.95
 43 ALA  HA     44 ALA  HN      3.50            #peak   528 #SUP  0.99  #QF  0.99
 42 MET  HB3    44 ALA  HN      4.84            #peak   529 #SUP  0.94  #QF  0.94
 46 LEU  HN     46 LEU  HG      2.99            #peak   530 #SUP  0.77  #QF  0.77
 47 SER  HN     48 SER  HN      3.08            #peak   531 #SUP  1.00
 47 SER  HN     47 SER  HB2     3.24            #peak   532 #SUP  0.98  #QF  0.98
 62 LYS  HN     63 ASP  HN      4.08            #peak   536 #SUP  0.98  #QF  0.98
  7 GLY  HA1     8 PHE  HA      5.36            #peak     6 #SUP  0.47  #QF  0.30
  7 GLY  HA2     8 PHE  HA      5.36            #peak     6 #SUP  0.47  #QF  0.30
 30 GLN  HB3    34 GLY  HA1     5.44            #peak     8 #SUP  0.98  #QF  0.98
 33 CYSS HN     34 GLY  HA1     4.44            #peak    10 #SUP  0.99  #QF  0.99
 33 CYSS HA     34 GLY  HA1     5.07            #peak    11 #SUP  1.00
 30 GLN  HG2    34 GLY  HA1     4.35            #peak    13 #SUP  1.00
 37 PHE  HB3    38 CYSS HN      3.66            #peak    15 #SUP  1.00
 19 GLU  HN     37 PHE  HB3     4.86            #peak    17 #SUP  0.99  #QF  0.99
 37 PHE  HB3    41 CYSS HB3     3.91            #peak    22 #SUP  0.99  #QF  0.99
 37 PHE  HB3    42 MET  HB3     4.90            #peak    24 #SUP  1.00
 37 PHE  HB3    42 MET  HB2     3.82            #peak    25 #SUP  1.00
 37 PHE  HB2    42 MET  HN      4.31            #peak    27 #SUP  1.00
 36 ARG  HA     37 PHE  HB2     4.85            #peak    33 #SUP  0.99  #QF  0.99
 37 PHE  HB2    41 CYSS HB3     5.05            #peak    36 #SUP  0.99  #QF  0.99
 37 PHE  HB2    42 MET  HB3     4.74            #peak    37 #SUP  1.00
 37 PHE  HB2    42 MET  HB2     3.80            #peak    38 #SUP  1.00
 37 PHE  HB2    42 MET  HG3     5.50            #peak    41 #SUP  0.99  #QF  0.99
 31 THR  QG2    37 PHE  HB3     5.50            #peak    43 #SUP  0.95  #QF  0.95
 25 LEU  HN     25 LEU  HB2     3.63            #peak    44 #SUP  0.99  #QF  0.99
 16 TYR  HB3    25 LEU  HB2     5.01            #peak    46 #SUP  0.98  #QF  0.98
 25 LEU  HB3    38 CYSS HB3     5.50            #peak    54 #SUP  0.99  #QF  0.99
 44 ALA  QB     45 LEU  HN      3.04            #peak    57 #SUP  0.98  #QF  0.98
 20 LYS  QE     44 ALA  QB      3.99            #peak    60 #SUP  0.99  #QF  0.99
 44 ALA  QB     45 LEU  QD2     3.96            #peak    62 #SUP  1.00
 44 ALA  QB     45 LEU  QD1     4.68            #peak    63 #SUP  0.98  #QF  0.98
 55 ALA  HN     55 ALA  QB      2.95            #peak    64 #SUP  0.99  #QF  0.99
 55 ALA  QB     56 CYSS HN      3.12            #peak    65 #SUP  0.86  #QF  0.86
 35 HIST HE1    55 ALA  QB      3.92            #peak    66 #SUP  0.99  #QF  0.99
 37 PHE  QE     55 ALA  QB      4.65            #peak    67 #SUP  0.99  #QF  0.99
 55 ALA  QB     56 CYSS HB3     4.10            #peak    69 #SUP  0.99  #QF  0.99
 19 GLU  HG2    55 ALA  QB      3.96            #peak    70 #SUP  0.99  #QF  0.99
 19 GLU  HG3    55 ALA  QB      3.50            #peak    71 #SUP  0.99  #QF  0.99
 19 GLU  HB2    55 ALA  QB      3.65            #peak    72 #SUP  0.99  #QF  0.99
 36 ARG  HN     55 ALA  QB      4.63            #peak    73 #SUP  0.67  #QF  0.67
 37 PHE  HZ     55 ALA  QB      4.06            #peak    74 #SUP  1.00
 54 THR  HN     55 ALA  QB      4.76            #peak    76 #SUP  0.94  #QF  0.94
 55 ALA  QB     56 CYSS HA      4.43            #peak    77 #SUP  1.00
 54 THR  HB     55 ALA  QB      4.83            #peak    78 #SUP  0.84  #QF  0.84
 35 HIST HB2    55 ALA  QB      4.01            #peak    80 #SUP  0.98  #QF  0.98
 35 HIST HB3    55 ALA  QB      3.76            #peak    81 #SUP  1.00
 19 GLU  HB3    55 ALA  QB      3.81            #peak    82 #SUP  0.93  #QF  0.93
 41 CYSS HN     44 ALA  QB      4.42            #peak    83 #SUP  0.95  #QF  0.95
 42 MET  HN     43 ALA  QB      4.87            #peak    84 #SUP  1.00  #QF  0.99
 42 MET  HN     44 ALA  QB      5.23            #peak    84 #SUP  1.00  #QF  0.99
 44 ALA  QB     47 SER  HN      4.57            #peak    85 #SUP  0.96  #QF  0.96
 41 CYSS HB2    44 ALA  QB      4.88            #peak    86 #SUP  0.98  #QF  0.98
 43 ALA  HN     43 ALA  QB      2.58            #peak    87 #SUP  0.96  #QF  0.96
 40 SER  HA     43 ALA  QB      3.07            #peak    88 #SUP  0.99  #QF  0.99
 43 ALA  QB     46 LEU  QD1     4.06            #peak    90 #SUP  0.99  #QF  0.99
 31 THR  HN     60 ILE  QG2     4.63            #peak    91 #SUP  0.77  #QF  0.77
 60 ILE  QG2    61 VAL  HN      3.40            #peak    92 #SUP  0.99  #QF  0.99
 60 ILE  HN     60 ILE  QG2     3.92            #peak    93 #SUP  1.00
 60 ILE  HA     60 ILE  QG2     2.98            #peak    95 #SUP  1.00
 60 ILE  QG2    61 VAL  HA      4.65            #peak    96 #SUP  0.98  #QF  0.98
 60 ILE  QG2    62 LYS  HA      5.06            #peak    97 #SUP  0.45  #QF  0.45
 53 CYSS HA     60 ILE  QG2     4.51            #peak    98 #SUP  0.99  #QF  0.99
 42 MET  HG3    60 ILE  QG2     4.90            #peak   101 #SUP  0.71  #QF  0.71
 51 PRO  HB2    60 ILE  QG2     3.89            #peak   102 #SUP  0.90  #QF  0.90
 31 THR  QG2    60 ILE  QG2     2.90            #peak   104 #SUP  0.96  #QF  0.96
 45 LEU  QD1    60 ILE  QG2     4.56            #peak   105 #SUP  1.00
 11 THR  HB     12 VAL  HN      3.85            #peak   106 #SUP  0.99  #QF  0.99
 37 PHE  HN     42 MET  QE      4.17            #peak   109 #SUP  0.98  #QF  0.98
 42 MET  QE     45 LEU  HN      5.50            #peak   110 #SUP  0.95  #QF  0.74
 42 MET  QE     46 LEU  HN      5.50            #peak   110 #SUP  0.95  #QF  0.74
 37 PHE  QE     42 MET  QE      4.55            #peak   111 #SUP  1.00
 37 PHE  QD     42 MET  QE      3.35            #peak   112 #SUP  0.99  #QF  0.99
 37 PHE  HA     42 MET  QE      4.84            #peak   113 #SUP  0.98  #QF  0.98
 29 LYS  HA     42 MET  QE      5.50            #peak   114 #SUP  1.00
 42 MET  HA     42 MET  QE      3.62            #peak   115 #SUP  1.00
 37 PHE  HB3    42 MET  QE      3.63            #peak   116 #SUP  1.00
 42 MET  QE     60 ILE  QG2     3.31            #peak   118 #SUP  0.90  #QF  0.25
 25 LEU  QD1    36 ARG  HD2     5.50            #peak   122 #SUP  0.98  #QF  0.98
 11 THR  HB     13 GLU  HN      5.19            #peak   123 #SUP  0.86  #QF  0.86
 11 THR  HA     11 THR  HB      2.97            #peak   124 #SUP  0.99  #QF  0.99
 36 ARG  HA     42 MET  QE      5.08            #peak   126 #SUP  0.96  #QF  0.96
 36 ARG  HN     36 ARG  HD2     4.48            #peak   128 #SUP  0.99  #QF  0.99
 36 ARG  HB2    36 ARG  HD2     3.56            #peak   130 #SUP  1.00
 36 ARG  HB3    36 ARG  HD2     3.76            #peak   132 #SUP  1.00
 36 ARG  HA     36 ARG  HD2     4.67            #peak   134 #SUP  1.00
 16 TYR  HB3    36 ARG  HD2     3.75            #peak   135 #SUP  0.93  #QF  0.93
 30 GLN  HG3    36 ARG  HD2     4.84            #peak   136 #SUP  0.86  #QF  0.86
 28 PRO  HG3    36 ARG  HD2     4.37            #peak   137 #SUP  0.98  #QF  0.65
 16 TYR  HB3    36 ARG  HD3     4.05            #peak   139 #SUP  0.93  #QF  0.93
 28 PRO  HG3    36 ARG  HD3     4.10            #peak   141 #SUP  1.00  #QF  0.92
 36 ARG  HB2    36 ARG  HD3     3.72            #peak   142 #SUP  0.99  #QF  0.99
 36 ARG  HB3    36 ARG  HD3     3.82            #peak   144 #SUP  1.00
 25 LEU  QD1    36 ARG  HD3     5.29            #peak   146 #SUP  0.98  #QF  0.98
 36 ARG  HN     36 ARG  HD3     5.50            #peak   147 #SUP  0.99  #QF  0.99
 36 ARG  HA     36 ARG  HD3     4.93            #peak   148 #SUP  1.00
 23 LEU  HN     23 LEU  HB3     3.72            #peak   149 #SUP  1.00  #QF  0.99
 23 LEU  HB3    24 VAL  HN      4.07            #peak   149 #SUP  1.00  #QF  0.99
 23 LEU  HN     23 LEU  HB2     3.33            #peak   158 #SUP  1.00
 23 LEU  HB2    23 LEU  QD2     3.21            #peak   164 #SUP  0.78  #QF  0.78
 23 LEU  HB2    25 LEU  QD2     4.35            #peak   165 #SUP  1.00
 23 LEU  HB2    25 LEU  QD1     4.84            #peak   166 #SUP  1.00
 23 LEU  HB2    38 CYSS HB3     4.69            #peak   167 #SUP  0.84  #QF  0.84
 20 LYS  QE     45 LEU  HN      4.85            #peak   168 #SUP  0.98  #QF  0.98
 20 LYS  QE     54 THR  HG1     4.37            #peak   169 #SUP  0.88  #QF  0.88
 20 LYS  QE     41 CYSS HA      4.14            #peak   170 #SUP  1.00
 20 LYS  QE     41 CYSS HB2     4.97            #peak   171 #SUP  0.99  #QF  0.99
 20 LYS  HB2    20 LYS  QE      3.99            #peak   172 #SUP  1.00
 20 LYS  HD2    20 LYS  QE      3.00            #peak   173 #SUP  1.00
 20 LYS  HG2    20 LYS  QE      3.16            #peak   175 #SUP  0.94  #QF  0.94
 20 LYS  HG3    20 LYS  QE      3.13            #peak   176 #SUP  0.95  #QF  0.95
 20 LYS  QE     45 LEU  QD2     3.33            #peak   177 #SUP  1.00
 20 LYS  QE     45 LEU  QD1     4.18            #peak   178 #SUP  0.99  #QF  0.99
 37 PHE  HZ     54 THR  HB      4.23            #peak   179 #SUP  1.00
 53 CYSS HA     54 THR  HB      4.67            #peak   180 #SUP  0.88  #QF  0.88
 20 LYS  HB2    54 THR  HB      4.81            #peak   181 #SUP  0.99  #QF  0.99
 19 GLU  HB2    54 THR  HB      5.35            #peak   182 #SUP  0.88  #QF  0.28
 20 LYS  HD3    54 THR  HB      5.50            #peak   182 #SUP  0.88  #QF  0.28
 54 THR  HB     55 ALA  HN      4.11            #peak   184 #SUP  1.00
 37 PHE  QE     54 THR  HB      3.93            #peak   185 #SUP  1.00
 54 THR  HN     54 THR  HB      4.03            #peak   186 #SUP  0.99  #QF  0.99
 29 LYS  HA     29 LYS  QE      4.55            #peak   190 #SUP  0.99  #QF  0.99
 10 LYS  HA     10 LYS  QE      4.58            #peak   191 #SUP  0.85  #QF  0.85
 29 LYS  QE     39 GLU  HA      4.24            #peak   192 #SUP  0.86  #QF  0.86
 10 LYS  QD     10 LYS  QE      2.96            #peak   193 #SUP  1.00
 10 LYS  HG2    10 LYS  QE      3.79            #peak   194 #SUP  0.83  #QF  0.43
 29 LYS  HG3    29 LYS  QE      3.66            #peak   194 #SUP  0.83  #QF  0.43
 62 LYS  HG2    62 LYS  QE      4.05            #peak   194 #SUP  0.83  #QF  0.43
 61 VAL  QG1    64 LYS  QE      3.79            #peak   199 #SUP  0.86  #QF  0.80
 61 VAL  QG2    64 LYS  QE      4.32            #peak   199 #SUP  0.86  #QF  0.80
 52 LYS  QE     53 CYSS HN      5.01            #peak   200 #SUP  0.58  #QF  0.58
 52 LYS  HN     52 LYS  QE      4.44            #peak   201 #SUP  0.97  #QF  0.43
 51 PRO  HA     52 LYS  QE      4.56            #peak   203 #SUP  0.81  #QF  0.81
 50 SER  HB2    52 LYS  QE      4.33            #peak   205 #SUP  0.98  #QF  0.98
 64 LYS  HB3    64 LYS  QE      4.57            #peak   207 #SUP  0.99  #QF  0.99
 52 LYS  HG3    52 LYS  QE      3.21            #peak   208 #SUP  0.91  #QF  0.91
 52 LYS  HG2    52 LYS  QE      3.21            #peak   209 #SUP  0.98  #QF  0.98
 17 LYS  QE     22 HIST HB3     4.12            #peak   212 #SUP  0.99  #QF  0.99
 17 LYS  HG2    17 LYS  QE      3.51            #peak   214 #SUP  0.99  #QF  0.37
 17 LYS  HG3    17 LYS  QE      3.41            #peak   215 #SUP  0.96  #QF  0.96
 15 LYS  HE2    24 VAL  QG1     4.59            #peak   216 #SUP  0.98  #QF  0.98
 17 LYS  HN     17 LYS  QE      5.50            #peak   217 #SUP  1.00  #QF  0.34
 17 LYS  QE     23 LEU  HN      5.50            #peak   217 #SUP  1.00  #QF  0.34
 17 LYS  QE     22 HIST HA      4.33            #peak   218 #SUP  0.91  #QF  0.91
 17 LYS  QE     24 VAL  HA      5.50            #peak   219 #SUP  0.99  #QF  0.99
 17 LYS  QE     19 GLU  HA      4.76            #peak   220 #SUP  0.91  #QF  0.91
 17 LYS  QE     22 HIST HB2     4.60            #peak   221 #SUP  0.98  #QF  0.98
 42 MET  HA     45 LEU  HB2     3.59            #peak   224 #SUP  0.97  #QF  0.97
 45 LEU  HB3    60 ILE  HB      4.40            #peak   231 #SUP  0.97  #QF  0.97
 42 MET  HA     45 LEU  HB3     5.24            #peak   235 #SUP  1.00
 42 MET  QE     45 LEU  HB3     5.23            #peak   238 #SUP  0.98  #QF  0.44
 45 LEU  HB3    46 LEU  HG      5.50            #peak   238 #SUP  0.98  #QF  0.44
 45 LEU  HB3    60 ILE  HG13    4.70            #peak   240 #SUP  0.98  #QF  0.98
 46 LEU  HN     46 LEU  HB2     3.19            #peak   243 #SUP  0.99  #QF  0.99
 46 LEU  HB2    46 LEU  QD1     3.03            #peak   247 #SUP  1.00
 46 LEU  HB2    46 LEU  QD2     3.38            #peak   248 #SUP  1.00
 42 MET  HG3    46 LEU  HB2     4.81            #peak   249 #SUP  1.00
 46 LEU  HB3    46 LEU  QD2     3.25            #peak   252 #SUP  1.00
 14 ASP  HA     14 ASP  QB      2.95            #peak   259 #SUP  0.97  #QF  0.97
 16 TYR  HB3    25 LEU  HG      4.93            #peak   261 #SUP  0.78  #QF  0.78
 16 TYR  HB3    28 PRO  HG3     4.77            #peak   268 #SUP  1.00  #QF  0.77
 16 TYR  HB3    36 ARG  HB2     4.29            #peak   269 #SUP  0.97  #QF  0.97
 16 TYR  HB3    36 ARG  HG3     5.29            #peak   270 #SUP  1.00
 16 TYR  HB3    25 LEU  QD1     4.32            #peak   271 #SUP  1.00
 16 TYR  HB2    28 PRO  HG3     4.49            #peak   273 #SUP  0.98  #QF  0.88
 16 TYR  HB2    25 LEU  HB2     4.40            #peak   278 #SUP  0.99  #QF  0.99
 16 TYR  HB2    25 LEU  HG      4.88            #peak   279 #SUP  1.00  #QF  0.92
 16 TYR  HB2    25 LEU  HB3     5.50            #peak   280 #SUP  0.98  #QF  0.84
 16 TYR  HB2    36 ARG  HB3     5.50            #peak   280 #SUP  0.98  #QF  0.84
 66 PHE  HN     66 PHE  HB3     4.11            #peak   284 #SUP  0.99  #QF  0.99
 16 TYR  HB3    36 ARG  HG2     4.82            #peak   288 #SUP  0.99  #QF  0.99
 66 PHE  HN     66 PHE  HB2     4.11            #peak   290 #SUP  0.99  #QF  0.99
 63 ASP  HN     63 ASP  HB2     3.72            #peak   295 #SUP  0.99  #QF  0.99
 63 ASP  HB2    64 LYS  HN      4.61            #peak   296 #SUP  0.99  #QF  0.99
 61 VAL  QG1    63 ASP  HB2     4.21            #peak   299 #SUP  0.97  #QF  0.97
 53 CYSS HN     60 ILE  QD1     4.15            #peak   304 #SUP  0.98  #QF  0.98
 45 LEU  HN     60 ILE  QD1     5.50            #peak   305 #SUP  0.99  #QF  0.91
 46 LEU  HN     60 ILE  QD1     5.50            #peak   305 #SUP  0.99  #QF  0.91
 52 LYS  HN     60 ILE  QD1     4.12            #peak   306 #SUP  0.97  #QF  0.97
 60 ILE  HN     60 ILE  QD1     4.06            #peak   307 #SUP  0.97  #QF  0.97
 37 PHE  QE     60 ILE  QD1     4.50            #peak   308 #SUP  0.97  #QF  0.97
 59 SER  HA     60 ILE  QD1     4.80            #peak   309 #SUP  0.97  #QF  0.97
 45 LEU  HA     60 ILE  QD1     4.40            #peak   311 #SUP  0.96  #QF  0.90
 46 LEU  HA     60 ILE  QD1     4.78            #peak   311 #SUP  0.96  #QF  0.90
 53 CYSS HA     60 ILE  QD1     3.48            #peak   312 #SUP  0.98  #QF  0.98
 53 CYSS HB2    60 ILE  QD1     3.92            #peak   314 #SUP  0.97  #QF  0.97
 51 PRO  HB2    60 ILE  QD1     3.68            #peak   315 #SUP  0.98  #QF  0.98
 45 LEU  HB2    60 ILE  QD1     3.91            #peak   316 #SUP  0.98  #QF  0.98
 42 MET  QE     60 ILE  QD1     3.44            #peak   317 #SUP  0.98  #QF  0.98
 45 LEU  HG     60 ILE  QD1     4.42            #peak   318 #SUP  0.96  #QF  0.96
 60 ILE  HB     60 ILE  QD1     3.25            #peak   319 #SUP  0.98  #QF  0.98
 45 LEU  HB3    60 ILE  QD1     3.78            #peak   321 #SUP  0.99  #QF  0.99
 60 ILE  QG2    60 ILE  QD1     2.84            #peak   323 #SUP  0.95  #QF  0.95
 60 ILE  HB     61 VAL  HN      4.46            #peak   334 #SUP  1.00
 59 SER  HA     60 ILE  HB      5.38            #peak   335 #SUP  1.00
 40 SER  HA     41 CYSS HA      5.08            #peak   341 #SUP  0.97  #QF  0.97
 41 CYSS HA     45 LEU  HN      4.35            #peak   343 #SUP  0.95  #QF  0.95
 41 CYSS HA     44 ALA  HN      3.62            #peak   344 #SUP  0.98  #QF  0.98
 20 LYS  HB2    41 CYSS HA      5.40            #peak   347 #SUP  0.99  #QF  0.99
 41 CYSS HA     44 ALA  QB      2.91            #peak   349 #SUP  0.89  #QF  0.89
 41 CYSS HA     45 LEU  QD1     4.86            #peak   350 #SUP  0.97  #QF  0.97
 54 THR  HA     57 GLN  HN      5.16            #peak   354 #SUP  0.99  #QF  0.99
 37 PHE  HZ     54 THR  HA      4.72            #peak   355 #SUP  1.00
 54 THR  HA     57 GLN  HE22    4.46            #peak   357 #SUP  0.80  #QF  0.80
 54 THR  HA     55 ALA  HA      5.06            #peak   358 #SUP  0.99  #QF  0.99
 54 THR  HA     54 THR  HB      2.94            #peak   359 #SUP  0.99  #QF  0.99
 54 THR  HA     54 THR  QG2     3.01            #peak   362 #SUP  1.00
 45 LEU  QD2    54 THR  HA      4.72            #peak   363 #SUP  0.98  #QF  0.98
 54 THR  HA     55 ALA  QB      5.02            #peak   364 #SUP  0.99  #QF  0.99
 37 PHE  QE     54 THR  HA      4.86            #peak   365 #SUP  0.76  #QF  0.76
 48 SER  HB2    51 PRO  HB3     5.03            #peak   367 #SUP  1.00
 48 SER  HB2    50 SER  HN      5.13            #peak   368 #SUP  0.86  #QF  0.86
 48 SER  HA     48 SER  HB2     2.90            #peak   370 #SUP  0.95  #QF  0.95
 48 SER  HB2    51 PRO  HA      4.81            #peak   371 #SUP  1.00
 45 LEU  QD2    48 SER  HB2     4.67            #peak   373 #SUP  0.88  #QF  0.88
 48 SER  HB3    50 SER  HN      4.79            #peak   374 #SUP  0.83  #QF  0.83
 47 SER  HN     48 SER  HB3     4.99            #peak   375 #SUP  0.97  #QF  0.97
 48 SER  HB3    51 PRO  HA      3.72            #peak   378 #SUP  0.95  #QF  0.95
 48 SER  HB3    51 PRO  HD3     4.57            #peak   380 #SUP  0.96  #QF  0.96
 48 SER  HB3    51 PRO  HB3     4.03            #peak   381 #SUP  0.98  #QF  0.98
 45 LEU  QD2    48 SER  HB3     4.83            #peak   382 #SUP  0.95  #QF  0.95
 58 GLU  HN     58 GLU  QG      3.88            #peak   383 #SUP  0.99  #QF  0.99
 58 GLU  QG     59 SER  HN      4.29            #peak   387 #SUP  0.98  #QF  0.98
 33 CYSS HA     58 GLU  QG      4.59            #peak   388 #SUP  0.98  #QF  0.98
 44 ALA  QB     47 SER  HB2     5.28            #peak   393 #SUP  0.87  #QF  0.87
 44 ALA  QB     47 SER  HB3     5.28            #peak   399 #SUP  0.63  #QF  0.45
 47 SER  HB3    48 SER  HN      4.64            #peak   400 #SUP  0.99  #QF  0.99
 32 GLU  QB     32 GLU  HG3     2.87            #peak   402 #SUP  1.00
 32 GLU  HN     32 GLU  HG3     4.74            #peak   403 #SUP  1.00
 32 GLU  HN     32 GLU  HG2     4.74            #peak   404 #SUP  0.96  #QF  0.96
 23 LEU  HA     24 VAL  HA      4.61            #peak   406 #SUP  0.90  #QF  0.90
 47 SER  HB2    48 SER  HN      4.64            #peak   407 #SUP  0.94  #QF  0.94
 52 LYS  HB3    59 SER  QB      5.33            #peak   408 #SUP  0.85  #QF  0.85
 59 SER  HN     59 SER  QB      3.23            #peak   409 #SUP  0.95  #QF  0.95
 59 SER  QB     60 ILE  HN      3.70            #peak   410 #SUP  0.98  #QF  0.98
 59 SER  QB     61 VAL  QG2     3.95            #peak   412 #SUP  0.98  #QF  0.98
 59 SER  QB     61 VAL  HN      5.17            #peak   413 #SUP  0.99  #QF  0.99
 58 GLU  QG     59 SER  QB      4.89            #peak   414 #SUP  0.98  #QF  0.98
 59 SER  QB     60 ILE  HG13    5.00            #peak   416 #SUP  0.99  #QF  0.99
 32 GLU  HG2    64 LYS  HB3     4.89            #peak   417 #SUP  0.87  #QF  0.87
 46 LEU  HN     51 PRO  HA      5.50            #peak   419 #SUP  0.84  #QF  0.84
 51 PRO  HA     60 ILE  HB      4.76            #peak   421 #SUP  0.99  #QF  0.99
 45 LEU  HB3    51 PRO  HA      4.38            #peak   422 #SUP  0.97  #QF  0.97
 51 PRO  HA     60 ILE  QD1     4.59            #peak   423 #SUP  1.00
 51 PRO  HA     52 LYS  HN      2.63            #peak   424 #SUP  0.97  #QF  0.97
 51 PRO  HA     60 ILE  HG13    4.18            #peak   427 #SUP  0.88  #QF  0.88
 18 CYSS HN     24 VAL  HA      4.14            #peak   429 #SUP  1.00
 24 VAL  HA     25 LEU  HN      2.92            #peak   430 #SUP  0.98  #QF  0.98
 24 VAL  HA     25 LEU  HG      3.81            #peak   433 #SUP  0.87  #QF  0.87
 24 VAL  HA     25 LEU  HB2     5.50            #peak   437 #SUP  0.98  #QF  0.98
 24 VAL  HA     25 LEU  HB3     5.50            #peak   438 #SUP  0.99  #QF  0.99
 29 LYS  QE     39 GLU  HG3     4.50            #peak   442 #SUP  0.79  #QF  0.79
 39 GLU  HB2    39 GLU  HG3     2.90            #peak   443 #SUP  0.86  #QF  0.86
 29 LYS  QE     39 GLU  HG2     4.62            #peak   448 #SUP  0.59  #QF  0.59
 29 LYS  HG2    39 GLU  HG2     5.50            #peak   449 #SUP  0.97  #QF  0.93
 39 GLU  HG2    43 ALA  QB      5.50            #peak   449 #SUP  0.97  #QF  0.93
 28 PRO  HA     29 LYS  HN      3.09            #peak   450 #SUP  0.84  #QF  0.84
 25 LEU  HB3    28 PRO  HA      4.55            #peak   453 #SUP  0.97  #QF  0.97
 25 LEU  QD2    28 PRO  HA      4.55            #peak   454 #SUP  0.90  #QF  0.90
 25 LEU  QD1    28 PRO  HA      3.77            #peak   455 #SUP  1.00
 50 SER  HB3    52 LYS  QE      4.33            #peak   467 #SUP  1.00
 11 THR  QG2    13 GLU  QG      4.89            #peak   473 #SUP  0.97  #QF  0.97
 52 LYS  HN     52 LYS  HB3     3.91            #peak   476 #SUP  0.99  #QF  0.99
 52 LYS  HB3    58 GLU  HA      4.66            #peak   481 #SUP  0.46  #QF  0.46
 52 LYS  HB2    58 GLU  HN      4.72            #peak   482 #SUP  0.98  #QF  0.96
 52 LYS  HB2    52 LYS  QE      4.44            #peak   485 #SUP  0.99  #QF  0.99
 40 SER  QB     43 ALA  QB      5.21            #peak   493 #SUP  1.00  #QF  0.99
 40 SER  QB     44 ALA  QB      5.50            #peak   493 #SUP  1.00  #QF  0.99
 40 SER  QB     42 MET  HN      5.35            #peak   494 #SUP  0.74  #QF  0.31
 39 GLU  HB3    40 SER  QB      5.09            #peak   495 #SUP  0.84  #QF  0.54
 39 GLU  HB2    40 SER  QB      5.43            #peak   495 #SUP  0.84  #QF  0.54
 65 VAL  HA     66 PHE  HN      2.82            #peak   496 #SUP  0.92  #QF  0.92
 65 VAL  HA     66 PHE  QD      4.31            #peak   498 #SUP  0.98  #QF  0.98
 29 LYS  HA     65 VAL  HA      5.03            #peak   499 #SUP  1.00  #QF  0.47
 65 VAL  HA     66 PHE  HA      5.28            #peak   499 #SUP  1.00  #QF  0.47
 31 THR  QG2    65 VAL  HA      5.11            #peak   503 #SUP  0.94  #QF  0.94
 12 VAL  HA     13 GLU  QG      4.68            #peak   507 #SUP  0.98  #QF  0.98
 12 VAL  HA     12 VAL  QG1     3.39            #peak   510 #SUP  0.97  #QF  0.38
 12 VAL  HA     12 VAL  QG2     3.39            #peak   510 #SUP  0.97  #QF  0.38
 19 GLU  HG2    35 HIST HB2     4.87            #peak   511 #SUP  0.89  #QF  0.89
 19 GLU  HN     19 GLU  HG2     3.64            #peak   512 #SUP  0.98  #QF  0.98
 18 CYSS HA     19 GLU  HG2     4.72            #peak   518 #SUP  0.88  #QF  0.88
 19 GLU  HG3    37 PHE  QE      4.87            #peak   528 #SUP  0.96  #QF  0.96
  9 VAL  HA      9 VAL  QG1     3.42            #peak   535 #SUP  0.85  #QF  0.85
 11 THR  HA     12 VAL  HB      4.68            #peak   540 #SUP  0.99  #QF  0.99
 17 LYS  HB2    18 CYSS HN      4.10            #peak   550 #SUP  0.99  #QF  0.99
 17 LYS  HB2    22 HIST HA      4.43            #peak   551 #SUP  0.98  #QF  0.98
 17 LYS  HN     17 LYS  HB2     3.82            #peak   552 #SUP  0.99  #QF  0.99
 16 TYR  HA     17 LYS  HB2     4.66            #peak   553 #SUP  0.78  #QF  0.78
 17 LYS  HB2    24 VAL  HA      4.59            #peak   554 #SUP  0.99  #QF  0.99
 17 LYS  HB2    17 LYS  QE      4.36            #peak   555 #SUP  0.98  #QF  0.98
 17 LYS  HB3    18 CYSS HN      4.38            #peak   559 #SUP  1.00
 16 TYR  HA     17 LYS  HB3     4.78            #peak   560 #SUP  0.85  #QF  0.85
 17 LYS  HB3    22 HIST HA      4.60            #peak   561 #SUP  0.98  #QF  0.98
 17 LYS  HB3    17 LYS  QE      4.28            #peak   562 #SUP  0.99  #QF  0.99
 17 LYS  HB3    24 VAL  QG2     5.01            #peak   564 #SUP  0.98  #QF  0.98
 17 LYS  HB3    24 VAL  HA      4.72            #peak   566 #SUP  0.94  #QF  0.94
 61 VAL  HA     62 LYS  QB      4.56            #peak   568 #SUP  1.00
 30 GLN  HG2    36 ARG  HG2     4.69            #peak   572 #SUP  0.95  #QF  0.95
 60 ILE  HA     61 VAL  HN      2.84            #peak   573 #SUP  0.86  #QF  0.86
 59 SER  HA     60 ILE  HA      4.54            #peak   575 #SUP  1.00
 60 ILE  HA     61 VAL  HB      4.86            #peak   576 #SUP  0.98  #QF  0.98
 31 THR  QG2    60 ILE  HA      3.77            #peak   578 #SUP  1.00  #QF  0.82
 60 ILE  HA     60 ILE  HG12    3.50            #peak   579 #SUP  0.96  #QF  0.94
 60 ILE  HA     60 ILE  QD1     4.04            #peak   581 #SUP  1.00
 59 SER  QB     60 ILE  HA      4.41            #peak   582 #SUP  0.99  #QF  0.99
 30 GLN  HG2    36 ARG  HA      5.31            #peak   584 #SUP  0.94  #QF  0.94
 30 GLN  HG2    31 THR  HN      4.06            #peak   586 #SUP  0.87  #QF  0.87
 30 GLN  HA     30 GLN  HG2     4.15            #peak   589 #SUP  1.00
 30 GLN  HG3    34 GLY  HA1     4.76            #peak   594 #SUP  0.96  #QF  0.96
 30 GLN  HA     30 GLN  HG3     4.14            #peak   598 #SUP  1.00
 30 GLN  HG3    31 THR  QG2     5.43            #peak   602 #SUP  0.99  #QF  0.99
 53 CYSS HA     57 GLN  HN      4.74            #peak   603 #SUP  1.00
 37 PHE  HZ     53 CYSS HA      3.80            #peak   606 #SUP  0.99  #QF  0.99
 53 CYSS HA     54 THR  HN      3.31            #peak   607 #SUP  0.97  #QF  0.97
 53 CYSS HA     60 ILE  HG12    4.82            #peak   611 #SUP  1.00
 53 CYSS HA     55 ALA  HN      4.57            #peak   614 #SUP  0.96  #QF  0.96
 37 PHE  QE     53 CYSS HA      4.29            #peak   615 #SUP  0.96  #QF  0.96
 57 GLN  HA     57 GLN  HG2     4.01            #peak   618 #SUP  1.00
 15 LYS  HN     15 LYS  HB2     4.08            #peak   626 #SUP  1.00
 15 LYS  HB2    24 VAL  QG1     3.80            #peak   629 #SUP  0.98  #QF  0.98
 15 LYS  HB3    16 TYR  HN      3.90            #peak   630 #SUP  0.99  #QF  0.99
 15 LYS  HB3    24 VAL  QG1     3.80            #peak   635 #SUP  0.94  #QF  0.94
 49 SER  HA     49 SER  QB      2.74            #peak   637 #SUP  1.00
 49 SER  HA     51 PRO  HD3     4.49            #peak   638 #SUP  0.34  #QF  0.34
 39 GLU  HA     42 MET  HG2     4.39            #peak   639 #SUP  0.98  #QF  0.98
 39 GLU  HA     43 ALA  HN      4.36            #peak   643 #SUP  0.98  #QF  0.98
 38 CYSS HB2    39 GLU  HA      5.02            #peak   644 #SUP  0.98  #QF  0.98
 39 GLU  HA     39 GLU  HG2     3.51            #peak   646 #SUP  1.00
 39 GLU  HA     42 MET  HB2     4.08            #peak   648 #SUP  1.00
 39 GLU  HA     42 MET  QE      5.38            #peak   649 #SUP  0.97  #QF  0.97
 29 LYS  HG3    39 GLU  HA      3.92            #peak   650 #SUP  0.99  #QF  0.99
 59 SER  HA     60 ILE  QG2     5.39            #peak   651 #SUP  0.98  #QF  0.98
 53 CYSS HB2    59 SER  HA      5.50            #peak   656 #SUP  0.26  #QF  0.26
 52 LYS  HB3    59 SER  HA      4.21            #peak   658 #SUP  0.95  #QF  0.95
 59 SER  HA     60 ILE  HG13    3.89            #peak   659 #SUP  0.96  #QF  0.96
 52 LYS  HG2    59 SER  HA      4.75            #peak   660 #SUP  0.98  #QF  0.98
 59 SER  HA     60 ILE  HG12    4.66            #peak   661 #SUP  0.96  #QF  0.96
 20 LYS  HB3    37 PHE  QE      4.44            #peak   662 #SUP  0.99  #QF  0.99
 20 LYS  HB3    41 CYSS HB2     4.31            #peak   664 #SUP  0.99  #QF  0.99
 20 LYS  HB3    37 PHE  QD      4.08            #peak   673 #SUP  0.98  #QF  0.98
 20 LYS  HB3    41 CYSS HA      5.42            #peak   674 #SUP  0.90  #QF  0.90
 20 LYS  HB3    21 CYSS HB2     5.07            #peak   675 #SUP  0.99  #QF  0.99
 20 LYS  HB3    20 LYS  HD2     3.83            #peak   677 #SUP  0.99  #QF  0.99
 20 LYS  HB3    20 LYS  HD3     3.89            #peak   678 #SUP  1.00
 20 LYS  HB3    20 LYS  QE      4.53            #peak   680 #SUP  0.95  #QF  0.95
 19 GLU  HB2    35 HIST HB3     4.56            #peak   681 #SUP  0.97  #QF  0.97
 61 VAL  QG1    64 LYS  HB3     5.06            #peak   695 #SUP  0.90  #QF  0.87
 61 VAL  QG2    64 LYS  HB3     5.50            #peak   695 #SUP  0.90  #QF  0.87
 32 GLU  HG3    64 LYS  HB3     4.89            #peak   696 #SUP  0.98  #QF  0.98
 29 LYS  HB2    30 GLN  HN      4.34            #peak   700 #SUP  1.00
 29 LYS  HB2    37 PHE  HB2     4.50            #peak   702 #SUP  0.98  #QF  0.32
 29 LYS  HB2    42 MET  HG2     4.65            #peak   702 #SUP  0.98  #QF  0.32
 29 LYS  HB2    42 MET  HG3     4.73            #peak   703 #SUP  0.92  #QF  0.92
 29 LYS  HB2    42 MET  HB3     4.98            #peak   704 #SUP  1.00
 29 LYS  HB2    65 VAL  QG1     4.66            #peak   705 #SUP  1.00  #QF  0.99
 29 LYS  HB2    65 VAL  QG2     4.66            #peak   705 #SUP  1.00  #QF  0.99
 29 LYS  HN     29 LYS  HB2     3.64            #peak   706 #SUP  0.97  #QF  0.97
 10 LYS  HB2    10 LYS  QE      4.87            #peak   709 #SUP  0.58  #QF  0.58
 61 VAL  HN     64 LYS  HB2     4.57            #peak   710 #SUP  0.99  #QF  0.99
 61 VAL  QG1    64 LYS  HB2     4.04            #peak   712 #SUP  0.94  #QF  0.87
 61 VAL  QG2    64 LYS  HB2     4.44            #peak   712 #SUP  0.94  #QF  0.87
 32 GLU  QB     64 LYS  HB2     4.12            #peak   714 #SUP  0.90  #QF  0.90
 29 LYS  HN     29 LYS  HB3     3.95            #peak   717 #SUP  0.99  #QF  0.99
 32 GLU  HA     32 GLU  HG3     3.60            #peak   723 #SUP  0.98  #QF  0.98
 32 GLU  HA     32 GLU  HG2     3.60            #peak   724 #SUP  0.98  #QF  0.98
 32 GLU  HA     32 GLU  QB      2.71            #peak   725 #SUP  1.00
 35 HIST HN     35 HIST HB2     3.65            #peak   733 #SUP  0.99  #QF  0.99
 19 GLU  HG3    35 HIST HB2     3.97            #peak   738 #SUP  0.99  #QF  0.99
 19 GLU  HG2    35 HIST HB3     4.09            #peak   743 #SUP  1.00
 19 GLU  HG3    35 HIST HB3     3.70            #peak   744 #SUP  1.00
 31 THR  QG2    35 HIST HB3     4.57            #peak   745 #SUP  0.76  #QF  0.76
 35 HIST HN     35 HIST HB3     3.90            #peak   747 #SUP  0.98  #QF  0.98
 35 HIST HB3    37 PHE  QE      4.01            #peak   748 #SUP  1.00
 12 VAL  HB     13 GLU  HN      4.52            #peak   754 #SUP  0.99  #QF  0.99
 61 VAL  HB     62 LYS  HN      4.64            #peak   757 #SUP  0.99  #QF  0.99
 62 LYS  HN     65 VAL  HB      5.22            #peak   757 #SUP  0.99  #QF  0.99
 61 VAL  HB     64 LYS  HB2     3.37            #peak   759 #SUP  0.95  #QF  0.95
 61 VAL  HB     64 LYS  HN      4.33            #peak   762 #SUP  0.98  #QF  0.97
 62 LYS  HA     62 LYS  QB      2.99            #peak   769 #SUP  1.00
 10 LYS  HB3    10 LYS  QE      4.87            #peak   770 #SUP  1.00  #QF  0.75
 62 LYS  QB     62 LYS  QE      5.10            #peak   770 #SUP  1.00  #QF  0.75
 46 LEU  QD2    62 LYS  QB      3.90            #peak   772 #SUP  0.99  #QF  0.99
 61 VAL  QG1    62 LYS  QB      4.14            #peak   773 #SUP  0.78  #QF  0.78
 18 CYSS HA     20 LYS  HB2     5.42            #peak   776 #SUP  0.97  #QF  0.97
 18 CYSS HA     19 GLU  HN      2.91            #peak   777 #SUP  1.00  #QF  0.95
 18 CYSS HA     25 LEU  QD2     4.26            #peak   780 #SUP  0.99  #QF  0.99
 46 LEU  QD2    61 VAL  HB      5.11            #peak   781 #SUP  0.83  #QF  0.76
 46 LEU  QD2    65 VAL  HB      5.50            #peak   781 #SUP  0.83  #QF  0.76
 61 VAL  HB     64 LYS  HA      5.02            #peak   782 #SUP  0.98  #QF  0.98
 25 LEU  QD1    36 ARG  HB2     4.46            #peak   790 #SUP  0.98  #QF  0.98
 29 LYS  HN     36 ARG  HB3     4.28            #peak   791 #SUP  1.00  #QF  0.25
 25 LEU  QD1    36 ARG  HB3     4.20            #peak   799 #SUP  1.00
 18 CYSS HA     25 LEU  HG      4.92            #peak   800 #SUP  0.99  #QF  0.22
 18 CYSS HA     37 PHE  HN      4.58            #peak   803 #SUP  0.64  #QF  0.64
 18 CYSS HA     36 ARG  HB3     4.37            #peak   805 #SUP  0.62  #QF  0.62
 18 CYSS HA     25 LEU  QD1     3.91            #peak   806 #SUP  1.00
 28 PRO  QB     36 ARG  HD2     4.65            #peak   807 #SUP  0.77  #QF  0.77
 16 TYR  HB2    28 PRO  QB      4.52            #peak   808 #SUP  1.00  #QF  0.94
 28 PRO  QB     36 ARG  HD3     4.94            #peak   808 #SUP  1.00  #QF  0.94
 28 PRO  QB     29 LYS  HN      4.05            #peak   809 #SUP  1.00
 16 TYR  QD     28 PRO  QB      4.80            #peak   810 #SUP  1.00
 16 TYR  HB3    28 PRO  QB      4.82            #peak   814 #SUP  0.95  #QF  0.95
 28 PRO  QB     36 ARG  HB3     3.84            #peak   815 #SUP  0.93  #QF  0.93
 46 LEU  HB2    47 SER  HA      4.89            #peak   822 #SUP  0.97  #QF  0.97
 46 LEU  HB3    47 SER  HA      4.92            #peak   823 #SUP  1.00
 21 CYSS HB2    23 LEU  HB3     5.50            #peak   824 #SUP  0.98  #QF  0.98
 21 CYSS HB3    23 LEU  HG      5.30            #peak   825 #SUP  0.92  #QF  0.92
 21 CYSS HB3    23 LEU  HN      4.69            #peak   826 #SUP  0.95  #QF  0.95
 21 CYSS HB3    23 LEU  HB2     4.97            #peak   827 #SUP  0.79  #QF  0.79
 21 CYSS HB2    23 LEU  HN      4.48            #peak   831 #SUP  0.99  #QF  0.99
 21 CYSS HB2    23 LEU  HG      4.07            #peak   834 #SUP  0.96  #QF  0.96
 20 LYS  HG2    21 CYSS HB3     5.42            #peak   839 #SUP  0.98  #QF  0.98
 20 LYS  HB3    21 CYSS HB3     4.54            #peak   842 #SUP  0.96  #QF  0.96
 30 GLN  HB3    34 GLY  HN      5.50            #peak   848 #SUP  0.63  #QF  0.63
 29 LYS  HA     30 GLN  HB2     4.86            #peak   851 #SUP  0.78  #QF  0.78
 30 GLN  HB2    36 ARG  HG2     4.49            #peak   855 #SUP  0.99  #QF  0.99
 62 LYS  HA     65 VAL  HB      4.73            #peak   864 #SUP  0.96  #QF  0.96
 45 LEU  HA     47 SER  HN      4.59            #peak   866 #SUP  0.96  #QF  0.96
 45 LEU  HA     48 SER  HN      4.73            #peak   867 #SUP  0.70  #QF  0.70
 20 LYS  QE     45 LEU  HA      4.86            #peak   868 #SUP  0.98  #QF  0.98
 45 LEU  HA     45 LEU  HG      3.41            #peak   870 #SUP  1.00
 19 GLU  HA     22 HIST HN      4.53            #peak   874 #SUP  0.77  #QF  0.77
 19 GLU  HA     19 GLU  HG3     3.73            #peak   875 #SUP  0.96  #QF  0.96
 19 GLU  HA     55 ALA  QB      4.70            #peak   876 #SUP  0.95  #QF  0.95
 38 CYSS HB2    40 SER  QB      4.43            #peak   877 #SUP  0.99  #QF  0.99
 38 CYSS HB2    39 GLU  HB2     4.49            #peak   878 #SUP  0.84  #QF  0.84
 23 LEU  HB3    38 CYSS HB2     4.82            #peak   879 #SUP  0.92  #QF  0.92
 25 LEU  HG     38 CYSS HB2     5.50            #peak   880 #SUP  0.98  #QF  0.98
 25 LEU  HB3    38 CYSS HB2     5.22            #peak   881 #SUP  0.97  #QF  0.97
 38 CYSS HB3    40 SER  QB      5.33            #peak   883 #SUP  0.99  #QF  0.99
 18 CYSS HB2    38 CYSS HB3     3.58            #peak   886 #SUP  1.00
 23 LEU  QD2    38 CYSS HB3     4.95            #peak   887 #SUP  0.96  #QF  0.96
 42 MET  HN     42 MET  HG2     4.74            #peak   889 #SUP  0.99  #QF  0.99
 42 MET  HA     42 MET  HG2     4.16            #peak   890 #SUP  1.00
 42 MET  HG2    42 MET  QE      3.46            #peak   894 #SUP  0.99  #QF  0.99
 29 LYS  HB3    42 MET  HG2     4.09            #peak   895 #SUP  0.95  #QF  0.95
 29 LYS  HG3    42 MET  HG2     4.15            #peak   896 #SUP  0.94  #QF  0.94
 42 MET  HG2    46 LEU  QD2     4.97            #peak   898 #SUP  1.00
 51 PRO  HB3    60 ILE  HN      4.58            #peak   911 #SUP  1.00
 51 PRO  HB3    52 LYS  HN      4.23            #peak   912 #SUP  0.99  #QF  0.99
 51 PRO  HB3    60 ILE  HB      3.69            #peak   916 #SUP  1.00
 51 PRO  HB3    60 ILE  HG13    4.23            #peak   917 #SUP  1.00
 51 PRO  HB3    60 ILE  QD1     3.97            #peak   919 #SUP  1.00
 46 LEU  HA     51 PRO  HB2     3.70            #peak   920 #SUP  1.00
 51 PRO  HB2    60 ILE  HB      3.49            #peak   924 #SUP  1.00
 51 PRO  HB2    60 ILE  HG13    4.21            #peak   925 #SUP  1.00
 46 LEU  QD2    51 PRO  HB2     3.56            #peak   926 #SUP  0.98  #QF  0.98
 53 CYSS HN     57 GLN  HA      4.21            #peak   928 #SUP  1.00
 57 GLN  HA     58 GLU  HN      3.16            #peak   929 #SUP  0.99  #QF  0.96
 53 CYSS HB2    57 GLN  HA      4.42            #peak   931 #SUP  0.70  #QF  0.70
 57 GLN  HA     57 GLN  HG3     4.01            #peak   933 #SUP  1.00
 52 LYS  HD3    57 GLN  HA      4.44            #peak   934 #SUP  0.99  #QF  0.99
 52 LYS  HB2    57 GLN  HA      3.31            #peak   935 #SUP  0.96  #QF  0.96
 52 LYS  HB3    57 GLN  HA      3.71            #peak   937 #SUP  0.98  #QF  0.96
 44 ALA  QB     45 LEU  HA      3.93            #peak   938 #SUP  0.99  #QF  0.99
 18 CYSS HA     19 GLU  HA      4.52            #peak   939 #SUP  0.98  #QF  0.98
 19 GLU  HA     22 HIST HD2     4.45            #peak   942 #SUP  0.95  #QF  0.95
 19 GLU  HA     19 GLU  HG2     3.71            #peak   944 #SUP  1.00
 38 CYSS HN     38 CYSS HB2     3.80            #peak   947 #SUP  1.00
 23 LEU  HB2    38 CYSS HB2     4.80            #peak   955 #SUP  0.99  #QF  0.99
 38 CYSS HB3    39 GLU  HN      4.04            #peak   956 #SUP  1.00
 18 CYSS HN     38 CYSS HB3     4.79            #peak   957 #SUP  0.99  #QF  0.99
 38 CYSS HB3    40 SER  HN      5.07            #peak   958 #SUP  0.99  #QF  0.99
 25 LEU  HG     38 CYSS HB3     4.79            #peak   960 #SUP  0.90  #QF  0.90
 23 LEU  HB3    38 CYSS HB3     4.71            #peak   961 #SUP  0.95  #QF  0.95
 24 VAL  HB     25 LEU  HN      4.50            #peak   962 #SUP  0.99  #QF  0.99
 23 LEU  HA     24 VAL  HB      5.18            #peak   964 #SUP  0.98  #QF  0.90
 51 PRO  HB2    59 SER  HA      5.50            #peak   964 #SUP  0.98  #QF  0.90
 18 CYSS HB3    38 CYSS HN      4.09            #peak   970 #SUP  1.00
 18 CYSS HN     18 CYSS HB3     3.13            #peak   971 #SUP  0.99  #QF  0.99
 18 CYSS HB3    23 LEU  HN      3.31            #peak   973 #SUP  0.98  #QF  0.98
 18 CYSS HB3    37 PHE  HA      4.69            #peak   975 #SUP  0.99  #QF  0.99
 18 CYSS HB3    22 HIST HA      3.98            #peak   976 #SUP  0.99  #QF  0.99
 18 CYSS HB3    38 CYSS HB3     3.85            #peak   978 #SUP  0.98  #QF  0.98
 18 CYSS HB3    23 LEU  HB3     4.23            #peak   980 #SUP  1.00
 18 CYSS HB3    23 LEU  HG      4.93            #peak   981 #SUP  1.00
 18 CYSS HB3    25 LEU  HG      5.50            #peak   982 #SUP  1.00  #QF  0.24
 18 CYSS HB3    25 LEU  QD2     3.74            #peak   983 #SUP  1.00
 18 CYSS HB3    20 LYS  HN      4.48            #peak   984 #SUP  0.96  #QF  0.96
 18 CYSS HB2    20 LYS  HN      4.87            #peak   985 #SUP  1.00
 18 CYSS HB2    23 LEU  HB3     4.38            #peak   986 #SUP  1.00
 18 CYSS HN     18 CYSS HB2     3.14            #peak   988 #SUP  0.99  #QF  0.99
 18 CYSS HB2    21 CYSS HN      4.35            #peak   989 #SUP  1.00
 18 CYSS HB2    23 LEU  HN      3.59            #peak   990 #SUP  0.98  #QF  0.98
 18 CYSS HB2    22 HIST HN      4.63            #peak   991 #SUP  0.99  #QF  0.99
 18 CYSS HB2    22 HIST HA      5.26            #peak   993 #SUP  1.00
 18 CYSS HB2    23 LEU  HB2     4.14            #peak   997 #SUP  1.00
 52 LYS  HB2    53 CYSS HB3     4.12            #peak  1002 #SUP  0.91  #QF  0.91
 53 CYSS HB3    60 ILE  QD1     4.38            #peak  1003 #SUP  1.00
 53 CYSS HB2    60 ILE  QG2     4.14            #peak  1005 #SUP  1.00
 53 CYSS HB2    58 GLU  HN      3.47            #peak  1006 #SUP  0.98  #QF  0.98
 53 CYSS HB3    58 GLU  HB3     4.98            #peak  1018 #SUP  0.99  #QF  0.99
 53 CYSS HB3    57 GLN  HN      3.62            #peak  1019 #SUP  1.00  #QF  0.90
 53 CYSS HB3    57 GLN  HA      4.12            #peak  1020 #SUP  0.99  #QF  0.99
 53 CYSS HB3    60 ILE  QG2     5.50            #peak  1023 #SUP  0.99  #QF  0.99
 31 THR  QG2    53 CYSS HB2     3.95            #peak  1027 #SUP  0.98  #QF  0.94
 29 LYS  HG3    42 MET  HB2     4.89            #peak  1039 #SUP  0.96  #QF  0.96
 21 CYSS HN     22 HIST HA      4.77            #peak  1049 #SUP  0.92  #QF  0.92
 58 GLU  HA     59 SER  QB      4.26            #peak  1053 #SUP  0.99  #QF  0.99
 58 GLU  HA     58 GLU  QG      3.33            #peak  1054 #SUP  0.98  #QF  0.98
 58 GLU  HA     59 SER  HA      4.85            #peak  1056 #SUP  1.00
 42 MET  HA     46 LEU  QD1     4.69            #peak  1057 #SUP  0.97  #QF  0.97
 42 MET  HA     45 LEU  HN      3.89            #peak  1062 #SUP  1.00
 37 PHE  HB3    42 MET  HA      4.32            #peak  1065 #SUP  0.99  #QF  0.99
 37 PHE  HB2    42 MET  HA      3.69            #peak  1066 #SUP  0.92  #QF  0.92
 42 MET  HA     42 MET  HG3     3.72            #peak  1067 #SUP  1.00
 42 MET  HA     45 LEU  HG      3.92            #peak  1071 #SUP  1.00
 42 MET  HA     44 ALA  QB      4.84            #peak  1072 #SUP  0.98  #QF  0.98
 31 THR  QG2    42 MET  HA      5.29            #peak  1073 #SUP  1.00
 42 MET  HA     45 LEU  QD2     5.50            #peak  1075 #SUP  1.00  #QF  0.95
 42 MET  HA     46 LEU  QD2     5.50            #peak  1075 #SUP  1.00  #QF  0.95
 42 MET  HA     44 ALA  HN      4.76            #peak  1077 #SUP  0.97  #QF  0.97
 58 GLU  HB3    58 GLU  QG      2.98            #peak  1083 #SUP  1.00
 58 GLU  HB2    59 SER  HN      4.16            #peak  1084 #SUP  0.99  #QF  0.99
 58 GLU  HN     58 GLU  HB2     3.61            #peak  1085 #SUP  1.00
 33 CYSS HA     58 GLU  HB2     5.16            #peak  1086 #SUP  0.99  #QF  0.99
 33 CYSS HB2    58 GLU  HB2     4.01            #peak  1089 #SUP  1.00
 53 CYSS HB3    58 GLU  HB2     4.98            #peak  1090 #SUP  1.00
 33 CYSS HB3    58 GLU  HB2     3.83            #peak  1092 #SUP  1.00
 58 GLU  HB2    58 GLU  QG      2.98            #peak  1093 #SUP  0.99  #QF  0.99
 46 LEU  HA     51 PRO  HA      4.91            #peak  1104 #SUP  0.95  #QF  0.95
 46 LEU  HA     61 VAL  QG2     5.41            #peak  1107 #SUP  0.93  #QF  0.93
 46 LEU  HA     51 PRO  HB3     3.34            #peak  1111 #SUP  1.00
 46 LEU  HA     46 LEU  QD1     4.10            #peak  1114 #SUP  1.00
 33 CYSS HB3    58 GLU  HA      4.98            #peak  1119 #SUP  0.82  #QF  0.82
 13 GLU  HA     14 ASP  QB      4.58            #peak  1122 #SUP  0.98  #QF  0.98
 13 GLU  HA     13 GLU  QG      3.41            #peak  1123 #SUP  0.99  #QF  0.99
 11 THR  QG2    13 GLU  HA      5.50            #peak  1126 #SUP  0.60  #QF  0.60
 45 LEU  HB3    46 LEU  HA      4.80            #peak  1128 #SUP  0.88  #QF  0.88
 33 CYSS HB2    35 HIST HN      5.18            #peak  1129 #SUP  0.99  #QF  0.98
 33 CYSS HA     33 CYSS HB2     3.02            #peak  1130 #SUP  0.99  #QF  0.99
 33 CYSS HB2    58 GLU  QG      3.83            #peak  1132 #SUP  0.99  #QF  0.99
 33 CYSS HB2    58 GLU  HB3     4.01            #peak  1133 #SUP  0.76  #QF  0.76
 38 CYSS HN     41 CYSS HB2     3.81            #peak  1134 #SUP  0.95  #QF  0.95
 41 CYSS HN     41 CYSS HB2     3.39            #peak  1135 #SUP  0.98  #QF  0.98
 37 PHE  QD     41 CYSS HB2     3.92            #peak  1137 #SUP  1.00
 37 PHE  HA     41 CYSS HB2     4.70            #peak  1138 #SUP  0.94  #QF  0.94
 38 CYSS HB3    41 CYSS HB2     4.67            #peak  1140 #SUP  0.78  #QF  0.78
 20 LYS  HD2    41 CYSS HB2     3.89            #peak  1142 #SUP  1.00
 20 LYS  HB2    41 CYSS HB2     4.13            #peak  1145 #SUP  1.00
 37 PHE  HA     41 CYSS HB3     5.27            #peak  1147 #SUP  0.97  #QF  0.97
 41 CYSS HN     41 CYSS HB3     3.80            #peak  1148 #SUP  1.00
 21 CYSS HN     41 CYSS HB3     5.19            #peak  1150 #SUP  0.95  #QF  0.95
 20 LYS  HB2    41 CYSS HB3     3.83            #peak  1155 #SUP  1.00
 41 CYSS HB3    44 ALA  QB      4.26            #peak  1158 #SUP  1.00
 38 CYSS HN     41 CYSS HB3     4.16            #peak  1160 #SUP  0.98  #QF  0.98
 41 CYSS HB3    44 ALA  HN      5.46            #peak  1161 #SUP  1.00
 20 LYS  HA     41 CYSS HB3     5.50            #peak  1162 #SUP  0.80  #QF  0.80
 20 LYS  QE     41 CYSS HB3     4.24            #peak  1163 #SUP  0.95  #QF  0.95
 33 CYSS HA     33 CYSS HB3     2.96            #peak  1167 #SUP  1.00
 33 CYSS HB3    58 GLU  QG      3.66            #peak  1169 #SUP  1.00
 33 CYSS HB3    58 GLU  HB3     3.83            #peak  1170 #SUP  0.62  #QF  0.62
 32 GLU  QB     33 CYSS HA      4.66            #peak  1172 #SUP  0.99  #QF  0.99
 32 GLU  HN     32 GLU  QB      3.37            #peak  1173 #SUP  0.99  #QF  0.99
 32 GLU  QB     34 GLY  HN      5.25            #peak  1174 #SUP  1.00
 32 GLU  QB     33 CYSS HN      3.59            #peak  1175 #SUP  0.98  #QF  0.98
 29 LYS  QE     39 GLU  HB2     4.99            #peak  1178 #SUP  0.42  #QF  0.42
 32 GLU  QB     33 CYSS HB3     4.89            #peak  1179 #SUP  0.96  #QF  0.96
 32 GLU  QB     32 GLU  HG2     2.87            #peak  1180 #SUP  0.99  #QF  0.99
 32 GLU  QB     64 LYS  HB3     3.88            #peak  1181 #SUP  0.92  #QF  0.92
 32 GLU  QB     61 VAL  QG2     4.95            #peak  1184 #SUP  0.39  #QF  0.39
 10 LYS  HA     10 LYS  HG2     4.12            #peak  1188 #SUP  0.92  #QF  0.92
 39 GLU  HB2    40 SER  HN      3.93            #peak  1191 #SUP  0.99  #QF  0.99
 39 GLU  HN     39 GLU  HB3     3.67            #peak  1193 #SUP  0.99  #QF  0.99
 39 GLU  HB3    39 GLU  HG2     2.83            #peak  1196 #SUP  0.97  #QF  0.97
 39 GLU  HB3    43 ALA  QB      4.57            #peak  1197 #SUP  0.79  #QF  0.79
 38 CYSS HB2    39 GLU  HB3     5.50            #peak  1198 #SUP  0.99  #QF  0.99
 29 LYS  QE     39 GLU  HB3     5.00            #peak  1199 #SUP  0.98  #QF  0.98
 10 LYS  QD     11 THR  HN      5.50            #peak  1200 #SUP  0.97  #QF  0.51
 62 LYS  QD     63 ASP  HN      5.50            #peak  1200 #SUP  0.97  #QF  0.51
 62 LYS  HA     62 LYS  QD      4.46            #peak  1201 #SUP  0.99  #QF  0.99
 46 LEU  QD1    62 LYS  QD      4.32            #peak  1202 #SUP  0.97  #QF  0.97
 17 LYS  HN     17 LYS  HD3     5.50            #peak  1203 #SUP  1.00
 17 LYS  HD3    22 HIST HA      4.42            #peak  1204 #SUP  0.99  #QF  0.99
 17 LYS  HD3    22 HIST HB3     4.44            #peak  1205 #SUP  0.99  #QF  0.99
 17 LYS  HD2    22 HIST HA      4.42            #peak  1207 #SUP  0.97  #QF  0.97
 17 LYS  HN     17 LYS  HD2     5.50            #peak  1209 #SUP  1.00  #QF  0.29
 10 LYS  HA     10 LYS  QD      4.40            #peak  1212 #SUP  0.92  #QF  0.92
 15 LYS  QD     24 VAL  QG2     4.26            #peak  1216 #SUP  0.59  #QF  0.59
 15 LYS  QD     24 VAL  HB      5.28            #peak  1219 #SUP  0.58  #QF  0.58
 14 ASP  HA     15 LYS  QD      4.56            #peak  1221 #SUP  0.88  #QF  0.88
 19 GLU  HB3    35 HIST HB3     4.83            #peak  1226 #SUP  0.91  #QF  0.91
 15 LYS  HA     16 TYR  HB2     5.17            #peak  1228 #SUP  1.00
 15 LYS  HA     26 CYSS HA      3.94            #peak  1232 #SUP  0.43  #QF  0.43
 20 LYS  HD2    37 PHE  QE      4.91            #peak  1236 #SUP  1.00
 20 LYS  HD2    21 CYSS HN      5.18            #peak  1237 #SUP  0.97  #QF  0.97
 20 LYS  HA     20 LYS  HD2     4.40            #peak  1239 #SUP  0.98  #QF  0.98
 20 LYS  HD2    41 CYSS HA      4.44            #peak  1240 #SUP  0.99  #QF  0.99
 20 LYS  HD2    41 CYSS HB3     3.41            #peak  1242 #SUP  0.98  #QF  0.65
 20 LYS  HB2    20 LYS  HD2     3.73            #peak  1243 #SUP  0.99  #QF  0.99
 20 LYS  HD2    45 LEU  QD2     4.35            #peak  1247 #SUP  0.95  #QF  0.95
 20 LYS  HD2    45 LEU  QD1     4.69            #peak  1248 #SUP  0.95  #QF  0.95
 19 GLU  HN     19 GLU  HB2     3.69            #peak  1249 #SUP  1.00
 18 CYSS HA     19 GLU  HB2     4.43            #peak  1250 #SUP  0.90  #QF  0.90
 20 LYS  HB2    20 LYS  HD3     3.80            #peak  1255 #SUP  1.00  #QF  0.99
 19 GLU  HB2    37 PHE  QD      5.01            #peak  1256 #SUP  0.96  #QF  0.54
 20 LYS  HD3    37 PHE  QD      5.50            #peak  1256 #SUP  0.96  #QF  0.54
 20 LYS  HD3    45 LEU  QD1     4.41            #peak  1258 #SUP  0.98  #QF  0.98
 20 LYS  HA     20 LYS  HD3     4.68            #peak  1259 #SUP  0.96  #QF  0.96
 20 LYS  HD3    41 CYSS HB2     4.50            #peak  1260 #SUP  0.95  #QF  0.95
 20 LYS  HD3    41 CYSS HB3     3.66            #peak  1261 #SUP  0.96  #QF  0.85
 20 LYS  HD3    45 LEU  QD2     3.87            #peak  1263 #SUP  0.99  #QF  0.99
 52 LYS  HN     52 LYS  HD3     4.94            #peak  1266 #SUP  0.93  #QF  0.93
 15 LYS  HA     15 LYS  QD      4.26            #peak  1269 #SUP  0.97  #QF  0.97
 52 LYS  HN     52 LYS  HD2     4.94            #peak  1270 #SUP  0.88  #QF  0.88
 52 LYS  HD2    57 GLN  HA      4.44            #peak  1271 #SUP  0.99  #QF  0.99
 19 GLU  HB3    55 ALA  HN      5.27            #peak  1273 #SUP  1.00
 19 GLU  HB3    54 THR  HB      4.79            #peak  1274 #SUP  0.92  #QF  0.92
 19 GLU  HN     19 GLU  HB3     3.57            #peak  1275 #SUP  0.99  #QF  0.99
 19 GLU  HB3    37 PHE  QE      4.09            #peak  1276 #SUP  1.00
 19 GLU  HB3    37 PHE  HZ      4.45            #peak  1281 #SUP  0.97  #QF  0.97
 23 LEU  HA     24 VAL  HN      3.11            #peak  1283 #SUP  1.00
 64 LYS  HA     64 LYS  QE      4.84            #peak  1288 #SUP  0.92  #QF  0.92
 61 VAL  QG1    64 LYS  HA      4.46            #peak  1295 #SUP  0.58  #QF  0.58
 61 VAL  HB     64 LYS  HD2     4.93            #peak  1298 #SUP  0.99  #QF  0.99
 61 VAL  QG1    64 LYS  HD2     5.18            #peak  1299 #SUP  1.00
 64 LYS  HA     64 LYS  HD2     4.11            #peak  1300 #SUP  0.99  #QF  0.99
 64 LYS  HA     64 LYS  HD3     4.11            #peak  1302 #SUP  0.99  #QF  0.99
 61 VAL  HB     64 LYS  HD3     4.93            #peak  1303 #SUP  0.99  #QF  0.99
 61 VAL  QG1    64 LYS  HD3     5.18            #peak  1305 #SUP  1.00  #QF  0.98
 42 MET  HB3    43 ALA  HA      4.58            #peak  1306 #SUP  0.83  #QF  0.83
 36 ARG  HG3    37 PHE  HN      4.86            #peak  1307 #SUP  0.99  #QF  0.99
 42 MET  HN     43 ALA  HA      5.50            #peak  1309 #SUP  1.00
 43 ALA  HA     46 LEU  HN      4.16            #peak  1310 #SUP  0.95  #QF  0.95
 43 ALA  HA     47 SER  HN      4.63            #peak  1313 #SUP  0.99  #QF  0.99
 42 MET  HG3    43 ALA  HA      4.36            #peak  1314 #SUP  0.99  #QF  0.99
 43 ALA  HA     46 LEU  HB2     3.23            #peak  1315 #SUP  0.94  #QF  0.94
 43 ALA  HA     46 LEU  QD2     5.01            #peak  1318 #SUP  0.99  #QF  0.99
 29 LYS  HA     29 LYS  HD2     3.88            #peak  1321 #SUP  0.96  #QF  0.96
 29 LYS  HA     29 LYS  HD3     3.88            #peak  1325 #SUP  0.97  #QF  0.97
 30 GLN  HG3    36 ARG  HG3     4.54            #peak  1330 #SUP  1.00
 28 PRO  QB     36 ARG  HG3     4.73            #peak  1332 #SUP  0.97  #QF  0.95
 28 PRO  HG3    36 ARG  HG3     5.22            #peak  1332 #SUP  0.97  #QF  0.95
 30 GLN  HG3    36 ARG  HG2     4.31            #peak  1338 #SUP  1.00
 28 PRO  QB     36 ARG  HG2     4.51            #peak  1339 #SUP  1.00
 28 PRO  HG3    36 ARG  HG2     5.04            #peak  1339 #SUP  1.00
 30 GLN  HA     36 ARG  HG2     4.28            #peak  1341 #SUP  0.98  #QF  0.98
 36 ARG  HA     36 ARG  HG2     3.74            #peak  1342 #SUP  0.99  #QF  0.99
 43 ALA  HN     44 ALA  HA      5.37            #peak  1349 #SUP  0.99  #QF  0.99
 44 ALA  HA     47 SER  HN      3.95            #peak  1351 #SUP  0.66  #QF  0.66
 44 ALA  HA     46 LEU  HB2     5.50            #peak  1353 #SUP  0.81  #QF  0.81
 51 PRO  HG2    52 LYS  HN      5.00            #peak  1367 #SUP  1.00
 51 PRO  HG2    60 ILE  QD1     4.78            #peak  1368 #SUP  0.99  #QF  0.99
 51 PRO  HG2    60 ILE  HB      4.03            #peak  1369 #SUP  1.00
 50 SER  HN     51 PRO  HG3     5.50            #peak  1370 #SUP  0.89  #QF  0.89
 51 PRO  HG3    60 ILE  QD1     4.84            #peak  1371 #SUP  0.96  #QF  0.96
 54 THR  QG2    55 ALA  HA      4.47            #peak  1374 #SUP  1.00
 51 PRO  HG2    60 ILE  HG13    4.51            #peak  1376 #SUP  0.67  #QF  0.67
 50 SER  HA     51 PRO  HG2     4.33            #peak  1377 #SUP  0.99  #QF  0.99
 46 LEU  HA     51 PRO  HG2     3.70            #peak  1379 #SUP  0.95  #QF  0.95
 51 PRO  HG2    61 VAL  QG2     4.42            #peak  1381 #SUP  0.98  #QF  0.98
 46 LEU  QD2    51 PRO  HG2     3.68            #peak  1382 #SUP  0.99  #QF  0.99
 51 PRO  HG2    60 ILE  HN      4.87            #peak  1383 #SUP  1.00
 46 LEU  HA     51 PRO  HG3     3.54            #peak  1385 #SUP  0.99  #QF  0.99
 46 LEU  HB3    51 PRO  HG3     4.28            #peak  1387 #SUP  1.00  #QF  0.78
 51 PRO  HG3    61 VAL  QG2     4.41            #peak  1388 #SUP  0.98  #QF  0.98
 50 SER  HA     51 PRO  HG3     4.76            #peak  1389 #SUP  1.00
 51 PRO  HG3    60 ILE  HG13    5.41            #peak  1390 #SUP  0.98  #QF  0.98
 53 CYSS HA     60 ILE  HG13    4.50            #peak  1392 #SUP  0.94  #QF  0.94
 53 CYSS HB2    60 ILE  HG13    4.65            #peak  1393 #SUP  0.94  #QF  0.94
 60 ILE  QG2    60 ILE  HG13    3.57            #peak  1395 #SUP  0.99  #QF  0.99
 51 PRO  HB3    60 ILE  HG12    5.50            #peak  1396 #SUP  0.75  #QF  0.75
 52 LYS  HN     60 ILE  HG12    4.84            #peak  1397 #SUP  0.95  #QF  0.93
 58 GLU  HN     60 ILE  HG12    5.26            #peak  1397 #SUP  0.95  #QF  0.93
 42 MET  QE     60 ILE  HG12    4.76            #peak  1399 #SUP  0.93  #QF  0.93
 53 CYSS HB3    60 ILE  HG13    4.83            #peak  1402 #SUP  0.78  #QF  0.78
 53 CYSS HN     60 ILE  HG13    4.26            #peak  1403 #SUP  0.99  #QF  0.99
 60 ILE  HA     60 ILE  HG13    3.74            #peak  1406 #SUP  1.00
 51 PRO  HB2    60 ILE  HG12    4.39            #peak  1414 #SUP  0.94  #QF  0.94
 53 CYSS HB2    60 ILE  HG12    4.83            #peak  1418 #SUP  0.99  #QF  0.99
 22 HIST HB2    23 LEU  HN      5.50            #peak  1423 #SUP  1.00  #QF  0.46
 22 HIST HB3    23 LEU  HN      4.83            #peak  1426 #SUP  0.98  #QF  0.98
 22 HIST HN     22 HIST HB3     4.03            #peak  1427 #SUP  0.99  #QF  0.99
 17 LYS  HB3    22 HIST HB3     5.50            #peak  1432 #SUP  0.99  #QF  0.99
 17 LYS  HG3    22 HIST HB3     4.94            #peak  1433 #SUP  0.86  #QF  0.86
 28 PRO  HG3    29 LYS  HN      4.66            #peak  1435 #SUP  0.77  #QF  0.77
 28 PRO  HG3    36 ARG  HB3     4.12            #peak  1439 #SUP  0.88  #QF  0.88
 16 TYR  HN     28 PRO  HG3     5.50            #peak  1440 #SUP  0.85  #QF  0.78
 21 CYSS HN     23 LEU  HG      5.50            #peak  1440 #SUP  0.85  #QF  0.78
 23 LEU  HA     23 LEU  HG      3.71            #peak  1441 #SUP  0.67  #QF  0.67
 23 LEU  HG     25 LEU  QD2     4.60            #peak  1444 #SUP  0.99  #QF  0.99
 25 LEU  QD1    28 PRO  HG3     4.16            #peak  1445 #SUP  0.95  #QF  0.95
 23 LEU  HN     23 LEU  HG      3.80            #peak  1446 #SUP  0.95  #QF  0.95
 16 TYR  HB3    28 PRO  HG2     4.54            #peak  1453 #SUP  0.99  #QF  0.99
 28 PRO  HG2    36 ARG  HD3     4.16            #peak  1454 #SUP  0.99  #QF  0.82
 28 PRO  HG2    36 ARG  HB3     4.31            #peak  1456 #SUP  0.89  #QF  0.89
 20 LYS  QE     45 LEU  HG      4.52            #peak  1459 #SUP  0.99  #QF  0.99
 44 ALA  QB     45 LEU  HG      3.68            #peak  1460 #SUP  0.93  #QF  0.93
 25 LEU  HA     25 LEU  HG      4.21            #peak  1465 #SUP  1.00
 18 CYSS HN     25 LEU  HG      4.46            #peak  1467 #SUP  0.99  #QF  0.99
 18 CYSS HB2    25 LEU  HG      4.83            #peak  1470 #SUP  0.94  #QF  0.94
 18 CYSS HN     25 LEU  QD1     4.05            #peak  1474 #SUP  1.00  #QF  0.99
 25 LEU  QD1    29 LYS  HN      4.43            #peak  1474 #SUP  1.00  #QF  0.99
 25 LEU  HN     25 LEU  QD1     3.81            #peak  1475 #SUP  0.99  #QF  0.99
 24 VAL  HA     25 LEU  QD1     5.12            #peak  1478 #SUP  0.99  #QF  0.99
 25 LEU  QD1    38 CYSS HB3     3.60            #peak  1480 #SUP  0.99  #QF  0.99
 18 CYSS HB2    25 LEU  QD1     4.04            #peak  1481 #SUP  1.00
 23 LEU  HB3    25 LEU  QD1     4.43            #peak  1482 #SUP  1.00
 25 LEU  QD1    28 PRO  QB      3.57            #peak  1483 #SUP  0.99  #QF  0.93
 25 LEU  HB2    25 LEU  QD1     2.98            #peak  1484 #SUP  0.99  #QF  0.99
 25 LEU  HB3    25 LEU  QD1     3.00            #peak  1486 #SUP  0.99  #QF  0.99
 25 LEU  QD1    38 CYSS HN      4.49            #peak  1487 #SUP  1.00
 17 LYS  HN     25 LEU  QD1     4.44            #peak  1488 #SUP  0.98  #QF  0.98
 25 LEU  HA     25 LEU  QD1     4.34            #peak  1490 #SUP  0.99  #QF  0.99
 16 TYR  HB2    25 LEU  QD1     3.96            #peak  1491 #SUP  1.00
 42 MET  HA     46 LEU  HG      4.87            #peak  1493 #SUP  0.97  #QF  0.97
 46 LEU  HA     46 LEU  HG      3.54            #peak  1494 #SUP  0.99  #QF  0.99
 42 MET  HG3    46 LEU  HG      3.99            #peak  1495 #SUP  0.99  #QF  0.99
 46 LEU  HG     60 ILE  QD1     4.88            #peak  1499 #SUP  0.99  #QF  0.99
 41 CYSS HB3    45 LEU  HG      4.88            #peak  1500 #SUP  0.98  #QF  0.98
 45 LEU  HN     45 LEU  HG      3.23            #peak  1501 #SUP  1.00
 57 GLN  HB2    58 GLU  HN      4.87            #peak  1507 #SUP  0.99  #QF  0.98
 57 GLN  HB3    58 GLU  HN      4.87            #peak  1508 #SUP  0.98  #QF  0.97
 20 LYS  HA     20 LYS  HG2     3.82            #peak  1513 #SUP  0.99  #QF  0.99
 20 LYS  HG2    41 CYSS HB2     5.50            #peak  1520 #SUP  0.99  #QF  0.99
 20 LYS  HG2    45 LEU  QD2     5.22            #peak  1521 #SUP  0.71  #QF  0.71
 20 LYS  HA     20 LYS  HG3     3.41            #peak  1523 #SUP  0.99  #QF  0.99
 20 LYS  HG3    45 LEU  QD2     4.91            #peak  1529 #SUP  1.00
 20 LYS  HG3    21 CYSS HN      4.84            #peak  1530 #SUP  1.00
 42 MET  HB3    46 LEU  QD1     4.39            #peak  1532 #SUP  1.00
 43 ALA  HA     46 LEU  QD1     3.42            #peak  1535 #SUP  1.00  #QF  0.99
 46 LEU  QD1    62 LYS  QE      4.82            #peak  1536 #SUP  0.99  #QF  0.99
 42 MET  HG3    46 LEU  QD1     3.30            #peak  1538 #SUP  1.00
 46 LEU  HB3    46 LEU  QD1     2.97            #peak  1540 #SUP  0.99  #QF  0.99
 62 LYS  HG2    63 ASP  HN      4.82            #peak  1542 #SUP  0.99  #QF  0.92
 62 LYS  HA     62 LYS  HG2     4.01            #peak  1544 #SUP  0.99  #QF  0.99
 10 LYS  HA     10 LYS  HG3     4.12            #peak  1546 #SUP  0.80  #QF  0.80
 15 LYS  HG3    16 TYR  HN      4.93            #peak  1547 #SUP  1.00
 17 LYS  HG2    18 CYSS HN      4.54            #peak  1549 #SUP  0.97  #QF  0.97
 17 LYS  HG2    23 LEU  HN      5.31            #peak  1550 #SUP  1.00
 17 LYS  HG2    24 VAL  HA      4.10            #peak  1551 #SUP  0.30  #QF  0.30
 52 LYS  HG2    57 GLN  HA      4.89            #peak  1558 #SUP  1.00
 17 LYS  HG3    18 CYSS HN      4.38            #peak  1559 #SUP  1.00
 17 LYS  HG3    23 LEU  HN      4.22            #peak  1560 #SUP  0.96  #QF  0.96
 17 LYS  HG3    22 HIST HA      4.11            #peak  1561 #SUP  1.00
 17 LYS  HG3    24 VAL  HA      4.26            #peak  1562 #SUP  1.00
 23 LEU  HA     23 LEU  QD1     3.73            #peak  1564 #SUP  1.00
 23 LEU  QD1    38 CYSS HB2     5.50            #peak  1566 #SUP  0.97  #QF  0.97
 23 LEU  QD1    38 CYSS HB3     4.95            #peak  1568 #SUP  0.97  #QF  0.97
 23 LEU  HB3    23 LEU  QD1     3.15            #peak  1570 #SUP  1.00
 62 LYS  HA     62 LYS  HG3     4.01            #peak  1576 #SUP  1.00
 62 LYS  HN     62 LYS  HG3     4.62            #peak  1579 #SUP  0.97  #QF  0.97
 10 LYS  HG3    10 LYS  QE      3.79            #peak  1581 #SUP  1.00  #QF  0.92
 62 LYS  HG3    62 LYS  QE      4.05            #peak  1581 #SUP  1.00  #QF  0.92
 46 LEU  QD1    62 LYS  HG3     4.80            #peak  1582 #SUP  0.99  #QF  0.99
 61 VAL  HB     64 LYS  HG2     3.99            #peak  1584 #SUP  1.00
 61 VAL  QG1    64 LYS  HG2     4.01            #peak  1585 #SUP  1.00  #QF  0.43
 64 LYS  HA     64 LYS  HG2     3.90            #peak  1587 #SUP  1.00
 52 LYS  HG3    53 CYSS HN      4.85            #peak  1590 #SUP  0.99  #QF  0.99
 52 LYS  HN     52 LYS  HG3     4.34            #peak  1591 #SUP  0.98  #QF  0.98
 52 LYS  HG3    59 SER  HA      4.75            #peak  1592 #SUP  0.89  #QF  0.89
 52 LYS  HG3    57 GLN  HA      4.89            #peak  1593 #SUP  0.99  #QF  0.99
 61 VAL  HB     64 LYS  HG3     3.99            #peak  1594 #SUP  1.00
 61 VAL  QG1    64 LYS  HG3     4.01            #peak  1597 #SUP  0.93  #QF  0.85
 15 LYS  HN     15 LYS  HG3     4.39            #peak  1599 #SUP  0.98  #QF  0.98
 64 LYS  HA     64 LYS  HG3     3.90            #peak  1600 #SUP  0.98  #QF  0.98
 18 CYSS HB3    23 LEU  QD1     5.34            #peak  1605 #SUP  0.94  #QF  0.94
 29 LYS  HG2    39 GLU  HA      4.44            #peak  1606 #SUP  0.99  #QF  0.99
 29 LYS  HG2    42 MET  HG2     4.31            #peak  1607 #SUP  1.00
 29 LYS  HG2    39 GLU  HN      5.50            #peak  1608 #SUP  0.97  #QF  0.80
 29 LYS  HN     29 LYS  HG2     4.31            #peak  1609 #SUP  0.98  #QF  0.98
 29 LYS  HG3    42 MET  HG3     4.48            #peak  1610 #SUP  0.98  #QF  0.98
 29 LYS  HA     29 LYS  HG3     4.12            #peak  1611 #SUP  0.99  #QF  0.99
 42 MET  HN     45 LEU  QD1     5.02            #peak  1612 #SUP  0.81  #QF  0.81
 45 LEU  HN     45 LEU  QD1     3.84            #peak  1613 #SUP  1.00
 45 LEU  QD1    52 LYS  HN      4.54            #peak  1614 #SUP  0.95  #QF  0.95
 37 PHE  HZ     45 LEU  QD1     4.27            #peak  1615 #SUP  1.00
 37 PHE  QE     45 LEU  QD1     3.82            #peak  1616 #SUP  1.00
 37 PHE  QD     45 LEU  QD1     3.82            #peak  1617 #SUP  1.00
 45 LEU  QD1    54 THR  HN      4.66            #peak  1618 #SUP  1.00
 42 MET  HA     45 LEU  QD1     3.46            #peak  1619 #SUP  1.00
 45 LEU  HA     45 LEU  QD1     4.09            #peak  1620 #SUP  0.99  #QF  0.99
 45 LEU  QD1    53 CYSS HA      4.02            #peak  1621 #SUP  1.00
 41 CYSS HB2    45 LEU  QD1     4.54            #peak  1622 #SUP  0.90  #QF  0.90
 41 CYSS HB3    45 LEU  QD1     4.30            #peak  1624 #SUP  0.99  #QF  0.99
 37 PHE  HB2    45 LEU  QD1     4.54            #peak  1625 #SUP  0.92  #QF  0.92
 45 LEU  HB2    45 LEU  QD1     3.17            #peak  1626 #SUP  1.00  #QF  0.71
 42 MET  QE     45 LEU  QD1     3.48            #peak  1627 #SUP  0.97  #QF  0.97
 45 LEU  QD1    60 ILE  HB      5.34            #peak  1629 #SUP  1.00  #QF  0.89
 31 THR  QG2    45 LEU  QD1     4.54            #peak  1630 #SUP  1.00  #QF  0.99
 45 LEU  QD1    60 ILE  HG13    5.25            #peak  1630 #SUP  1.00  #QF  0.99
 45 LEU  HB3    45 LEU  QD1     3.22            #peak  1631 #SUP  1.00
 45 LEU  QD1    60 ILE  HG12    4.41            #peak  1632 #SUP  1.00
 45 LEU  QD1    60 ILE  QD1     3.17            #peak  1634 #SUP  1.00
 29 LYS  HA     29 LYS  HG2     4.07            #peak  1635 #SUP  1.00
 29 LYS  HG2    42 MET  HB3     4.75            #peak  1636 #SUP  1.00
 29 LYS  HG2    39 GLU  HG3     5.50            #peak  1637 #SUP  0.82  #QF  0.54
 29 LYS  HG2    42 MET  HG3     5.50            #peak  1637 #SUP  0.82  #QF  0.54
 29 LYS  HG3    39 GLU  HN      5.50            #peak  1641 #SUP  0.95  #QF  0.95
 29 LYS  HN     29 LYS  HG3     4.46            #peak  1642 #SUP  0.99  #QF  0.99
 29 LYS  HG3    42 MET  HB3     4.37            #peak  1643 #SUP  0.98  #QF  0.98
 31 THR  QG2    37 PHE  HB2     4.60            #peak  1645 #SUP  0.95  #QF  0.95
 31 THR  QG2    32 GLU  QB      5.04            #peak  1646 #SUP  0.97  #QF  0.97
 25 LEU  QD2    39 GLU  HN      4.37            #peak  1648 #SUP  1.00
 25 LEU  HN     25 LEU  QD2     3.51            #peak  1649 #SUP  0.96  #QF  0.96
 23 LEU  HN     25 LEU  QD2     4.81            #peak  1650 #SUP  1.00  #QF  0.97
 24 VAL  HN     25 LEU  QD2     5.06            #peak  1650 #SUP  1.00  #QF  0.97
 25 LEU  HA     25 LEU  QD2     3.18            #peak  1651 #SUP  0.99  #QF  0.99
 24 VAL  HA     25 LEU  QD2     4.18            #peak  1652 #SUP  1.00
 25 LEU  QD2    38 CYSS HB3     3.25            #peak  1654 #SUP  1.00
 23 LEU  HB3    25 LEU  QD2     3.91            #peak  1655 #SUP  1.00
 18 CYSS HN     25 LEU  QD2     3.67            #peak  1657 #SUP  1.00
 25 LEU  QD2    37 PHE  HA      5.14            #peak  1658 #SUP  0.99  #QF  0.99
 25 LEU  QD2    38 CYSS HB2     3.41            #peak  1660 #SUP  0.99  #QF  0.99
 18 CYSS HB2    25 LEU  QD2     3.34            #peak  1661 #SUP  1.00
 16 TYR  HB2    25 LEU  QD2     5.33            #peak  1662 #SUP  0.99  #QF  0.99
 31 THR  HN     31 THR  QG2     3.25            #peak  1666 #SUP  0.98  #QF  0.98
 31 THR  QG2    34 GLY  HN      4.34            #peak  1667 #SUP  0.95  #QF  0.95
 31 THR  QG2    37 PHE  QE      3.62            #peak  1668 #SUP  0.99  #QF  0.99
 30 GLN  HA     31 THR  QG2     4.06            #peak  1671 #SUP  0.97  #QF  0.97
 31 THR  QG2    36 ARG  HA      4.68            #peak  1672 #SUP  0.96  #QF  0.96
 31 THR  QG2    53 CYSS HA      4.59            #peak  1673 #SUP  0.99  #QF  0.99
 31 THR  QG2    35 HIST HB2     4.26            #peak  1674 #SUP  0.99  #QF  0.99
 31 THR  QG2    65 VAL  HB      5.50            #peak  1677 #SUP  1.00  #QF  0.98
 31 THR  QG2    45 LEU  HB2     5.50            #peak  1678 #SUP  0.95  #QF  0.95
 31 THR  QG2    60 ILE  HG12    3.48            #peak  1680 #SUP  0.99  #QF  0.92
 31 THR  QG2    60 ILE  QD1     3.28            #peak  1682 #SUP  0.88  #QF  0.88
 29 LYS  HA     31 THR  QG2     5.50            #peak  1683 #SUP  0.92  #QF  0.92
 23 LEU  HA     23 LEU  QD2     3.73            #peak  1685 #SUP  0.99  #QF  0.99
 23 LEU  QD2    38 CYSS HB2     5.50            #peak  1686 #SUP  1.00
 18 CYSS HB3    23 LEU  QD2     5.34            #peak  1687 #SUP  0.77  #QF  0.77
 23 LEU  HB3    23 LEU  QD2     3.15            #peak  1690 #SUP  1.00
 16 TYR  HB3    28 PRO  HD2     4.72            #peak  1694 #SUP  0.96  #QF  0.96
 16 TYR  QD     28 PRO  HD2     4.22            #peak  1697 #SUP  1.00
 16 TYR  HB2    28 PRO  HD2     4.84            #peak  1700 #SUP  0.98  #QF  0.91
 16 TYR  QD     28 PRO  HD3     4.22            #peak  1701 #SUP  0.98  #QF  0.98
 16 TYR  HB3    28 PRO  HD3     4.72            #peak  1703 #SUP  0.98  #QF  0.98
 16 TYR  HB2    28 PRO  HD3     4.84            #peak  1706 #SUP  1.00  #QF  0.99
 50 SER  HN     51 PRO  HD3     4.56            #peak  1709 #SUP  0.92  #QF  0.85
 51 PRO  HD3    61 VAL  QG2     5.50            #peak  1711 #SUP  0.78  #QF  0.78
 46 LEU  QD2    51 PRO  HD3     4.82            #peak  1712 #SUP  0.82  #QF  0.82
 50 SER  HA     51 PRO  HD3     3.03            #peak  1713 #SUP  0.71  #QF  0.71
 46 LEU  HA     51 PRO  HD3     4.24            #peak  1715 #SUP  0.88  #QF  0.88
 53 CYSS HA     54 THR  QG2     5.07            #peak  1717 #SUP  0.99  #QF  0.99
 54 THR  QG2    55 ALA  HN      4.21            #peak  1718 #SUP  1.00
 37 PHE  QD     54 THR  QG2     4.83            #peak  1721 #SUP  0.99  #QF  0.99
 54 THR  HN     54 THR  QG2     3.56            #peak  1722 #SUP  0.98  #QF  0.98
 20 LYS  HA     54 THR  QG2     3.70            #peak  1723 #SUP  1.00  #QF  0.85
 54 THR  QG2    54 THR  HG1     3.87            #peak  1723 #SUP  1.00  #QF  0.85
 20 LYS  QE     54 THR  QG2     3.85            #peak  1727 #SUP  0.97  #QF  0.97
 20 LYS  HB3    54 THR  QG2     4.77            #peak  1728 #SUP  0.98  #QF  0.98
 54 THR  QG2    55 ALA  QB      4.59            #peak  1730 #SUP  1.00
 45 LEU  QD1    54 THR  QG2     4.09            #peak  1731 #SUP  1.00
 45 LEU  HN     45 LEU  QD2     3.67            #peak  1732 #SUP  0.93  #QF  0.93
 45 LEU  QD2    52 LYS  HN      4.42            #peak  1733 #SUP  0.90  #QF  0.90
 37 PHE  QE     45 LEU  QD2     4.51            #peak  1734 #SUP  0.98  #QF  0.98
 45 LEU  QD2    54 THR  HN      4.53            #peak  1736 #SUP  0.91  #QF  0.91
 45 LEU  QD2    51 PRO  HA      4.35            #peak  1737 #SUP  0.99  #QF  0.99
 45 LEU  HA     45 LEU  QD2     2.70            #peak  1738 #SUP  0.92  #QF  0.92
 45 LEU  QD2    53 CYSS HA      4.11            #peak  1739 #SUP  0.94  #QF  0.94
 41 CYSS HB3    45 LEU  QD2     4.50            #peak  1741 #SUP  1.00
 45 LEU  HB2    45 LEU  QD2     3.30            #peak  1742 #SUP  0.95  #QF  0.95
 46 LEU  HN     46 LEU  QD2     3.56            #peak  1744 #SUP  0.97  #QF  0.97
 46 LEU  QD2    61 VAL  HA      4.07            #peak  1746 #SUP  0.92  #QF  0.92
 46 LEU  HA     46 LEU  QD2     2.65            #peak  1747 #SUP  0.97  #QF  0.97
 46 LEU  QD2    51 PRO  HD2     5.50            #peak  1748 #SUP  1.00  #QF  0.99
 42 MET  HG3    46 LEU  QD2     4.14            #peak  1750 #SUP  0.99  #QF  0.99
 46 LEU  QD2    51 PRO  HB3     3.49            #peak  1751 #SUP  1.00  #QF  0.94
 46 LEU  QD2    51 PRO  HG3     3.64            #peak  1751 #SUP  1.00  #QF  0.94
 46 LEU  QD2    60 ILE  HB      3.44            #peak  1753 #SUP  0.99  #QF  0.98
 46 LEU  QD2    60 ILE  QD1     3.65            #peak  1754 #SUP  0.92  #QF  0.92
 18 CYSS HN     24 VAL  QG2     4.97            #peak  1755 #SUP  0.96  #QF  0.96
 24 VAL  HN     24 VAL  QG2     3.11            #peak  1757 #SUP  0.94  #QF  0.94
 24 VAL  HA     24 VAL  QG2     2.99            #peak  1758 #SUP  0.98  #QF  0.98
 23 LEU  HA     24 VAL  QG2     4.16            #peak  1759 #SUP  0.94  #QF  0.94
 11 THR  HA     11 THR  QG2     3.07            #peak  1761 #SUP  0.98  #QF  0.98
 11 THR  HN     11 THR  QG2     4.44            #peak  1763 #SUP  0.93  #QF  0.93
 61 VAL  QG1    63 ASP  HN      3.53            #peak  1768 #SUP  0.99  #QF  0.99
 61 VAL  HN     61 VAL  QG1     3.95            #peak  1769 #SUP  0.99  #QF  0.99
 61 VAL  QG1    63 ASP  HA      4.50            #peak  1771 #SUP  0.99  #QF  0.99
 61 VAL  HA     61 VAL  QG1     2.95            #peak  1772 #SUP  0.99  #QF  0.99
 61 VAL  QG1    62 LYS  HA      4.55            #peak  1773 #SUP  0.99  #QF  0.99
 61 VAL  QG1    63 ASP  HB3     4.21            #peak  1775 #SUP  0.94  #QF  0.94
 29 LYS  HA     65 VAL  QG1     5.20            #peak  1777 #SUP  1.00  #QF  0.98
 15 LYS  HE3    24 VAL  QG1     4.59            #peak  1778 #SUP  1.00
 24 VAL  QG1    25 LEU  HN      3.29            #peak  1787 #SUP  0.85  #QF  0.85
 23 LEU  HA     24 VAL  QG1     5.50            #peak  1788 #SUP  0.98  #QF  0.98
 15 LYS  HA     24 VAL  QG1     5.04            #peak  1789 #SUP  0.89  #QF  0.89
 24 VAL  HA     24 VAL  QG1     3.04            #peak  1790 #SUP  0.99  #QF  0.99
 15 LYS  QD     24 VAL  QG1     3.24            #peak  1791 #SUP  0.91  #QF  0.63
 30 GLN  HN     65 VAL  QG1     5.50            #peak  1792 #SUP  0.96  #QF  0.94
 30 GLN  HN     65 VAL  QG2     5.50            #peak  1792 #SUP  0.96  #QF  0.94
 12 VAL  QG1    13 GLU  QG      5.50            #peak  1795 #SUP  0.99  #QF  0.34
 12 VAL  QG2    13 GLU  QG      5.50            #peak  1795 #SUP  0.99  #QF  0.34
 29 LYS  HA     65 VAL  QG2     5.20            #peak  1802 #SUP  0.60  #QF  0.60
  9 VAL  QG1    10 LYS  HA      4.49            #peak  1808 #SUP  0.71  #QF  0.71
 61 VAL  QG2    62 LYS  HN      4.21            #peak  1810 #SUP  0.97  #QF  0.97
 61 VAL  HN     61 VAL  QG2     3.24            #peak  1811 #SUP  1.00
 61 VAL  QG2    64 LYS  HN      4.35            #peak  1812 #SUP  0.96  #QF  0.96
 60 ILE  HN     61 VAL  QG2     4.62            #peak  1815 #SUP  0.96  #QF  0.96
  9 VAL  HA      9 VAL  QG2     3.42            #peak  1819 #SUP  0.98  #QF  0.98
 59 SER  HA     61 VAL  QG2     4.85            #peak  1821 #SUP  0.89  #QF  0.89
  9 VAL  QG2    10 LYS  HA      4.49            #peak  1822 #SUP  0.28  #QF  0.28
 61 VAL  HA     61 VAL  QG2     2.84            #peak  1823 #SUP  0.94  #QF  0.94
 35 HIST HD2    36 ARG  HN      4.16            #peak  1824 #SUP  0.99  #QF  0.99
 35 HIST HB3    35 HIST HD2     3.86            #peak  1827 #SUP  0.99  #QF  0.99
 19 GLU  HG3    35 HIST HD2     4.21            #peak  1828 #SUP  0.99  #QF  0.99
 35 HIST HD2    55 ALA  QB      3.79            #peak  1829 #SUP  1.00
 19 GLU  HG2    35 HIST HD2     4.64            #peak  1830 #SUP  0.94  #QF  0.94
 22 HIST HA     22 HIST HD2     3.74            #peak  1833 #SUP  0.87  #QF  0.87
 21 CYSS HA     22 HIST HD2     4.81            #peak  1837 #SUP  0.49  #QF  0.49
 17 LYS  QE     22 HIST HD2     4.72            #peak  1838 #SUP  0.91  #QF  0.91
 16 TYR  HN     16 TYR  QE      4.79            #peak  1839 #SUP  1.00
 16 TYR  QE     36 ARG  HD3     4.08            #peak  1843 #SUP  0.99  #QF  0.99
 16 TYR  QE     28 PRO  HG3     4.38            #peak  1844 #SUP  1.00
 16 TYR  QE     36 ARG  HG2     5.35            #peak  1846 #SUP  0.91  #QF  0.91
 16 TYR  QE     28 PRO  HG2     4.60            #peak  1847 #SUP  0.95  #QF  0.95
 35 HIST HE1    56 CYSS HA      4.52            #peak  1849 #SUP  0.99  #QF  0.99
 35 HIST HE1    56 CYSS HB2     3.83            #peak  1850 #SUP  0.98  #QF  0.98
 35 HIST HE1    56 CYSS HB3     2.99            #peak  1851 #SUP  0.91  #QF  0.91
 37 PHE  HA     38 CYSS HN      3.07            #peak  1854 #SUP  0.99  #QF  0.99
 20 LYS  HN     37 PHE  HA      4.74            #peak  1855 #SUP  1.00
 19 GLU  HN     37 PHE  HA      3.58            #peak  1856 #SUP  0.99  #QF  0.99
 37 PHE  HA     37 PHE  QD      3.54            #peak  1858 #SUP  1.00
 18 CYSS HA     37 PHE  HA      3.29            #peak  1859 #SUP  1.00
 37 PHE  HA     38 CYSS HB3     4.48            #peak  1861 #SUP  0.99  #QF  0.99
 20 LYS  HB2    37 PHE  HA      4.73            #peak  1863 #SUP  0.94  #QF  0.94
 19 GLU  HB2    37 PHE  HA      4.69            #peak  1864 #SUP  1.00  #QF  0.98
 36 ARG  HB3    37 PHE  HA      4.74            #peak  1865 #SUP  0.99  #QF  0.99
 25 LEU  QD1    37 PHE  HA      4.58            #peak  1867 #SUP  1.00
 18 CYSS HB2    37 PHE  HA      3.88            #peak  1868 #SUP  0.99  #QF  0.99
 16 TYR  HN     16 TYR  QD      3.67            #peak  1881 #SUP  1.00
 16 TYR  HA     16 TYR  QD      3.23            #peak  1884 #SUP  0.95  #QF  0.95
 15 LYS  HA     16 TYR  QD      4.17            #peak  1885 #SUP  0.99  #QF  0.99
 16 TYR  QD     36 ARG  HD2     4.05            #peak  1890 #SUP  1.00
 16 TYR  QD     36 ARG  HD3     3.55            #peak  1891 #SUP  1.00
 16 TYR  QD     28 PRO  HG3     4.02            #peak  1892 #SUP  1.00
 16 TYR  QD     28 PRO  HG2     4.08            #peak  1893 #SUP  0.78  #QF  0.78
 16 TYR  QD     36 ARG  HG3     4.87            #peak  1895 #SUP  1.00
 16 TYR  QD     36 ARG  HB3     4.71            #peak  1896 #SUP  0.99  #QF  0.99
 16 TYR  QD     36 ARG  HG2     4.59            #peak  1897 #SUP  0.99  #QF  0.99
 16 TYR  QD     25 LEU  QD1     4.71            #peak  1898 #SUP  1.00
 66 PHE  HA     66 PHE  QD      4.28            #peak  1900 #SUP  0.99  #QF  0.99
 65 VAL  QG1    66 PHE  QD      5.50            #peak  1901 #SUP  0.72  #QF  0.62
 65 VAL  QG2    66 PHE  QD      5.50            #peak  1901 #SUP  0.72  #QF  0.62
 66 PHE  HN     66 PHE  QD      4.20            #peak  1902 #SUP  0.99  #QF  0.99
 36 ARG  HA     37 PHE  QD      4.42            #peak  1910 #SUP  0.97  #QF  0.97
 37 PHE  QD     41 CYSS HB3     3.59            #peak  1912 #SUP  0.93  #QF  0.93
 31 THR  QG2    37 PHE  QD      3.36            #peak  1915 #SUP  0.99  #QF  0.99
 37 PHE  QE     55 ALA  HN      4.20            #peak  1916 #SUP  1.00  #QF  0.99
 19 GLU  HN     37 PHE  QE      4.83            #peak  1917 #SUP  0.99  #QF  0.99
 37 PHE  HN     37 PHE  QE      5.50            #peak  1918 #SUP  1.00
 37 PHE  HA     37 PHE  QE      4.82            #peak  1922 #SUP  1.00
 20 LYS  HA     37 PHE  QE      4.73            #peak  1923 #SUP  1.00  #QF  0.98
 35 HIST HB2    37 PHE  QE      3.78            #peak  1925 #SUP  0.99  #QF  0.99
 37 PHE  QE     53 CYSS HB2     5.50            #peak  1926 #SUP  1.00  #QF  0.62
 37 PHE  QE     41 CYSS HB3     5.25            #peak  1927 #SUP  0.98  #QF  0.90
 20 LYS  HB2    37 PHE  QE      3.53            #peak  1930 #SUP  1.00  #QF  0.24
 19 GLU  HB2    37 PHE  QE      3.82            #peak  1931 #SUP  0.99  #QF  0.99
 37 PHE  QE     54 THR  QG2     3.34            #peak  1932 #SUP  1.00  #QF  0.54
  8 PHE  HA      8 PHE  QD      4.33            #peak  1936 #SUP  1.00
 19 GLU  HN     37 PHE  QD      4.41            #peak  1938 #SUP  1.00
 37 PHE  QD     37 PHE  HZ      3.88            #peak  1939 #SUP  1.00
 18 CYSS HA     37 PHE  QD      4.76            #peak  1940 #SUP  1.00  #QF  0.97
 37 PHE  QD     54 THR  HB      5.12            #peak  1940 #SUP  1.00  #QF  0.97
 35 HIST HB3    37 PHE  QD      4.50            #peak  1941 #SUP  0.99  #QF  0.99
 20 LYS  HB2    37 PHE  QD      3.56            #peak  1942 #SUP  1.00
 20 LYS  HD2    37 PHE  QD      4.48            #peak  1943 #SUP  0.99  #QF  0.99
 20 LYS  HG2    37 PHE  QD      4.89            #peak  1944 #SUP  1.00
 37 PHE  QD     45 LEU  QD2     4.97            #peak  1945 #SUP  1.00
 19 GLU  HA     37 PHE  QD      5.42            #peak  1947 #SUP  0.94  #QF  0.94
 37 PHE  HZ     55 ALA  HN      4.19            #peak  1950 #SUP  1.00
 19 GLU  HG3    37 PHE  HZ      4.50            #peak  1952 #SUP  0.98  #QF  0.98
 37 PHE  HZ     54 THR  HN      3.81            #peak  1956 #SUP  0.97  #QF  0.97
 35 HIST HB3    37 PHE  HZ      4.71            #peak  1959 #SUP  1.00
 37 PHE  HZ     54 THR  QG2     4.15            #peak  1961 #SUP  0.98  #QF  0.98
 52 LYS  HB3    52 LYS  QE      4.35            #peak  1962 #SUP  0.97  #QF  0.97
 37 PHE  HB2    42 MET  QE      3.04            #peak  1967 #SUP  0.98  #QF  0.95
 42 MET  HG3    42 MET  QE      3.63            #peak  1968 #SUP  1.00
 42 MET  HB3    42 MET  QE      3.43            #peak  1969 #SUP  0.92  #QF  0.92
 31 THR  QG2    42 MET  QE      2.90            #peak  1970 #SUP  0.99  #QF  0.99
 29 LYS  HG2    42 MET  QE      4.94            #peak  1971 #SUP  1.00
 42 MET  QE     60 ILE  HB      5.43            #peak  1971 #SUP  1.00
 25 LEU  QD1    38 CYSS HA      3.86            #peak  1973 #SUP  0.98  #QF  0.98
 46 LEU  QD2    62 LYS  HA      3.80            #peak  1974 #SUP  0.88  #QF  0.88
 55 ALA  QB     56 CYSS HB2     4.64            #peak  1981 #SUP  1.00
 39 GLU  HB2    40 SER  HA      4.98            #peak  1983 #SUP  0.86  #QF  0.86
 30 GLN  HA     36 ARG  HG3     4.82            #peak  1986 #SUP  0.99  #QF  0.99
 46 LEU  QD1    62 LYS  QB      3.32            #peak  1987 #SUP  0.99  #QF  0.94
 23 LEU  HB2    23 LEU  QD1     3.21            #peak  1988 #SUP  0.98  #QF  0.98
 31 THR  HA     31 THR  QG2     3.13            #peak  1989 #SUP  0.95  #QF  0.95
 60 ILE  QG2    60 ILE  HG12    3.04            #peak  1991 #SUP  0.84  #QF  0.70
 29 LYS  HB3    30 GLN  HN      4.53            #peak  1995 #SUP  0.99  #QF  0.99
 20 LYS  HA     37 PHE  QD      4.88            #peak  1997 #SUP  0.86  #QF  0.86
 14 ASP  QB     15 LYS  HA      4.91            #peak  2003 #SUP  0.99  #QF  0.99
 18 CYSS HB2    38 CYSS HB2     3.79            #peak  2018 #SUP  1.00
 18 CYSS HB3    25 LEU  QD1     4.41            #peak  2020 #SUP  1.00
 20 LYS  HD3    37 PHE  QE      4.54            #peak  2022 #SUP  0.65  #QF  0.65
 19 GLU  HB2    37 PHE  HZ      4.42            #peak  2023 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HD3     5.50            #peak  2024 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HG2     5.05            #peak  2026 #SUP  0.99  #QF  0.99
 19 GLU  HB2    55 ALA  HN      5.01            #peak  2031 #SUP  1.00  #QF  0.99
 20 LYS  QE     37 PHE  QE      5.02            #peak  2032 #SUP  0.92  #QF  0.92
 51 PRO  HG3    60 ILE  HB      4.55            #peak  2036 #SUP  1.00  #QF  0.99
 39 GLU  HA     39 GLU  HG3     3.56            #peak  2037 #SUP  1.00
 39 GLU  HA     42 MET  HB3     3.37            #peak  2038 #SUP  0.98  #QF  0.94
 39 GLU  HA     43 ALA  QB      5.07            #peak  2039 #SUP  1.00
 30 GLN  HG2    36 ARG  HG3     4.58            #peak  2041 #SUP  0.98  #QF  0.98
 18 CYSS HB3    21 CYSS HB3     5.33            #peak  2042 #SUP  0.99  #QF  0.99
 17 LYS  HD2    22 HIST HB3     4.44            #peak  2043 #SUP  0.89  #QF  0.89
 17 LYS  HG2    22 HIST HB2     5.05            #peak  2044 #SUP  0.99  #QF  0.99
 17 LYS  HB2    22 HIST HB2     5.50            #peak  2045 #SUP  0.68  #QF  0.68
 17 LYS  HB2    24 VAL  QG2     3.35            #peak  2048 #SUP  0.88  #QF  0.88
 25 LEU  QD2    38 CYSS HA      3.33            #peak  2059 #SUP  0.94  #QF  0.94
 25 LEU  HB2    25 LEU  QD2     3.38            #peak  2060 #SUP  1.00
 25 LEU  HB3    25 LEU  QD2     3.18            #peak  2062 #SUP  0.99  #QF  0.99
 25 LEU  QD2    28 PRO  QB      4.23            #peak  2065 #SUP  0.99  #QF  0.99
 29 LYS  HG2    29 LYS  QE      4.11            #peak  2075 #SUP  0.64  #QF  0.64
 28 PRO  HA     29 LYS  HG2     4.93            #peak  2077 #SUP  0.94  #QF  0.94
 28 PRO  HA     29 LYS  HG3     5.21            #peak  2078 #SUP  0.94  #QF  0.94
 30 GLN  HA     36 ARG  HA      4.03            #peak  2079 #SUP  0.92  #QF  0.92
 30 GLN  HG2    34 GLY  HA2     4.81            #peak  2084 #SUP  0.96  #QF  0.96
 30 GLN  HG3    34 GLY  HA2     5.50            #peak  2085 #SUP  0.94  #QF  0.94
 36 ARG  HA     36 ARG  HG3     3.95            #peak  2087 #SUP  0.99  #QF  0.99
 25 LEU  QD1    38 CYSS HB2     3.90            #peak  2089 #SUP  0.96  #QF  0.96
 39 GLU  HB3    40 SER  HA      4.48            #peak  2090 #SUP  0.94  #QF  0.94
 29 LYS  HG2    42 MET  HB2     4.67            #peak  2096 #SUP  0.97  #QF  0.97
 42 MET  HG2    43 ALA  HA      4.92            #peak  2097 #SUP  0.95  #QF  0.95
 42 MET  HG2    46 LEU  QD1     3.63            #peak  2098 #SUP  0.99  #QF  0.99
 42 MET  HG3    65 VAL  QG1     5.18            #peak  2099 #SUP  0.91  #QF  0.87
 42 MET  HG3    65 VAL  QG2     5.18            #peak  2099 #SUP  0.91  #QF  0.87
 29 LYS  HB3    42 MET  HG3     5.12            #peak  2100 #SUP  0.95  #QF  0.95
 42 MET  HB2    42 MET  QE      3.12            #peak  2102 #SUP  0.98  #QF  0.98
 42 MET  HB3    43 ALA  QB      4.11            #peak  2103 #SUP  0.93  #QF  0.93
 42 MET  HG3    43 ALA  QB      4.35            #peak  2104 #SUP  0.97  #QF  0.97
 45 LEU  HB2    60 ILE  HB      4.20            #peak  2106 #SUP  0.84  #QF  0.84
 45 LEU  HB3    45 LEU  QD2     3.23            #peak  2109 #SUP  0.99  #QF  0.99
 42 MET  HG3    46 LEU  HB3     5.50            #peak  2110 #SUP  1.00
 47 SER  HN     48 SER  HB2     4.96            #peak  2114 #SUP  0.81  #QF  0.81
 51 PRO  HB2    52 LYS  HN      3.89            #peak  2118 #SUP  0.97  #QF  0.97
 51 PRO  HA     52 LYS  HB2     5.48            #peak  2122 #SUP  0.99  #QF  0.96
 52 LYS  HB2    58 GLU  HA      5.50            #peak  2122 #SUP  0.99  #QF  0.96
 45 LEU  QD1    54 THR  HB      4.97            #peak  2125 #SUP  0.98  #QF  0.98
 20 LYS  HB2    54 THR  QG2     3.98            #peak  2126 #SUP  0.98  #QF  0.98
 20 LYS  HD2    54 THR  QG2     4.05            #peak  2127 #SUP  0.98  #QF  0.98
 19 GLU  HB2    54 THR  QG2     3.90            #peak  2128 #SUP  0.49  #QF  0.49
 58 GLU  HB3    59 SER  HN      4.16            #peak  2134 #SUP  1.00
 33 CYSS HA     58 GLU  HB3     5.16            #peak  2137 #SUP  0.99  #QF  0.99
 46 LEU  QD1    62 LYS  HG2     4.80            #peak  2138 #SUP  0.99  #QF  0.99
 18 CYSS HB3    23 LEU  HB2     4.09            #peak  2143 #SUP  0.99  #QF  0.99
 17 LYS  HG2    22 HIST HA      4.17            #peak  2144 #SUP  0.83  #QF  0.83
 51 PRO  HD2    61 VAL  QG2     4.67            #peak  2145 #SUP  0.98  #QF  0.98
 46 LEU  HB3    51 PRO  HD3     5.50            #peak  2146 #SUP  0.77  #QF  0.77
 50 SER  HA     51 PRO  HD2     2.78            #peak  2149 #SUP  0.78  #QF  0.22
 42 MET  HG2    46 LEU  HG      5.06            #peak  2154 #SUP  0.97  #QF  0.97
  7 GLY  QA      8 PHE  HA      4.60            #peak     6
  7 GLY  QA      8 PHE  QB      4.76            #peak   331
  8 PHE  HA      9 VAL  QQG     4.83            #peak  1818
  8 PHE  QB      9 VAL  HN      4.18            #peak    63
  9 VAL  HN      9 VAL  QQG     3.68            #peak    61
  9 VAL  HA      9 VAL  QQG     2.85            #peak   535
  9 VAL  QQG    10 LYS  HN      4.27            #peak   432
  9 VAL  QQG    10 LYS  HA      3.77            #peak  1822
 10 LYS  HN     10 LYS  QB      3.47            #peak   430
 10 LYS  HN     10 LYS  QG      4.58            #peak   431
 10 LYS  HA     10 LYS  QG      3.49            #peak  1188
 10 LYS  QB     10 LYS  QE      4.27            #peak   709
 10 LYS  QB     11 THR  HN      3.92            #peak   767
 10 LYS  QG     10 LYS  QE      3.11            #peak   194
 11 THR  HA     12 VAL  QQG     4.05            #peak   539
 11 THR  HB     12 VAL  QQG     5.19            #peak   125
 12 VAL  HN     12 VAL  QQG     3.20            #peak   492
 12 VAL  HA     12 VAL  QQG     2.96            #peak   510
 12 VAL  HA     13 GLU  QB      4.62            #peak   509
 12 VAL  QQG    13 GLU  HN      3.85            #peak     7
 12 VAL  QQG    13 GLU  HA      4.55            #peak  1127
 12 VAL  QQG    14 ASP  HN      4.99            #peak   126
 12 VAL  QQG    14 ASP  HA      4.86            #peak  1796
 12 VAL  QQG    14 ASP  QB      4.22            #peak  1805
 13 GLU  HN     13 GLU  QB      3.23            #peak     6
 13 GLU  QB     14 ASP  HN      3.91            #peak   111
 14 ASP  HA     15 LYS  QB      4.98            #peak  1362
 14 ASP  HA     15 LYS  QG      3.67            #peak  1604
 14 ASP  QB     15 LYS  QB      5.18            #peak   283
 15 LYS  HN     15 LYS  QB      3.51            #peak   238
 15 LYS  HN     15 LYS  QG      3.60            #peak   239
 15 LYS  HA     15 LYS  QG      3.52            #peak  1554
 15 LYS  QB     15 LYS  QE      4.27            #peak   633
 15 LYS  QB     16 TYR  HN      3.36            #peak   227
 15 LYS  QB     16 TYR  QD      4.35            #peak  1894
 15 LYS  QB     16 TYR  QE      5.34            #peak  1845
 15 LYS  QG     16 TYR  HN      4.24            #peak   221
 15 LYS  QG     24 VAL  QG1     4.36            #peak  1555
 15 LYS  QE     24 VAL  HA      5.34            #peak   219
 15 LYS  QE     24 VAL  QG1     3.87            #peak  1778
 15 LYS  QE     24 VAL  QG2     3.80            #peak   222
 16 TYR  HB2    28 PRO  QD      4.26            #peak  1700
 16 TYR  QD     27 SER  QB      5.34            #peak  1899
 16 TYR  QE     28 PRO  QD      4.72            #peak  1841
 17 LYS  HN     17 LYS  QD      4.77            #peak  1203
 17 LYS  QD     18 CYSS HN      4.74            #peak   438
 17 LYS  QD     18 CYSS HB3     5.34            #peak   982
 17 LYS  QD     22 HIST HB2     4.31            #peak  1422
 17 LYS  QD     22 HIST HB3     3.80            #peak  2043
 17 LYS  QD     22 HIST HD2     4.93            #peak  1836
 17 LYS  QD     23 LEU  HN      5.34            #peak  1209
 17 LYS  QD     24 VAL  QG2     4.90            #peak  1224
 18 CYSS HB2    23 LEU  QQD     5.44            #peak  1689
 18 CYSS HB3    23 LEU  QQD     4.58            #peak  1605
 21 CYSS HB2    23 LEU  QQD     4.06            #peak  1567
 21 CYSS HB3    23 LEU  QQD     4.47            #peak  1569
 23 LEU  HN     23 LEU  QQD     3.73            #peak  1565
 23 LEU  HA     23 LEU  QQD     2.84            #peak  1685
 23 LEU  QQD    24 VAL  HN      3.53            #peak  1684
 23 LEU  QQD    38 CYSS HB2     4.09            #peak  1686
 23 LEU  QQD    38 CYSS HB3     4.16            #peak   887
 25 LEU  QD1    28 PRO  QD      3.95            #peak  2151
 26 CYSS QB     27 SER  QB      4.07            #peak   439
 27 SER  QB     28 PRO  QD      4.08            #peak  1698
 28 PRO  HA     29 LYS  QD      4.37            #peak   452
 28 PRO  QD     36 ARG  HD3     5.08            #peak  1700
 29 LYS  HN     65 VAL  QQG     5.28            #peak  1784
 29 LYS  HA     29 LYS  QD      3.38            #peak  1321
 29 LYS  HA     65 VAL  QQG     3.84            #peak  1777
 29 LYS  HB2    65 VAL  QQG     3.83            #peak   705
 29 LYS  HB3    65 VAL  QQG     3.23            #peak  1783
 29 LYS  QD     30 GLN  HN      4.83            #peak  1354
 29 LYS  QD     39 GLU  HA      5.06            #peak   640
 29 LYS  QD     42 MET  HG2     4.61            #peak  1358
 29 LYS  QD     65 VAL  QQG     3.94            #peak  1355
 29 LYS  QE     65 VAL  QQG     4.64            #peak   195
 30 GLN  HN     65 VAL  QQG     4.76            #peak  1792
 30 GLN  HB2    30 GLN  QE2     4.65            #peak    26
 30 GLN  HB3    30 GLN  QE2     4.64            #peak    25
 30 GLN  HG2    30 GLN  QE2     3.56            #peak    24
 30 GLN  QE2    34 GLY  HA1     4.21            #peak    32
 30 GLN  QE2    34 GLY  HA2     4.69            #peak    23
 31 THR  QG2    65 VAL  QQG     3.49            #peak  1806
 32 GLU  HN     32 GLU  QG      4.14            #peak   404
 32 GLU  HA     32 GLU  QG      3.10            #peak   724
 32 GLU  QB     32 GLU  QG      2.43            #peak  1180
 32 GLU  QB     64 LYS  QG      4.55            #peak  1183
 32 GLU  QG     33 CYSS HN      4.97            #peak   477
 32 GLU  QG     64 LYS  HB3     4.25            #peak   696
 33 CYSS HA     58 GLU  QB      4.38            #peak  1086
 33 CYSS HB2    58 GLU  QB      3.47            #peak  1133
 33 CYSS HB3    58 GLU  QB      3.29            #peak  1170
 42 MET  HG2    65 VAL  QQG     3.83            #peak  1779
 42 MET  HG3    65 VAL  QQG     4.38            #peak  2099
 42 MET  QE     65 VAL  QQG     3.27            #peak  1782
 43 ALA  QB     47 SER  QB      4.71            #peak   399
 44 ALA  HN     47 SER  QB      5.25            #peak   395
 44 ALA  QB     47 SER  QB      4.47            #peak   393
 46 LEU  HN     47 SER  QB      4.60            #peak   394
 46 LEU  HG     65 VAL  QQG     4.97            #peak  1497
 46 LEU  QD2    62 LYS  QG      4.34            #peak  1545
 47 SER  HN     47 SER  QB      2.77            #peak   463
 47 SER  HA     47 SER  QB      2.60            #peak   397
 47 SER  QB     48 SER  HN      4.04            #peak   400
 50 SER  QB     52 LYS  QG      4.51            #peak   468
 50 SER  QB     52 LYS  QE      3.67            #peak   205
 51 PRO  HA     52 LYS  QD      5.34            #peak   420
 52 LYS  HN     52 LYS  QG      3.75            #peak    21
 52 LYS  HN     52 LYS  QD      4.27            #peak  1266
 52 LYS  HB2    52 LYS  QD      3.50            #peak   486
 52 LYS  HB2    57 GLN  QG      4.96            #peak   585
 52 LYS  HB3    52 LYS  QD      3.42            #peak   478
 52 LYS  QG     52 LYS  QE      2.77            #peak   208
 52 LYS  QG     53 CYSS HN      4.09            #peak    33
 52 LYS  QG     57 GLN  HA      4.20            #peak  1593
 52 LYS  QG     59 SER  HA      4.09            #peak   660
 52 LYS  QG     60 ILE  HN      5.01            #peak    47
 52 LYS  QD     57 GLN  HA      3.76            #peak   934
 52 LYS  QD     57 GLN  QB      3.73            #peak  1267
 52 LYS  QD     57 GLN  QG      3.79            #peak   592
 53 CYSS HB2    58 GLU  QB      4.39            #peak  1028
 53 CYSS HB3    58 GLU  QB      4.16            #peak  1018
 54 THR  HA     57 GLN  QB      5.34            #peak   360
 54 THR  HA     57 GLN  QG      4.77            #peak   361
 57 GLN  HN     57 GLN  QG      3.85            #peak   619
 57 GLN  HA     57 GLN  QG      3.26            #peak   933
 57 GLN  QB     57 GLN  QG      2.28            #peak  2157
 57 GLN  QB     58 GLU  HN      4.28            #peak  1508
 57 GLN  QG     58 GLU  HN      5.34            #peak   616
 58 GLU  HN     58 GLU  QB      2.98            #peak   179
 58 GLU  QB     59 SER  HN      3.59            #peak  1084
 58 GLU  QB     59 SER  QB      4.40            #peak   415
 60 ILE  HA     65 VAL  QQG     3.86            #peak   579
 60 ILE  QG2    65 VAL  QQG     3.25            #peak  1991
 61 VAL  HA     62 LYS  QG      4.56            #peak   569
 61 VAL  HA     64 LYS  QG      5.34            #peak   570
 61 VAL  HB     64 LYS  QD      4.16            #peak  1303
 61 VAL  QG1    63 ASP  QB      3.64            #peak  1775
 61 VAL  QG1    64 LYS  QG      3.43            #peak  1597
 61 VAL  QG1    64 LYS  QD      4.56            #peak  1299
 61 VAL  QG2    64 LYS  QG      3.86            #peak  1585
 61 VAL  QG2    64 LYS  QD      5.34            #peak  1305
 62 LYS  HN     62 LYS  QG      3.86            #peak   415
 62 LYS  HA     65 VAL  QQG     3.44            #peak  1804
 62 LYS  QG     62 LYS  QE      3.43            #peak   194
 62 LYS  QG     63 ASP  HN      4.13            #peak   304
 62 LYS  QG     63 ASP  HA      4.92            #peak  1361
 62 LYS  QG     63 ASP  QB      4.38            #peak   298
 63 ASP  HN     63 ASP  QB      3.24            #peak   303
 63 ASP  QB     64 LYS  HN      3.92            #peak   244
 63 ASP  QB     64 LYS  HA      4.76            #peak  1296
 63 ASP  QB     64 LYS  QG      4.42            #peak  1601
 64 LYS  HN     65 VAL  QQG     4.42            #peak  1800
 64 LYS  HA     64 LYS  QG      3.19            #peak  1600
 64 LYS  HA     64 LYS  QD      3.51            #peak  1300
 64 LYS  HB3    64 LYS  QD      3.72            #peak  1301
 65 VAL  HN     65 VAL  QQG     3.53            #peak  1801
 65 VAL  HA     65 VAL  QQG     2.97            #peak   501
 65 VAL  QQG    66 PHE  HN      3.34            #peak  1785
 65 VAL  QQG    66 PHE  HA      4.40            #peak  1777
 65 VAL  QQG    66 PHE  QB      5.28            #peak  2051
 65 VAL  QQG    66 PHE  QD      4.69            #peak  1901
 66 PHE  HN     66 PHE  QB      3.58            #peak   290

21 CYSS CHI1 45 75
38 CYSS CHI1 45 75
41 CYSS CHI1 -75 -45


33 CYSS CHI1 45 75
35 HIST CHI1 -75 -45



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1 -44.128  15.589 -17.428
    2    HA2  GLY   1           1HA      GLY   1 -44.994  13.325 -16.074
    3    HA3  GLY   1           2HA      GLY   1 -45.048  12.927 -17.784
    4    H    SER   2           H        SER   2 -42.717  15.013 -16.138
    5    HA   SER   2           HA       SER   2 -40.647  12.973 -16.478
    6    HB3  SER   2           2HB      SER   2 -40.882  15.450 -18.021
    7    HG   SER   2           HG       SER   2 -38.273  14.868 -17.187
    8    H    SER   3           H        SER   3 -39.663  12.744 -14.594
    9    HA   SER   3           HA       SER   3 -38.465  14.860 -13.175
   10    HB3  SER   3           2HB      SER   3 -40.602  13.744 -11.443
   11    HG   SER   3           HG       SER   3 -38.978  15.385 -10.871
   12    H    GLY   4           H        GLY   4 -37.195  14.137 -11.421
   13    HA2  GLY   4           1HA      GLY   4 -36.091  11.615 -11.638
   14    HA3  GLY   4           2HA      GLY   4 -35.976  12.620 -10.202
   15    H    SER   5           H        SER   5 -36.030   9.880  -9.993
   16    HA   SER   5           HA       SER   5 -38.514   9.506  -8.508
   17    HB3  SER   5           2HB      SER   5 -37.531   7.364 -10.399
   18    HG   SER   5           HG       SER   5 -39.721   6.637 -10.032
   19    H    SER   6           H        SER   6 -35.284   8.365  -9.326
   20    HA   SER   6           HA       SER   6 -35.153   6.711  -6.939
   21    HB3  SER   6           2HB      SER   6 -33.710   5.547  -8.194
   22    HG   SER   6           HG       SER   6 -33.525   6.035 -10.286
   23    H    GLY   7           H        GLY   7 -35.007   7.905  -5.120
   24    HA2  GLY   7           1HA      GLY   7 -34.205   9.414  -3.582
   25    HA3  GLY   7           2HA      GLY   7 -32.638   9.042  -4.287
   26    H    PHE   8           H        PHE   8 -32.684  11.447  -3.366
   27    HA   PHE   8           HA       PHE   8 -33.081  13.162  -5.724
   28    HB3  PHE   8           2HB      PHE   8 -33.605  15.027  -4.077
   29    HD1  PHE   8           1HD      PHE   8 -35.373  11.778  -3.588
   30    HD2  PHE   8           2HD      PHE   8 -35.505  15.737  -5.142
   31    HE1  PHE   8           1HE      PHE   8 -37.713  11.431  -4.264
   32    HE2  PHE   8           2HE      PHE   8 -37.845  15.399  -5.819
   33    HZ   PHE   8           HZ       PHE   8 -38.954  13.243  -5.379
   34    H    VAL   9           H        VAL   9 -30.711  11.777  -4.798
   35    HA   VAL   9           HA       VAL   9 -29.025  14.043  -3.961
   36    HB   VAL   9           HB       VAL   9 -28.916  12.141  -2.433
   37   HG11  VAL   9          1HG1      VAL   9 -29.498  10.390  -4.065
   38   HG12  VAL   9          2HG1      VAL   9 -27.898  10.558  -4.791
   39   HG13  VAL   9          3HG1      VAL   9 -28.059   9.985  -3.131
   40   HG21  VAL   9          3HG2      VAL   9 -26.330  11.617  -3.031
   41   HG22  VAL   9          1HG2      VAL   9 -26.597  13.079  -3.979
   42   HG23  VAL   9          2HG2      VAL   9 -26.883  13.093  -2.239
   43    H    LYS  10           H        LYS  10 -27.579  14.844  -5.342
   44    HA   LYS  10           HA       LYS  10 -27.116  13.388  -7.856
   45    HB3  LYS  10           2HB      LYS  10 -26.145  15.964  -8.203
   46    HG3  LYS  10           2HG      LYS  10 -28.744  14.673  -8.932
   47    HD3  LYS  10           2HD      LYS  10 -28.640  17.359  -8.608
   48    HE3  LYS  10           2HE      LYS  10 -28.564  17.992 -11.199
   49    HZ1  LYS  10           3HZ      LYS  10 -26.489  19.006 -10.804
   50    HZ2  LYS  10           1HZ      LYS  10 -26.053  17.865  -9.633
   51    HZ3  LYS  10           2HZ      LYS  10 -27.278  18.984  -9.307
   52    H    THR  11           H        THR  11 -25.076  12.938  -8.557
   53    HA   THR  11           HA       THR  11 -22.819  12.628  -8.514
   54    HB   THR  11           HB       THR  11 -22.308  14.688  -6.441
   55    HG1  THR  11           1HG      THR  11 -23.785  15.906  -7.449
   56   HG21  THR  11          3HG2      THR  11 -20.618  13.428  -7.929
   57   HG22  THR  11          1HG2      THR  11 -20.429  15.171  -7.741
   58   HG23  THR  11          2HG2      THR  11 -21.158  14.516  -9.208
   59    H    VAL  12           H        VAL  12 -21.109  11.752  -7.171
   60    HA   VAL  12           HA       VAL  12 -22.098  10.068  -5.123
   61    HB   VAL  12           HB       VAL  12 -20.231   9.336  -6.458
   62   HG11  VAL  12          1HG1      VAL  12 -18.513  10.634  -7.015
   63   HG12  VAL  12          2HG1      VAL  12 -19.321  11.955  -6.167
   64   HG13  VAL  12          3HG1      VAL  12 -18.133  10.960  -5.325
   65   HG21  VAL  12          3HG2      VAL  12 -19.083   8.276  -4.794
   66   HG22  VAL  12          1HG2      VAL  12 -18.897   9.744  -3.835
   67   HG23  VAL  12          2HG2      VAL  12 -20.442   8.894  -3.855
   68    H    GLU  13           H        GLU  13 -22.676  10.754  -3.171
   69    HA   GLU  13           HA       GLU  13 -21.120  12.906  -1.907
   70    HB3  GLU  13           2HB      GLU  13 -23.213  12.890  -0.334
   71    HG3  GLU  13           2HG      GLU  13 -24.508  14.313  -1.934
   72    H    ASP  14           H        ASP  14 -19.583  10.993  -1.556
   73    HA   ASP  14           HA       ASP  14 -19.598  10.321   1.172
   74    HB3  ASP  14           2HB      ASP  14 -20.084   7.913  -0.576
   75    H    LYS  15           H        LYS  15 -17.660   9.368   1.841
   76    HA   LYS  15           HA       LYS  15 -15.746   8.486  -0.153
   77    HB3  LYS  15           2HB      LYS  15 -15.331  10.848  -0.230
   78    HG3  LYS  15           2HG      LYS  15 -14.436  11.268   2.491
   79    HD3  LYS  15           2HD      LYS  15 -15.630  13.349   2.235
   80    HE3  LYS  15           2HE      LYS  15 -13.769  12.364   0.258
   81    HZ1  LYS  15           3HZ      LYS  15 -15.960  13.634  -0.860
   82    HZ2  LYS  15           1HZ      LYS  15 -14.477  13.300  -1.603
   83    HZ3  LYS  15           2HZ      LYS  15 -14.724  14.787  -0.834
   84    H    TYR  16           H        TYR  16 -13.479   8.315   1.220
   85    HA   TYR  16           HA       TYR  16 -14.196   6.814   3.653
   86    HB3  TYR  16           2HB      TYR  16 -12.448   5.240   3.167
   87    HD1  TYR  16           1HD      TYR  16 -13.199   6.403  -0.257
   88    HD2  TYR  16           2HD      TYR  16 -14.246   3.709   2.866
   89    HE1  TYR  16           1HE      TYR  16 -14.633   5.157  -1.820
   90    HE2  TYR  16           2HE      TYR  16 -15.681   2.456   1.311
   91    HH   TYR  16           HH       TYR  16 -15.728   2.130  -1.295
   92    H    LYS  17           H        LYS  17 -12.163   6.470   5.072
   93    HA   LYS  17           HA       LYS  17 -10.292   8.683   5.037
   94    HB3  LYS  17           2HB      LYS  17 -12.495   8.424   7.042
   95    HG3  LYS  17           2HG      LYS  17 -10.779  10.262   8.164
   96    HD3  LYS  17           2HD      LYS  17 -10.385   8.136   9.756
   97    HE3  LYS  17           2HE      LYS  17 -12.355  10.211   9.505
   98    HZ1  LYS  17           3HZ      LYS  17 -14.181   8.921   9.567
   99    HZ2  LYS  17           1HZ      LYS  17 -13.811   8.794  11.212
  100    HZ3  LYS  17           2HZ      LYS  17 -13.358   7.561  10.147
  101    H    CYS  18           H        CYS  18  -8.400   8.232   6.086
  102    HA   CYS  18           HA       CYS  18  -7.773   5.537   6.605
  103    HB3  CYS  18           2HB      CYS  18  -6.311   8.095   7.272
  104    H    GLU  19           H        GLU  19  -7.581   4.369   8.462
  105    HA   GLU  19           HA       GLU  19  -9.000   5.381  10.774
  106    HB3  GLU  19           2HB      GLU  19  -8.105   2.918  11.520
  107    HG3  GLU  19           2HG      GLU  19 -10.219   2.056  11.037
  108    H    LYS  20           H        LYS  20  -6.325   6.451  10.011
  109    HA   LYS  20           HA       LYS  20  -5.027   6.033  12.616
  110    HB3  LYS  20           2HB      LYS  20  -3.071   6.652  10.597
  111    HG3  LYS  20           2HG      LYS  20  -3.509   4.411  12.529
  112    HD3  LYS  20           2HD      LYS  20  -1.177   4.613  10.629
  113    HE3  LYS  20           2HE      LYS  20  -0.288   2.819  11.686
  114    HZ1  LYS  20           3HZ      LYS  20  -0.778   2.815  14.074
  115    HZ2  LYS  20           1HZ      LYS  20  -2.117   3.812  13.805
  116    HZ3  LYS  20           2HZ      LYS  20  -0.559   4.383  13.478
  117    H    CYS  21           H        CYS  21  -4.656   8.053   9.694
  118    HA   CYS  21           HA       CYS  21  -4.291  10.385  11.433
  119    HB3  CYS  21           2HB      CYS  21  -2.517  10.158   9.855
  120    H    HIS  22           H        HIS  22  -6.792   8.872  10.079
  121    HA   HIS  22           HA       HIS  22  -8.907   9.452   9.478
  122    HB3  HIS  22           2HB      HIS  22  -9.790  10.950  10.894
  123    HD2  HIS  22           2HD      HIS  22  -7.637   9.255  12.497
  124    HE1  HIS  22           1HE      HIS  22  -6.334  12.941  14.145
  125    HE2  HIS  22           2HE      HIS  22  -6.240  10.431  14.329
  126    H    LEU  23           H        LEU  23  -6.598   9.961   7.661
  127    HA   LEU  23           HA       LEU  23  -7.139  12.313   6.159
  128    HB3  LEU  23           2HB      LEU  23  -5.873  10.699   4.389
  129    HG   LEU  23           HG       LEU  23  -3.671  11.382   5.724
  130   HD11  LEU  23          1HD1      LEU  23  -3.698  13.475   4.501
  131   HD12  LEU  23          2HD1      LEU  23  -5.443  13.348   4.280
  132   HD13  LEU  23          3HD1      LEU  23  -4.369  12.180   3.510
  133   HD21  LEU  23          3HD2      LEU  23  -3.891  13.034   7.278
  134   HD22  LEU  23          1HD2      LEU  23  -5.380  12.143   7.599
  135   HD23  LEU  23          2HD2      LEU  23  -5.424  13.607   6.616
  136    H    VAL  24           H        VAL  24  -8.912  12.656   5.009
  137    HA   VAL  24           HA       VAL  24 -10.701  10.594   4.224
  138    HB   VAL  24           HB       VAL  24 -10.575  13.478   3.331
  139   HG11  VAL  24          1HG1      VAL  24 -13.133  12.860   2.998
  140   HG12  VAL  24          2HG1      VAL  24 -11.939  12.616   1.721
  141   HG13  VAL  24          3HG1      VAL  24 -12.450  11.258   2.725
  142   HG21  VAL  24          3HG2      VAL  24 -10.916  13.402   5.684
  143   HG22  VAL  24          1HG2      VAL  24 -12.491  13.701   4.949
  144   HG23  VAL  24          2HG2      VAL  24 -12.084  12.089   5.538
  145    H    LEU  25           H        LEU  25 -10.451   9.236   2.588
  146    HA   LEU  25           HA       LEU  25  -9.081  10.189   0.161
  147    HB3  LEU  25           2HB      LEU  25  -7.600   8.552   0.307
  148    HG   LEU  25           HG       LEU  25  -8.936   8.051   2.921
  149   HD11  LEU  25          1HD1      LEU  25  -6.649   6.330   2.536
  150   HD12  LEU  25          2HD1      LEU  25  -7.961   5.918   1.433
  151   HD13  LEU  25          3HD1      LEU  25  -8.250   5.953   3.173
  152   HD21  LEU  25          3HD2      LEU  25  -6.144   8.730   2.015
  153   HD22  LEU  25          1HD2      LEU  25  -6.588   8.410   3.692
  154   HD23  LEU  25          2HD2      LEU  25  -7.295   9.784   2.840
  155    H    CYS  26           H        CYS  26  -9.644   8.879  -1.797
  156    HA   CYS  26           HA       CYS  26 -12.531   8.422  -1.825
  157    HB3  CYS  26           2HB      CYS  26 -11.603   8.193  -4.437
  158    H    SER  27           H        SER  27  -9.485   6.819  -2.590
  159    HA   SER  27           HA       SER  27 -10.940   4.262  -2.670
  160    HB3  SER  27           2HB      SER  27  -8.762   5.213  -4.533
  161    HG   SER  27           HG       SER  27  -9.712   2.693  -4.955
  162    HA   PRO  28           HA       PRO  28  -7.645   4.104   0.556
  163    HB3  PRO  28           2HB      PRO  28  -9.206   4.459   2.203
  164    HG3  PRO  28           2HG      PRO  28 -11.450   3.954   1.859
  165    HD3  PRO  28           2HD      PRO  28 -11.026   5.192  -0.039
  166    H    LYS  29           H        LYS  29  -7.474   1.838   2.058
  167    HA   LYS  29           HA       LYS  29  -7.286  -0.325   0.066
  168    HB3  LYS  29           2HB      LYS  29  -5.174  -0.942   0.823
  169    HG3  LYS  29           2HG      LYS  29  -3.861   1.224   1.293
  170    HD3  LYS  29           2HD      LYS  29  -5.155   1.757  -1.236
  171    HE3  LYS  29           2HE      LYS  29  -2.474   0.650  -0.419
  172    HZ1  LYS  29           3HZ      LYS  29  -3.356   1.583  -3.097
  173    HZ2  LYS  29           1HZ      LYS  29  -2.993  -0.017  -2.683
  174    HZ3  LYS  29           2HZ      LYS  29  -1.776   1.157  -2.671
  175    H    GLN  30           H        GLN  30  -9.570  -0.308   1.352
  176    HA   GLN  30           HA       GLN  30 -10.027  -1.192   3.833
  177    HB3  GLN  30           2HB      GLN  30 -11.356  -2.892   1.819
  178    HG3  GLN  30           2HG      GLN  30 -12.425  -0.905   3.809
  179   HE21  GLN  30          1HE2      GLN  30 -14.334  -3.250   4.250
  180   HE22  GLN  30          2HE2      GLN  30 -15.538  -3.024   3.032
  181    H    THR  31           H        THR  31  -9.060  -2.631   5.085
  182    HA   THR  31           HA       THR  31  -7.442  -4.740   4.060
  183    HB   THR  31           HB       THR  31  -6.917  -5.281   6.295
  184    HG1  THR  31           1HG      THR  31  -9.349  -3.966   6.985
  185   HG21  THR  31          3HG2      THR  31  -7.542  -2.439   6.839
  186   HG22  THR  31          1HG2      THR  31  -6.573  -2.774   5.405
  187   HG23  THR  31          2HG2      THR  31  -6.019  -3.313   6.990
  188    H    GLU  32           H        GLU  32  -8.160  -6.705   6.106
  189    HA   GLU  32           HA       GLU  32 -10.407  -7.937   4.682
  190    HB3  GLU  32           2HB      GLU  32  -9.131  -9.672   6.601
  191    HG3  GLU  32           2HG      GLU  32  -8.711 -11.089   4.709
  192    H    CYS  33           H        CYS  33 -10.311  -5.925   7.062
  193    HA   CYS  33           HA       CYS  33 -12.165  -7.430   8.790
  194    HB3  CYS  33           2HB      CYS  33  -9.997  -6.687   9.855
  195    H    GLY  34           H        GLY  34 -11.575  -4.507   6.981
  196    HA2  GLY  34           1HA      GLY  34 -13.802  -3.668   6.055
  197    HA3  GLY  34           2HA      GLY  34 -14.240  -3.503   7.750
  198    H    HIS  35           H        HIS  35 -12.084  -2.395   8.907
  199    HA   HIS  35           HA       HIS  35 -12.299   0.290   8.458
  200    HB3  HIS  35           2HB      HIS  35 -10.078   0.516   9.583
  201    HD2  HIS  35           2HD      HIS  35 -12.246   1.306  11.334
  202    HE1  HIS  35           1HE      HIS  35 -12.276  -2.420  13.362
  203    HE2  HIS  35           2HE      HIS  35 -13.134  -0.052  13.348
  204    H    ARG  36           H        ARG  36 -10.363   1.750   7.789
  205    HA   ARG  36           HA       ARG  36  -9.035   0.751   5.383
  206    HB3  ARG  36           2HB      ARG  36  -9.694   2.938   4.234
  207    HG3  ARG  36           2HG      ARG  36 -11.471   0.620   4.685
  208    HD3  ARG  36           2HD      ARG  36 -12.573   2.586   2.823
  209    HE   ARG  36           HE       ARG  36 -14.192   1.029   3.224
  210   HH11  ARG  36          1HH1      ARG  36 -12.791   1.996   6.261
  211   HH12  ARG  36          2HH1      ARG  36 -13.925   1.102   7.218
  212   HH21  ARG  36          1HH2      ARG  36 -15.691  -0.152   4.474
  213   HH22  ARG  36          2HH2      ARG  36 -15.574  -0.121   6.200
  214    H    PHE  37           H        PHE  37  -7.272   2.107   4.663
  215    HA   PHE  37           HA       PHE  37  -6.360   4.122   6.576
  216    HB3  PHE  37           2HB      PHE  37  -4.029   3.049   6.394
  217    HD1  PHE  37           1HD      PHE  37  -6.419   0.410   7.307
  218    HD2  PHE  37           2HD      PHE  37  -4.067   3.679   8.688
  219    HE1  PHE  37           1HE      PHE  37  -6.836  -0.276   9.633
  220    HE2  PHE  37           2HE      PHE  37  -4.479   2.996  11.016
  221    HZ   PHE  37           HZ       PHE  37  -5.864   1.016  11.491
  222    H    CYS  38           H        CYS  38  -4.279   5.179   5.721
  223    HA   CYS  38           HA       CYS  38  -4.749   5.828   2.912
  224    HB3  CYS  38           2HB      CYS  38  -4.581   7.629   4.657
  225    H    GLU  39           H        GLU  39  -2.890   6.137   1.470
  226    HA   GLU  39           HA       GLU  39  -1.409   3.924   1.008
  227    HB3  GLU  39           2HB      GLU  39   0.350   5.865   0.184
  228    HG3  GLU  39           2HG      GLU  39  -2.128   5.513  -1.418
  229    H    SER  40           H        SER  40  -0.320   6.715   2.925
  230    HA   SER  40           HA       SER  40   2.212   5.718   3.581
  231    HB3  SER  40           2HB      SER  40   1.981   7.300   5.591
  232    HG   SER  40           HG       SER  40   1.301   8.802   3.385
  233    H    CYS  41           H        CYS  41  -0.131   6.201   6.164
  234    HA   CYS  41           HA       CYS  41   0.729   4.482   8.005
  235    HB3  CYS  41           2HB      CYS  41  -1.613   4.131   8.738
  236    H    MET  42           H        MET  42  -1.252   3.516   5.225
  237    HA   MET  42           HA       MET  42  -1.584   0.830   5.825
  238    HB3  MET  42           2HB      MET  42  -1.344   2.279   3.197
  239    HG3  MET  42           2HG      MET  42  -0.669  -0.021   2.770
  240    HE1  MET  42           3HE      MET  42  -3.421   0.069   5.611
  241    HE2  MET  42           1HE      MET  42  -4.235   0.313   4.065
  242    HE3  MET  42           2HE      MET  42  -4.517  -1.164   4.985
  243    H    ALA  43           H        ALA  43   0.960   2.268   3.777
  244    HA   ALA  43           HA       ALA  43   2.428  -0.082   3.389
  245    HB1  ALA  43           3HB      ALA  43   3.426   1.323   1.989
  246    HB2  ALA  43           1HB      ALA  43   2.749   2.719   2.829
  247    HB3  ALA  43           2HB      ALA  43   4.275   2.019   3.369
  248    H    ALA  44           H        ALA  44   2.268   2.087   6.090
  249    HA   ALA  44           HA       ALA  44   4.726   1.352   7.316
  250    HB1  ALA  44           3HB      ALA  44   2.489   2.254   9.026
  251    HB2  ALA  44           1HB      ALA  44   4.163   2.805   8.958
  252    HB3  ALA  44           2HB      ALA  44   3.005   3.351   7.747
  253    H    LEU  45           H        LEU  45   1.355   0.470   8.095
  254    HA   LEU  45           HA       LEU  45   1.920  -1.404  10.068
  255    HB3  LEU  45           2HB      LEU  45  -0.303  -2.291   9.664
  256    HG   LEU  45           HG       LEU  45  -0.290   0.702   9.293
  257   HD11  LEU  45          1HD1      LEU  45  -2.595   0.677   9.960
  258   HD12  LEU  45          2HD1      LEU  45  -2.563  -1.075  10.161
  259   HD13  LEU  45          3HD1      LEU  45  -2.401  -0.369   8.552
  260   HD21  LEU  45          3HD2      LEU  45   0.079   0.865  11.481
  261   HD22  LEU  45          1HD2      LEU  45   0.485  -0.852  11.461
  262   HD23  LEU  45          2HD2      LEU  45  -1.158  -0.339  11.847
  263    H    LEU  46           H        LEU  46   1.305  -1.981   6.605
  264    HA   LEU  46           HA       LEU  46   1.639  -4.714   6.542
  265    HB3  LEU  46           2HB      LEU  46   2.229  -4.472   4.199
  266    HG   LEU  46           HG       LEU  46   0.147  -2.465   5.044
  267   HD11  LEU  46          1HD1      LEU  46  -0.593  -2.644   2.644
  268   HD12  LEU  46          2HD1      LEU  46   0.979  -3.362   2.296
  269   HD13  LEU  46          3HD1      LEU  46   0.880  -1.716   2.922
  270   HD21  LEU  46          3HD2      LEU  46  -0.413  -4.754   5.573
  271   HD22  LEU  46          1HD2      LEU  46  -0.011  -5.264   3.933
  272   HD23  LEU  46          2HD2      LEU  46  -1.394  -4.204   4.214
  273    H    SER  47           H        SER  47   4.064  -2.212   6.773
  274    HA   SER  47           HA       SER  47   6.250  -4.069   6.343
  275    HB3  SER  47           2HB      SER  47   6.426  -1.194   7.265
  276    HG   SER  47           HG       SER  47   8.468  -1.398   6.158
  277    H    SER  48           H        SER  48   4.343  -4.310   8.645
  278    HA   SER  48           HA       SER  48   6.259  -4.054  10.865
  279    HB3  SER  48           2HB      SER  48   3.271  -4.460  11.085
  280    HG   SER  48           HG       SER  48   5.342  -3.809  12.886
  281    H    SER  49           H        SER  49   5.701  -6.243   8.723
  282    HA   SER  49           HA       SER  49   6.058  -8.498   8.657
  283    HB3  SER  49           2HB      SER  49   6.064  -8.930  11.578
  284    HG   SER  49           HG       SER  49   8.001  -9.429   9.564
  285    H    SER  50           H        SER  50   4.193  -7.949  11.649
  286    HA   SER  50           HA       SER  50   2.123  -9.744  10.572
  287    HB3  SER  50           2HB      SER  50   1.448  -9.859  13.074
  288    HG   SER  50           HG       SER  50   2.382 -11.642  12.147
  289    HA   PRO  51           HA       PRO  51   0.323  -5.439  10.769
  290    HB3  PRO  51           2HB      PRO  51   0.971  -4.941   8.621
  291    HG3  PRO  51           2HG      PRO  51   1.424  -6.627   7.084
  292    HD3  PRO  51           2HD      PRO  51   2.702  -7.355   8.859
  293    H    LYS  52           H        LYS  52  -1.567  -5.394  11.793
  294    HA   LYS  52           HA       LYS  52  -3.629  -7.361  11.050
  295    HB3  LYS  52           2HB      LYS  52  -4.462  -7.257  13.270
  296    HG3  LYS  52           2HG      LYS  52  -1.487  -7.375  13.148
  297    HD3  LYS  52           2HD      LYS  52  -2.907  -7.999  15.698
  298    HE3  LYS  52           2HE      LYS  52  -0.255  -6.779  15.733
  299    HZ1  LYS  52           3HZ      LYS  52   0.192  -8.799  17.068
  300    HZ2  LYS  52           1HZ      LYS  52  -1.395  -9.313  16.781
  301    HZ3  LYS  52           2HZ      LYS  52  -1.111  -7.888  17.648
  302    H    CYS  53           H        CYS  53  -3.671  -4.188  12.670
  303    HA   CYS  53           HA       CYS  53  -4.719  -2.546  10.824
  304    HB3  CYS  53           2HB      CYS  53  -6.810  -4.472  11.762
  305    H    THR  54           H        THR  54  -3.896  -0.971  12.116
  306    HA   THR  54           HA       THR  54  -3.853  -0.537  14.735
  307    HB   THR  54           HB       THR  54  -3.887   1.200  12.459
  308    HG1  THR  54           1HG      THR  54  -2.139   0.968  13.898
  309   HG21  THR  54          3HG2      THR  54  -5.984   2.096  13.210
  310   HG22  THR  54          1HG2      THR  54  -4.718   3.252  13.623
  311   HG23  THR  54          2HG2      THR  54  -5.398   2.207  14.869
  312    H    ALA  55           H        ALA  55  -6.743  -0.108  12.744
  313    HA   ALA  55           HA       ALA  55  -8.458   1.030  14.592
  314    HB1  ALA  55           3HB      ALA  55  -8.698   0.022  12.040
  315    HB2  ALA  55           1HB      ALA  55  -9.773  -1.007  12.988
  316    HB3  ALA  55           2HB      ALA  55  -9.991   0.743  12.998
  317    H    CYS  56           H        CYS  56  -8.759  -2.408  13.754
  318    HA   CYS  56           HA       CYS  56  -9.283  -2.959  16.601
  319    HB3  CYS  56           2HB      CYS  56 -11.269  -3.325  15.265
  320    H    GLN  57           H        GLN  57  -7.476  -3.853  13.775
  321    HA   GLN  57           HA       GLN  57  -5.481  -5.001  13.673
  322    HB3  GLN  57           2HB      GLN  57  -4.422  -5.846  15.574
  323    HG3  GLN  57           2HG      GLN  57  -5.795  -4.275  17.467
  324   HE21  GLN  57          1HE2      GLN  57  -3.403  -4.356  14.890
  325   HE22  GLN  57          2HE2      GLN  57  -2.121  -3.648  15.807
  326    H    GLU  58           H        GLU  58  -6.294  -6.314  12.069
  327    HA   GLU  58           HA       GLU  58  -7.168  -8.977  12.960
  328    HB3  GLU  58           2HB      GLU  58  -8.358  -8.616  10.472
  329    HG3  GLU  58           2HG      GLU  58 -10.471  -8.628  11.622
  330    H    SER  59           H        SER  59  -6.329  -7.311   9.917
  331    HA   SER  59           HA       SER  59  -3.889  -8.583   9.491
  332    HB3  SER  59           2HB      SER  59  -5.827  -9.898   7.657
  333    HG   SER  59           HG       SER  59  -3.764 -10.493   7.333
  334    H    ILE  60           H        ILE  60  -2.875  -7.361   8.048
  335    HA   ILE  60           HA       ILE  60  -4.480  -6.016   5.974
  336    HB   ILE  60           HB       ILE  60  -1.940  -4.764   6.865
  337   HG13  ILE  60          2HG1      ILE  60  -3.171  -5.429   8.964
  338   HG21  ILE  60          1HG2      ILE  60  -4.240  -4.087   5.316
  339   HG22  ILE  60          2HG2      ILE  60  -4.083  -2.945   6.650
  340   HG23  ILE  60          3HG2      ILE  60  -2.741  -3.183   5.530
  341   HD11  ILE  60          3HD1      ILE  60  -3.473  -2.529   9.045
  342   HD12  ILE  60          1HD1      ILE  60  -2.483  -3.600  10.036
  343   HD13  ILE  60          2HD1      ILE  60  -1.903  -3.074   8.455
  344    H    VAL  61           H        VAL  61  -4.037  -6.975   4.098
  345    HA   VAL  61           HA       VAL  61  -1.211  -7.378   3.383
  346    HB   VAL  61           HB       VAL  61  -3.476  -9.313   2.901
  347   HG11  VAL  61          1HG1      VAL  61  -2.467  -9.808   0.973
  348   HG12  VAL  61          2HG1      VAL  61  -1.052  -8.832   1.370
  349   HG13  VAL  61          3HG1      VAL  61  -1.171 -10.492   1.955
  350   HG21  VAL  61          3HG2      VAL  61  -1.471 -10.774   3.925
  351   HG22  VAL  61          1HG2      VAL  61  -1.128  -9.221   4.689
  352   HG23  VAL  61          2HG2      VAL  61  -2.699  -9.989   4.918
  353    H    LYS  62           H        LYS  62  -0.706  -6.246   1.639
  354    HA   LYS  62           HA       LYS  62  -2.326  -4.659   0.141
  355    HB3  LYS  62           2HB      LYS  62  -0.021  -4.365  -0.167
  356    HG3  LYS  62           2HG      LYS  62   0.187  -7.216  -1.117
  357    HD3  LYS  62           2HD      LYS  62   2.064  -4.900  -1.092
  358    HE3  LYS  62           2HE      LYS  62   3.238  -6.351   0.376
  359    HZ1  LYS  62           3HZ      LYS  62   1.858  -8.358  -0.148
  360    HZ2  LYS  62           1HZ      LYS  62   3.513  -8.654   0.036
  361    HZ3  LYS  62           2HZ      LYS  62   2.831  -8.599  -1.511
  362    H    ASP  63           H        ASP  63  -1.539  -8.050  -0.514
  363    HA   ASP  63           HA       ASP  63  -2.902  -8.261  -2.964
  364    HB3  ASP  63           2HB      ASP  63  -2.903 -10.674  -1.279
  365    H    LYS  64           H        LYS  64  -3.960  -8.777   0.369
  366    HA   LYS  64           HA       LYS  64  -6.643  -9.477  -0.486
  367    HB3  LYS  64           2HB      LYS  64  -7.097  -9.964   1.787
  368    HG3  LYS  64           2HG      LYS  64  -4.988 -11.150   2.625
  369    HD3  LYS  64           2HD      LYS  64  -6.641 -11.702   0.258
  370    HE3  LYS  64           2HE      LYS  64  -4.321 -13.531   0.754
  371    HZ1  LYS  64           3HZ      LYS  64  -5.222 -13.393  -1.900
  372    HZ2  LYS  64           1HZ      LYS  64  -6.570 -13.569  -0.894
  373    HZ3  LYS  64           2HZ      LYS  64  -5.312 -14.696  -0.825
  374    H    VAL  65           H        VAL  65  -4.983  -6.657  -0.146
  375    HA   VAL  65           HA       VAL  65  -7.168  -5.105   0.996
  376    HB   VAL  65           HB       VAL  65  -4.345  -4.735   0.752
  377   HG11  VAL  65          1HG1      VAL  65  -4.925  -3.482  -1.301
  378   HG12  VAL  65          2HG1      VAL  65  -5.954  -2.425  -0.331
  379   HG13  VAL  65          3HG1      VAL  65  -4.212  -2.464  -0.049
  380   HG21  VAL  65          3HG2      VAL  65  -5.043  -4.182   2.823
  381   HG22  VAL  65          1HG2      VAL  65  -5.237  -2.577   2.119
  382   HG23  VAL  65          2HG2      VAL  65  -6.628  -3.653   2.260
  383    H    PHE  66           H        PHE  66  -8.210  -3.403  -0.110
  384    HA   PHE  66           HA       PHE  66  -7.985  -3.486  -3.043
  385    HB3  PHE  66           2HB      PHE  66 -10.451  -3.213  -3.173
  386    HD1  PHE  66           1HD      PHE  66  -9.351  -5.589  -0.516
  387    HD2  PHE  66           2HD      PHE  66 -10.828  -5.064  -4.473
  388    HE1  PHE  66           1HE      PHE  66  -9.500  -8.031  -0.781
  389    HE2  PHE  66           2HE      PHE  66 -10.981  -7.505  -4.744
  390    HZ   PHE  66           HZ       PHE  66 -10.317  -8.991  -2.896
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1 -49.063  19.040 -17.256
    2    HA2  GLY   1           1HA      GLY   1 -50.893  18.514 -15.247
    3    HA3  GLY   1           2HA      GLY   1 -50.911  17.747 -16.829
    4    H    SER   2           H        SER   2 -50.476  15.627 -16.970
    5    HA   SER   2           HA       SER   2 -48.814  14.213 -15.158
    6    HB3  SER   2           2HB      SER   2 -51.744  13.539 -14.878
    7    HG   SER   2           HG       SER   2 -50.412  11.897 -14.213
    8    H    SER   3           H        SER   3 -48.128  13.807 -17.404
    9    HA   SER   3           HA       SER   3 -49.750  11.738 -18.728
   10    HB3  SER   3           2HB      SER   3 -47.926  12.361 -20.610
   11    HG   SER   3           HG       SER   3 -50.226  12.527 -20.792
   12    H    GLY   4           H        GLY   4 -48.445  10.780 -16.602
   13    HA2  GLY   4           1HA      GLY   4 -47.255   8.743 -16.366
   14    HA3  GLY   4           2HA      GLY   4 -46.382   9.113 -17.847
   15    H    SER   5           H        SER   5 -44.355   9.785 -17.639
   16    HA   SER   5           HA       SER   5 -42.422  10.583 -16.741
   17    HB3  SER   5           2HB      SER   5 -44.517  12.251 -15.543
   18    HG   SER   5           HG       SER   5 -43.095  13.134 -13.979
   19    H    SER   6           H        SER   6 -41.098  10.599 -14.683
   20    HA   SER   6           HA       SER   6 -42.084   8.717 -12.670
   21    HB3  SER   6           2HB      SER   6 -40.922   7.302 -14.267
   22    HG   SER   6           HG       SER   6 -38.535   8.723 -13.817
   23    H    GLY   7           H        GLY   7 -40.123   8.419 -10.995
   24    HA2  GLY   7           1HA      GLY   7 -39.561  11.135 -10.091
   25    HA3  GLY   7           2HA      GLY   7 -39.391   9.666  -9.143
   26    H    PHE   8           H        PHE   8 -37.457  11.676  -9.172
   27    HA   PHE   8           HA       PHE   8 -35.335  10.846 -10.963
   28    HB3  PHE   8           2HB      PHE   8 -34.357  12.830 -10.478
   29    HD1  PHE   8           1HD      PHE   8 -36.896  12.894 -11.728
   30    HD2  PHE   8           2HD      PHE   8 -35.764  14.508  -7.955
   31    HE1  PHE   8           1HE      PHE   8 -38.715  14.543 -11.891
   32    HE2  PHE   8           2HE      PHE   8 -37.581  16.158  -8.112
   33    HZ   PHE   8           HZ       PHE   8 -39.061  16.177 -10.081
   34    H    VAL   9           H        VAL   9 -33.142  10.400 -10.054
   35    HA   VAL   9           HA       VAL   9 -33.370   8.665  -7.682
   36    HB   VAL   9           HB       VAL   9 -32.894   7.370  -9.677
   37   HG11  VAL   9          1HG1      VAL   9 -31.867   8.559 -11.297
   38   HG12  VAL   9          2HG1      VAL   9 -30.943   9.528 -10.148
   39   HG13  VAL   9          3HG1      VAL   9 -30.407   7.899 -10.563
   40   HG21  VAL   9          3HG2      VAL   9 -31.540   7.212  -7.332
   41   HG22  VAL   9          1HG2      VAL   9 -31.409   6.037  -8.642
   42   HG23  VAL   9          2HG2      VAL   9 -30.209   7.320  -8.485
   43    H    LYS  10           H        LYS  10 -31.878   8.826  -6.065
   44    HA   LYS  10           HA       LYS  10 -29.728  10.807  -6.387
   45    HB3  LYS  10           2HB      LYS  10 -30.375  11.096  -3.756
   46    HG3  LYS  10           2HG      LYS  10 -30.180  12.809  -5.750
   47    HD3  LYS  10           2HD      LYS  10 -33.057  12.165  -5.583
   48    HE3  LYS  10           2HE      LYS  10 -32.637  14.921  -6.416
   49    HZ1  LYS  10           3HZ      LYS  10 -34.745  13.473  -5.755
   50    HZ2  LYS  10           1HZ      LYS  10 -34.725  15.160  -5.632
   51    HZ3  LYS  10           2HZ      LYS  10 -34.459  14.209  -4.258
   52    H    THR  11           H        THR  11 -27.893   9.707  -6.202
   53    HA   THR  11           HA       THR  11 -27.754   7.350  -4.495
   54    HB   THR  11           HB       THR  11 -25.240   8.086  -5.737
   55    HG1  THR  11           1HG      THR  11 -27.375   7.583  -7.545
   56   HG21  THR  11          3HG2      THR  11 -27.001   5.743  -6.405
   57   HG22  THR  11          1HG2      THR  11 -26.097   5.825  -4.894
   58   HG23  THR  11          2HG2      THR  11 -25.240   5.842  -6.436
   59    H    VAL  12           H        VAL  12 -26.706   7.246  -2.594
   60    HA   VAL  12           HA       VAL  12 -25.930   9.643  -1.277
   61    HB   VAL  12           HB       VAL  12 -25.477   6.773  -0.449
   62   HG11  VAL  12          1HG1      VAL  12 -24.963   7.541   1.710
   63   HG12  VAL  12          2HG1      VAL  12 -24.035   8.581   0.627
   64   HG13  VAL  12          3HG1      VAL  12 -25.528   9.174   1.356
   65   HG21  VAL  12          3HG2      VAL  12 -27.604   8.634   0.569
   66   HG22  VAL  12          1HG2      VAL  12 -27.865   7.590  -0.829
   67   HG23  VAL  12          2HG2      VAL  12 -27.497   6.881   0.744
   68    H    GLU  13           H        GLU  13 -24.224  10.618  -2.325
   69    HA   GLU  13           HA       GLU  13 -21.810   9.128  -2.901
   70    HB3  GLU  13           2HB      GLU  13 -20.957  11.272  -3.757
   71    HG3  GLU  13           2HG      GLU  13 -23.282  11.755  -5.148
   72    H    ASP  14           H        ASP  14 -20.407   8.679  -1.347
   73    HA   ASP  14           HA       ASP  14 -19.873  10.729   0.700
   74    HB3  ASP  14           2HB      ASP  14 -21.160   8.502   1.349
   75    H    LYS  15           H        LYS  15 -17.812   9.240   1.971
   76    HA   LYS  15           HA       LYS  15 -15.821   8.648  -0.050
   77    HB3  LYS  15           2HB      LYS  15 -15.522  11.008   0.005
   78    HG3  LYS  15           2HG      LYS  15 -15.046  11.091   2.943
   79    HD3  LYS  15           2HD      LYS  15 -16.264  13.169   1.148
   80    HE3  LYS  15           2HE      LYS  15 -14.780  13.201   3.767
   81    HZ1  LYS  15           3HZ      LYS  15 -14.149  15.277   3.405
   82    HZ2  LYS  15           1HZ      LYS  15 -15.719  15.740   2.975
   83    HZ3  LYS  15           2HZ      LYS  15 -14.658  15.150   1.797
   84    H    TYR  16           H        TYR  16 -13.581   8.402   1.234
   85    HA   TYR  16           HA       TYR  16 -14.199   6.787   3.621
   86    HB3  TYR  16           2HB      TYR  16 -12.416   5.287   3.019
   87    HD1  TYR  16           2HD      TYR  16 -13.271   6.527  -0.344
   88    HD2  TYR  16           1HD      TYR  16 -14.232   3.754   2.737
   89    HE1  TYR  16           2HE      TYR  16 -14.725   5.304  -1.906
   90    HE2  TYR  16           1HE      TYR  16 -15.689   2.524   1.183
   91    HH   TYR  16           HH       TYR  16 -15.681   3.097  -2.185
   92    H    LYS  17           H        LYS  17 -12.217   6.469   5.047
   93    HA   LYS  17           HA       LYS  17 -10.335   8.678   5.043
   94    HB3  LYS  17           2HB      LYS  17 -12.538   8.381   7.045
   95    HG3  LYS  17           2HG      LYS  17 -10.820  10.212   8.185
   96    HD3  LYS  17           2HD      LYS  17 -10.429   8.069   9.755
   97    HE3  LYS  17           2HE      LYS  17 -12.370  10.162   9.541
   98    HZ1  LYS  17           3HZ      LYS  17 -14.222   9.223  10.595
   99    HZ2  LYS  17           1HZ      LYS  17 -13.433   7.757  10.898
  100    HZ3  LYS  17           2HZ      LYS  17 -13.880   8.167   9.318
  101    H    CYS  18           H        CYS  18  -8.444   8.208   6.086
  102    HA   CYS  18           HA       CYS  18  -7.820   5.504   6.561
  103    HB3  CYS  18           2HB      CYS  18  -6.359   8.056   7.251
  104    H    GLU  19           H        GLU  19  -7.612   4.311   8.404
  105    HA   GLU  19           HA       GLU  19  -9.033   5.289  10.732
  106    HB3  GLU  19           2HB      GLU  19  -8.292   2.858  11.514
  107    HG3  GLU  19           2HG      GLU  19 -10.293   1.956  10.734
  108    H    LYS  20           H        LYS  20  -6.377   6.392  10.000
  109    HA   LYS  20           HA       LYS  20  -5.072   5.926  12.591
  110    HB3  LYS  20           2HB      LYS  20  -3.104   6.561  10.601
  111    HG3  LYS  20           2HG      LYS  20  -3.584   4.265  12.457
  112    HD3  LYS  20           2HD      LYS  20  -1.238   4.519  10.581
  113    HE3  LYS  20           2HE      LYS  20  -0.324   2.743  11.627
  114    HZ1  LYS  20           3HZ      LYS  20  -0.859   2.640  13.995
  115    HZ2  LYS  20           1HZ      LYS  20  -2.240   3.580  13.735
  116    HZ3  LYS  20           2HZ      LYS  20  -0.707   4.238  13.465
  117    H    CYS  21           H        CYS  21  -4.715   7.979   9.692
  118    HA   CYS  21           HA       CYS  21  -4.334  10.290  11.457
  119    HB3  CYS  21           2HB      CYS  21  -2.563  10.075   9.872
  120    H    HIS  22           H        HIS  22  -6.836   8.796  10.075
  121    HA   HIS  22           HA       HIS  22  -8.953   9.388   9.488
  122    HB3  HIS  22           2HB      HIS  22  -9.833  10.871  10.922
  123    HD2  HIS  22           2HD      HIS  22  -7.678   9.148  12.499
  124    HE1  HIS  22           1HE      HIS  22  -6.378  12.809  14.204
  125    HE2  HIS  22           2HE      HIS  22  -6.283  10.296  14.350
  126    H    LEU  23           H        LEU  23  -6.635   9.925   7.682
  127    HA   LEU  23           HA       LEU  23  -7.174  12.293   6.207
  128    HB3  LEU  23           2HB      LEU  23  -5.916  10.700   4.415
  129    HG   LEU  23           HG       LEU  23  -3.710  11.348   5.767
  130   HD11  LEU  23          1HD1      LEU  23  -3.925  13.625   4.677
  131   HD12  LEU  23          2HD1      LEU  23  -5.535  13.118   4.164
  132   HD13  LEU  23          3HD1      LEU  23  -4.115  12.225   3.620
  133   HD21  LEU  23          3HD2      LEU  23  -5.524  13.530   6.692
  134   HD22  LEU  23          1HD2      LEU  23  -3.933  13.056   7.290
  135   HD23  LEU  23          2HD2      LEU  23  -5.346  12.074   7.673
  136    H    VAL  24           H        VAL  24  -8.951  12.657   5.068
  137    HA   VAL  24           HA       VAL  24 -10.741  10.605   4.253
  138    HB   VAL  24           HB       VAL  24 -10.634  13.501   3.395
  139   HG11  VAL  24          1HG1      VAL  24 -12.711  13.265   2.420
  140   HG12  VAL  24          2HG1      VAL  24 -11.952  11.726   2.006
  141   HG13  VAL  24          3HG1      VAL  24 -13.098  11.814   3.344
  142   HG21  VAL  24          3HG2      VAL  24 -10.898  13.352   5.776
  143   HG22  VAL  24          1HG2      VAL  24 -12.460  13.765   5.068
  144   HG23  VAL  24          2HG2      VAL  24 -12.145  12.116   5.607
  145    H    LEU  25           H        LEU  25 -10.450   9.267   2.606
  146    HA   LEU  25           HA       LEU  25  -9.111  10.283   0.186
  147    HB3  LEU  25           2HB      LEU  25  -7.608   8.665   0.317
  148    HG   LEU  25           HG       LEU  25  -8.969   8.073   2.896
  149   HD11  LEU  25          1HD1      LEU  25  -8.145   5.947   1.431
  150   HD12  LEU  25          2HD1      LEU  25  -8.146   6.008   3.193
  151   HD13  LEU  25          3HD1      LEU  25  -6.665   6.357   2.299
  152   HD21  LEU  25          3HD2      LEU  25  -6.153   8.745   2.056
  153   HD22  LEU  25          1HD2      LEU  25  -6.652   8.423   3.717
  154   HD23  LEU  25          2HD2      LEU  25  -7.313   9.811   2.852
  155    H    CYS  26           H        CYS  26  -9.634   8.883  -1.771
  156    HA   CYS  26           HA       CYS  26 -12.528   8.385  -1.780
  157    HB3  CYS  26           2HB      CYS  26 -11.296   8.391  -4.400
  158    H    SER  27           H        SER  27  -9.428   6.916  -2.373
  159    HA   SER  27           HA       SER  27 -10.777   4.336  -2.761
  160    HB3  SER  27           2HB      SER  27 -10.040   5.104  -4.972
  161    HG   SER  27           HG       SER  27  -8.228   6.367  -4.087
  162    HA   PRO  28           HA       PRO  28  -7.635   4.148   0.633
  163    HB3  PRO  28           2HB      PRO  28  -9.259   4.486   2.223
  164    HG3  PRO  28           2HG      PRO  28 -11.489   4.001   1.782
  165    HD3  PRO  28           2HD      PRO  28 -10.983   5.267  -0.077
  166    H    LYS  29           H        LYS  29  -7.537   1.857   2.104
  167    HA   LYS  29           HA       LYS  29  -7.291  -0.279   0.088
  168    HB3  LYS  29           2HB      LYS  29  -5.244  -1.007   1.075
  169    HG3  LYS  29           2HG      LYS  29  -3.752   0.916   0.937
  170    HD3  LYS  29           2HD      LYS  29  -5.821   1.412  -1.164
  171    HE3  LYS  29           2HE      LYS  29  -3.443   2.417  -1.052
  172    HZ1  LYS  29           3HZ      LYS  29  -1.735   1.033  -1.144
  173    HZ2  LYS  29           1HZ      LYS  29  -2.327   0.320  -2.559
  174    HZ3  LYS  29           2HZ      LYS  29  -2.787  -0.288  -1.048
  175    H    GLN  30           H        GLN  30  -9.613  -0.277   1.295
  176    HA   GLN  30           HA       GLN  30 -10.182  -1.168   3.739
  177    HB3  GLN  30           2HB      GLN  30 -11.394  -2.937   1.733
  178    HG3  GLN  30           2HG      GLN  30 -12.450  -0.890   3.660
  179   HE21  GLN  30          1HE2      GLN  30 -14.853  -2.099   4.090
  180   HE22  GLN  30          2HE2      GLN  30 -15.851  -1.945   2.688
  181    H    THR  31           H        THR  31  -9.098  -2.505   5.021
  182    HA   THR  31           HA       THR  31  -7.461  -4.624   4.094
  183    HB   THR  31           HB       THR  31  -7.059  -5.163   6.387
  184    HG1  THR  31           1HG      THR  31  -9.502  -3.802   6.816
  185   HG21  THR  31          3HG2      THR  31  -7.541  -2.193   6.410
  186   HG22  THR  31          1HG2      THR  31  -6.242  -2.930   5.475
  187   HG23  THR  31          2HG2      THR  31  -6.272  -3.102   7.230
  188    H    GLU  32           H        GLU  32  -7.968  -6.730   5.817
  189    HA   GLU  32           HA       GLU  32 -10.250  -7.952   4.488
  190    HB3  GLU  32           2HB      GLU  32  -8.767  -9.557   6.453
  191    HG3  GLU  32           2HG      GLU  32  -8.383 -10.822   4.148
  192    H    CYS  33           H        CYS  33 -10.230  -5.971   6.894
  193    HA   CYS  33           HA       CYS  33 -12.056  -7.554   8.583
  194    HB3  CYS  33           2HB      CYS  33  -9.890  -6.775   9.660
  195    H    GLY  34           H        GLY  34 -11.513  -4.588   6.835
  196    HA2  GLY  34           1HA      GLY  34 -13.753  -3.771   5.921
  197    HA3  GLY  34           2HA      GLY  34 -14.193  -3.641   7.618
  198    H    HIS  35           H        HIS  35 -12.036  -2.525   8.785
  199    HA   HIS  35           HA       HIS  35 -12.299   0.168   8.380
  200    HB3  HIS  35           2HB      HIS  35 -10.060   0.396   9.495
  201    HD2  HIS  35           2HD      HIS  35 -12.122   1.246  11.298
  202    HE1  HIS  35           1HE      HIS  35 -12.375  -2.519  13.236
  203    HE2  HIS  35           2HE      HIS  35 -13.086  -0.104  13.283
  204    H    ARG  36           H        ARG  36 -10.411   1.676   7.724
  205    HA   ARG  36           HA       ARG  36  -9.073   0.727   5.296
  206    HB3  ARG  36           2HB      ARG  36  -9.735   2.972   4.233
  207    HG3  ARG  36           2HG      ARG  36 -11.484   0.610   4.565
  208    HD3  ARG  36           2HD      ARG  36 -12.575   2.635   2.759
  209    HE   ARG  36           HE       ARG  36 -14.111   0.955   3.072
  210   HH11  ARG  36          1HH1      ARG  36 -13.045   2.161   6.160
  211   HH12  ARG  36          2HH1      ARG  36 -14.251   1.300   7.058
  212   HH21  ARG  36          1HH2      ARG  36 -15.703  -0.183   4.244
  213   HH22  ARG  36          2HH2      ARG  36 -15.761  -0.034   5.969
  214    H    PHE  37           H        PHE  37  -7.330   2.130   4.586
  215    HA   PHE  37           HA       PHE  37  -6.401   4.097   6.534
  216    HB3  PHE  37           2HB      PHE  37  -4.075   3.014   6.362
  217    HD1  PHE  37           2HD      PHE  37  -6.550   0.423   7.228
  218    HD2  PHE  37           1HD      PHE  37  -4.066   3.567   8.660
  219    HE1  PHE  37           2HE      PHE  37  -6.990  -0.289   9.541
  220    HE2  PHE  37           1HE      PHE  37  -4.500   2.860  10.977
  221    HZ   PHE  37           HZ       PHE  37  -5.965   0.930  11.419
  222    H    CYS  38           H        CYS  38  -4.325   5.166   5.701
  223    HA   CYS  38           HA       CYS  38  -4.767   5.825   2.891
  224    HB3  CYS  38           2HB      CYS  38  -4.613   7.611   4.661
  225    H    GLU  39           H        GLU  39  -2.908   6.126   1.459
  226    HA   GLU  39           HA       GLU  39  -1.419   3.922   1.000
  227    HB3  GLU  39           2HB      GLU  39   0.355   5.753   0.128
  228    HG3  GLU  39           2HG      GLU  39  -2.168   5.864  -1.383
  229    H    SER  40           H        SER  40  -0.291   6.719   2.893
  230    HA   SER  40           HA       SER  40   2.214   5.705   3.583
  231    HB3  SER  40           2HB      SER  40   1.751   7.240   5.712
  232    HG   SER  40           HG       SER  40   1.970   8.191   3.046
  233    H    CYS  41           H        CYS  41  -0.159   6.168   6.145
  234    HA   CYS  41           HA       CYS  41   0.687   4.442   7.987
  235    HB3  CYS  41           2HB      CYS  41  -1.666   4.069   8.682
  236    H    MET  42           H        MET  42  -1.115   3.501   5.098
  237    HA   MET  42           HA       MET  42  -1.479   0.795   5.705
  238    HB3  MET  42           2HB      MET  42  -1.191   2.218   3.060
  239    HG3  MET  42           2HG      MET  42  -0.800  -0.417   3.203
  240    HE1  MET  42           3HE      MET  42  -2.376  -1.031   5.499
  241    HE2  MET  42           1HE      MET  42  -3.391   0.394   5.282
  242    HE3  MET  42           2HE      MET  42  -4.128  -1.205   5.390
  243    H    ALA  43           H        ALA  43   1.063   2.301   3.704
  244    HA   ALA  43           HA       ALA  43   2.565  -0.038   3.319
  245    HB1  ALA  43           3HB      ALA  43   2.957   2.837   2.894
  246    HB2  ALA  43           1HB      ALA  43   4.441   1.918   3.147
  247    HB3  ALA  43           2HB      ALA  43   3.337   1.469   1.846
  248    H    ALA  44           H        ALA  44   2.160   1.900   6.083
  249    HA   ALA  44           HA       ALA  44   4.707   1.290   7.292
  250    HB1  ALA  44           3HB      ALA  44   2.525   3.066   7.824
  251    HB2  ALA  44           1HB      ALA  44   2.910   2.142   9.276
  252    HB3  ALA  44           2HB      ALA  44   4.165   3.087   8.474
  253    H    LEU  45           H        LEU  45   1.337   0.497   8.170
  254    HA   LEU  45           HA       LEU  45   1.852  -1.355  10.141
  255    HB3  LEU  45           2HB      LEU  45  -0.352  -2.292   9.665
  256    HG   LEU  45           HG       LEU  45  -0.355   0.705   9.316
  257   HD11  LEU  45          1HD1      LEU  45  -2.678   0.632   9.974
  258   HD12  LEU  45          2HD1      LEU  45  -2.621  -1.127  10.090
  259   HD13  LEU  45          3HD1      LEU  45  -2.439  -0.340   8.521
  260   HD21  LEU  45          3HD2      LEU  45   0.260  -0.960  11.527
  261   HD22  LEU  45          1HD2      LEU  45  -1.294  -0.189  11.842
  262   HD23  LEU  45          2HD2      LEU  45   0.122   0.798  11.480
  263    H    LEU  46           H        LEU  46   1.298  -2.054   6.687
  264    HA   LEU  46           HA       LEU  46   1.684  -4.782   6.726
  265    HB3  LEU  46           2HB      LEU  46   2.274  -4.620   4.382
  266    HG   LEU  46           HG       LEU  46   0.161  -2.632   5.179
  267   HD11  LEU  46          1HD1      LEU  46  -0.512  -2.498   2.872
  268   HD12  LEU  46          2HD1      LEU  46   0.793  -3.581   2.389
  269   HD13  LEU  46          3HD1      LEU  46   1.167  -1.976   3.018
  270   HD21  LEU  46          3HD2      LEU  46  -1.365  -4.319   4.711
  271   HD22  LEU  46          1HD2      LEU  46  -0.044  -5.187   5.493
  272   HD23  LEU  46          2HD2      LEU  46  -0.211  -5.231   3.737
  273    H    SER  47           H        SER  47   4.046  -2.236   6.961
  274    HA   SER  47           HA       SER  47   6.276  -4.068   6.599
  275    HB3  SER  47           2HB      SER  47   6.908  -1.377   7.574
  276    HG   SER  47           HG       SER  47   7.606  -2.177   5.029
  277    H    SER  48           H        SER  48   4.369  -4.294   8.876
  278    HA   SER  48           HA       SER  48   6.242  -3.874  11.110
  279    HB3  SER  48           2HB      SER  48   3.230  -4.167  11.114
  280    HG   SER  48           HG       SER  48   3.899  -3.396  13.437
  281    H    SER  49           H        SER  49   5.805  -6.164   9.059
  282    HA   SER  49           HA       SER  49   6.241  -8.405   9.098
  283    HB3  SER  49           2HB      SER  49   7.205  -9.386  10.966
  284    HG   SER  49           HG       SER  49   8.437  -7.806  11.949
  285    H    SER  50           H        SER  50   4.239  -7.772  11.985
  286    HA   SER  50           HA       SER  50   2.262  -9.671  10.906
  287    HB3  SER  50           2HB      SER  50   1.661  -9.324  13.599
  288    HG   SER  50           HG       SER  50   3.418 -11.366  12.886
  289    HA   PRO  51           HA       PRO  51   0.342  -5.417  10.934
  290    HB3  PRO  51           2HB      PRO  51   1.025  -4.970   8.786
  291    HG3  PRO  51           2HG      PRO  51   1.557  -6.689   7.314
  292    HD3  PRO  51           2HD      PRO  51   2.812  -7.327   9.140
  293    H    LYS  52           H        LYS  52  -1.573  -5.389  11.911
  294    HA   LYS  52           HA       LYS  52  -3.573  -7.420  11.166
  295    HB3  LYS  52           2HB      LYS  52  -4.358  -7.452  13.356
  296    HG3  LYS  52           2HG      LYS  52  -1.402  -7.010  13.404
  297    HD3  LYS  52           2HD      LYS  52  -2.975  -7.863  15.820
  298    HE3  LYS  52           2HE      LYS  52  -0.672  -6.771  16.701
  299    HZ1  LYS  52           3HZ      LYS  52  -1.024  -8.847  17.502
  300    HZ2  LYS  52           1HZ      LYS  52   0.183  -9.230  16.382
  301    HZ3  LYS  52           2HZ      LYS  52  -1.442  -9.499  15.998
  302    H    CYS  53           H        CYS  53  -3.700  -4.232  12.754
  303    HA   CYS  53           HA       CYS  53  -4.758  -2.632  10.878
  304    HB3  CYS  53           2HB      CYS  53  -6.823  -4.587  11.815
  305    H    THR  54           H        THR  54  -3.993  -1.017  12.151
  306    HA   THR  54           HA       THR  54  -3.984  -0.555  14.767
  307    HB   THR  54           HB       THR  54  -4.047   1.158  12.468
  308    HG1  THR  54           1HG      THR  54  -3.124   1.544  15.140
  309   HG21  THR  54          3HG2      THR  54  -4.907   3.204  13.606
  310   HG22  THR  54          1HG2      THR  54  -5.542   2.172  14.888
  311   HG23  THR  54          2HG2      THR  54  -6.160   2.017  13.242
  312    H    ALA  55           H        ALA  55  -6.855  -0.107  12.737
  313    HA   ALA  55           HA       ALA  55  -8.608   0.981  14.562
  314    HB1  ALA  55           3HB      ALA  55  -8.795  -0.127  12.012
  315    HB2  ALA  55           1HB      ALA  55  -9.943  -1.038  12.994
  316    HB3  ALA  55           2HB      ALA  55 -10.061   0.719  12.901
  317    H    CYS  56           H        CYS  56  -8.922  -2.451  13.721
  318    HA   CYS  56           HA       CYS  56  -9.449  -3.006  16.566
  319    HB3  CYS  56           2HB      CYS  56 -11.410  -3.378  15.175
  320    H    GLN  57           H        GLN  57  -7.634  -3.925  13.744
  321    HA   GLN  57           HA       GLN  57  -5.630  -5.060  13.655
  322    HB3  GLN  57           2HB      GLN  57  -4.549  -5.835  15.564
  323    HG3  GLN  57           2HG      GLN  57  -6.025  -4.282  17.426
  324   HE21  GLN  57          1HE2      GLN  57  -3.504  -4.347  14.969
  325   HE22  GLN  57          2HE2      GLN  57  -2.270  -3.648  15.955
  326    H    GLU  58           H        GLU  58  -6.177  -6.512  12.124
  327    HA   GLU  58           HA       GLU  58  -7.113  -9.127  13.053
  328    HB3  GLU  58           2HB      GLU  58  -8.354  -8.957  10.626
  329    HG3  GLU  58           2HG      GLU  58 -10.117  -7.891  12.639
  330    H    SER  59           H        SER  59  -6.182  -7.426  10.056
  331    HA   SER  59           HA       SER  59  -3.762  -8.696   9.641
  332    HB3  SER  59           2HB      SER  59  -5.029 -10.144   7.619
  333    HG   SER  59           HG       SER  59  -4.552 -11.879   9.396
  334    H    ILE  60           H        ILE  60  -2.750  -7.493   8.178
  335    HA   ILE  60           HA       ILE  60  -4.355  -6.202   6.071
  336    HB   ILE  60           HB       ILE  60  -1.854  -4.886   6.984
  337   HG13  ILE  60          2HG1      ILE  60  -3.114  -5.538   9.070
  338   HG21  ILE  60          1HG2      ILE  60  -4.273  -3.305   6.613
  339   HG22  ILE  60          2HG2      ILE  60  -2.687  -3.143   5.863
  340   HG23  ILE  60          3HG2      ILE  60  -3.858  -4.285   5.206
  341   HD11  ILE  60          3HD1      ILE  60  -2.435  -3.697  10.106
  342   HD12  ILE  60          1HD1      ILE  60  -1.908  -3.142   8.517
  343   HD13  ILE  60          2HD1      ILE  60  -3.485  -2.661   9.141
  344    H    VAL  61           H        VAL  61  -3.746  -6.656   4.063
  345    HA   VAL  61           HA       VAL  61  -0.946  -7.178   3.455
  346    HB   VAL  61           HB       VAL  61  -3.138  -9.186   2.936
  347   HG11  VAL  61          1HG1      VAL  61  -2.061  -9.318   0.922
  348   HG12  VAL  61          2HG1      VAL  61  -0.521  -8.764   1.583
  349   HG13  VAL  61          3HG1      VAL  61  -1.064 -10.417   1.874
  350   HG21  VAL  61          3HG2      VAL  61  -1.440 -10.708   4.033
  351   HG22  VAL  61          1HG2      VAL  61  -0.560  -9.248   4.488
  352   HG23  VAL  61          2HG2      VAL  61  -2.200  -9.512   5.085
  353    H    LYS  62           H        LYS  62  -0.398  -6.210   1.615
  354    HA   LYS  62           HA       LYS  62  -2.084  -4.611   0.125
  355    HB3  LYS  62           2HB      LYS  62   0.292  -4.304  -0.001
  356    HG3  LYS  62           2HG      LYS  62   0.550  -6.872  -1.537
  357    HD3  LYS  62           2HD      LYS  62   2.574  -5.031  -0.263
  358    HE3  LYS  62           2HE      LYS  62   2.717  -7.759  -1.325
  359    HZ1  LYS  62           3HZ      LYS  62   5.026  -7.264  -2.198
  360    HZ2  LYS  62           1HZ      LYS  62   4.536  -5.650  -2.318
  361    HZ3  LYS  62           2HZ      LYS  62   3.732  -6.846  -3.204
  362    H    ASP  63           H        ASP  63  -1.201  -7.985  -0.393
  363    HA   ASP  63           HA       ASP  63  -2.351  -8.310  -2.932
  364    HB3  ASP  63           2HB      ASP  63  -2.100 -10.629  -2.608
  365    H    LYS  64           H        LYS  64  -3.713  -8.599   0.312
  366    HA   LYS  64           HA       LYS  64  -6.313  -9.355  -0.740
  367    HB3  LYS  64           2HB      LYS  64  -6.961  -9.757   1.482
  368    HG3  LYS  64           2HG      LYS  64  -5.088 -10.911   2.610
  369    HD3  LYS  64           2HD      LYS  64  -6.036 -11.399  -0.096
  370    HE3  LYS  64           2HE      LYS  64  -3.282 -12.250   0.684
  371    HZ1  LYS  64           3HZ      LYS  64  -4.220 -14.352   0.399
  372    HZ2  LYS  64           1HZ      LYS  64  -3.571 -13.990  -1.121
  373    HZ3  LYS  64           2HZ      LYS  64  -5.235 -13.848  -0.856
  374    H    VAL  65           H        VAL  65  -4.636  -6.514  -0.254
  375    HA   VAL  65           HA       VAL  65  -6.939  -4.904   0.492
  376    HB   VAL  65           HB       VAL  65  -4.056  -4.519   0.444
  377   HG11  VAL  65          1HG1      VAL  65  -4.082  -2.136  -0.098
  378   HG12  VAL  65          2HG1      VAL  65  -4.567  -3.113  -1.485
  379   HG13  VAL  65          3HG1      VAL  65  -5.785  -2.252  -0.542
  380   HG21  VAL  65          3HG2      VAL  65  -6.417  -3.370   1.890
  381   HG22  VAL  65          1HG2      VAL  65  -5.100  -4.362   2.519
  382   HG23  VAL  65          2HG2      VAL  65  -4.807  -2.677   2.086
  383    H    PHE  66           H        PHE  66  -7.948  -3.404  -0.820
  384    HA   PHE  66           HA       PHE  66  -7.358  -3.643  -3.698
  385    HB3  PHE  66           2HB      PHE  66  -9.840  -2.947  -3.921
  386    HD1  PHE  66           1HD      PHE  66  -8.972  -4.701  -5.555
  387    HD2  PHE  66           2HD      PHE  66 -10.301  -5.623  -1.618
  388    HE1  PHE  66           1HE      PHE  66  -9.286  -7.051  -6.215
  389    HE2  PHE  66           2HE      PHE  66 -10.616  -7.974  -2.271
  390    HZ   PHE  66           HZ       PHE  66 -10.108  -8.691  -4.572
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1 -32.975  35.986   5.811
    2    HA2  GLY   1           1HA      GLY   1 -32.307  33.321   5.094
    3    HA3  GLY   1           2HA      GLY   1 -31.584  34.780   4.434
    4    H    SER   2           H        SER   2 -31.443  32.465   7.083
    5    HA   SER   2           HA       SER   2 -28.596  32.558   7.145
    6    HB3  SER   2           2HB      SER   2 -28.439  33.320   9.548
    7    HG   SER   2           HG       SER   2 -27.827  34.992   8.423
    8    H    SER   3           H        SER   3 -27.830  31.332   9.259
    9    HA   SER   3           HA       SER   3 -29.560  29.513  10.516
   10    HB3  SER   3           2HB      SER   3 -29.280  28.784   7.913
   11    HG   SER   3           HG       SER   3 -27.558  27.616   7.608
   12    H    GLY   4           H        GLY   4 -28.307  27.691  11.587
   13    HA2  GLY   4           1HA      GLY   4 -25.681  27.268  11.807
   14    HA3  GLY   4           2HA      GLY   4 -25.831  28.824  12.610
   15    H    SER   5           H        SER   5 -27.524  25.683  12.614
   16    HA   SER   5           HA       SER   5 -26.930  25.059  15.279
   17    HB3  SER   5           2HB      SER   5 -28.790  27.105  15.166
   18    HG   SER   5           HG       SER   5 -30.748  26.284  15.405
   19    H    SER   6           H        SER   6 -27.222  22.939  15.477
   20    HA   SER   6           HA       SER   6 -29.264  21.645  13.790
   21    HB3  SER   6           2HB      SER   6 -26.449  21.263  13.771
   22    HG   SER   6           HG       SER   6 -27.711  18.824  14.364
   23    H    GLY   7           H        GLY   7 -30.420  19.935  14.670
   24    HA2  GLY   7           1HA      GLY   7 -30.756  20.005  17.506
   25    HA3  GLY   7           2HA      GLY   7 -31.582  18.930  16.387
   26    H    PHE   8           H        PHE   8 -31.330  16.936  17.161
   27    HA   PHE   8           HA       PHE   8 -29.479  15.911  18.843
   28    HB3  PHE   8           2HB      PHE   8 -31.507  14.762  17.742
   29    HD1  PHE   8           2HD      PHE   8 -28.614  12.934  16.408
   30    HD2  PHE   8           1HD      PHE   8 -32.154  15.105  15.473
   31    HE1  PHE   8           2HE      PHE   8 -28.481  12.142  14.082
   32    HE2  PHE   8           1HE      PHE   8 -32.028  14.315  13.146
   33    HZ   PHE   8           HZ       PHE   8 -30.189  12.833  12.448
   34    H    VAL   9           H        VAL   9 -27.632  14.451  18.492
   35    HA   VAL   9           HA       VAL   9 -25.466  15.587  17.347
   36    HB   VAL   9           HB       VAL   9 -25.233  13.630  18.738
   37   HG11  VAL   9          1HG1      VAL   9 -26.381  12.043  16.443
   38   HG12  VAL   9          2HG1      VAL   9 -25.804  11.398  17.982
   39   HG13  VAL   9          3HG1      VAL   9 -27.232  12.434  17.937
   40   HG21  VAL   9          3HG2      VAL   9 -23.952  13.851  16.132
   41   HG22  VAL   9          1HG2      VAL   9 -23.244  13.565  17.722
   42   HG23  VAL   9          2HG2      VAL   9 -23.896  12.215  16.791
   43    H    LYS  10           H        LYS  10 -24.754  16.029  15.366
   44    HA   LYS  10           HA       LYS  10 -25.805  14.481  13.099
   45    HB3  LYS  10           2HB      LYS  10 -25.561  17.490  13.264
   46    HG3  LYS  10           2HG      LYS  10 -25.046  16.219  10.996
   47    HD3  LYS  10           2HD      LYS  10 -28.045  16.533  10.928
   48    HE3  LYS  10           2HE      LYS  10 -27.185  16.866   8.762
   49    HZ1  LYS  10           3HZ      LYS  10 -25.275  14.727   9.448
   50    HZ2  LYS  10           1HZ      LYS  10 -24.966  16.271   8.829
   51    HZ3  LYS  10           2HZ      LYS  10 -25.627  15.077   7.831
   52    H    THR  11           H        THR  11 -24.350  13.975  11.540
   53    HA   THR  11           HA       THR  11 -21.724  15.269  11.574
   54    HB   THR  11           HB       THR  11 -21.531  12.374  11.174
   55    HG1  THR  11           1HG      THR  11 -21.626  12.090  13.565
   56   HG21  THR  11          3HG2      THR  11 -19.471  13.346  11.383
   57   HG22  THR  11          1HG2      THR  11 -19.753  12.912  13.068
   58   HG23  THR  11          2HG2      THR  11 -20.040  14.565  12.523
   59    H    VAL  12           H        VAL  12 -20.488  14.939   9.633
   60    HA   VAL  12           HA       VAL  12 -22.205  14.352   7.317
   61    HB   VAL  12           HB       VAL  12 -21.286  16.640   7.415
   62   HG11  VAL  12          1HG1      VAL  12 -19.018  15.470   8.380
   63   HG12  VAL  12          2HG1      VAL  12 -18.559  15.841   6.717
   64   HG13  VAL  12          3HG1      VAL  12 -19.130  17.125   7.783
   65   HG21  VAL  12          3HG2      VAL  12 -20.671  14.746   5.221
   66   HG22  VAL  12          1HG2      VAL  12 -21.706  16.173   5.231
   67   HG23  VAL  12          2HG2      VAL  12 -19.956  16.355   5.123
   68    H    GLU  13           H        GLU  13 -21.887  12.428   6.429
   69    HA   GLU  13           HA       GLU  13 -19.208  11.224   6.569
   70    HB3  GLU  13           2HB      GLU  13 -20.294   9.076   6.238
   71    HG3  GLU  13           2HG      GLU  13 -20.459  10.434   8.541
   72    H    ASP  14           H        ASP  14 -18.066  11.610   4.790
   73    HA   ASP  14           HA       ASP  14 -19.165  10.859   2.214
   74    HB3  ASP  14           2HB      ASP  14 -17.872  13.314   1.687
   75    H    LYS  15           H        LYS  15 -17.671   9.820   1.065
   76    HA   LYS  15           HA       LYS  15 -15.664   9.059   0.306
   77    HB3  LYS  15           2HB      LYS  15 -13.796  10.510   0.236
   78    HG3  LYS  15           2HG      LYS  15 -16.412  11.765  -0.074
   79    HD3  LYS  15           2HD      LYS  15 -15.240  13.433   1.372
   80    HE3  LYS  15           2HE      LYS  15 -13.008  12.766  -0.051
   81    HZ1  LYS  15           3HZ      LYS  15 -14.318  14.782  -1.536
   82    HZ2  LYS  15           1HZ      LYS  15 -12.852  14.003  -1.863
   83    HZ3  LYS  15           2HZ      LYS  15 -12.874  15.395  -0.902
   84    H    TYR  16           H        TYR  16 -13.931   7.782   1.018
   85    HA   TYR  16           HA       TYR  16 -14.185   6.782   3.659
   86    HB3  TYR  16           2HB      TYR  16 -12.446   5.244   3.080
   87    HD1  TYR  16           1HD      TYR  16 -13.219   6.517  -0.298
   88    HD2  TYR  16           2HD      TYR  16 -14.253   3.725   2.742
   89    HE1  TYR  16           1HE      TYR  16 -14.656   5.320  -1.895
   90    HE2  TYR  16           2HE      TYR  16 -15.692   2.520   1.153
   91    HH   TYR  16           HH       TYR  16 -16.671   2.605  -0.876
   92    H    LYS  17           H        LYS  17 -12.208   6.491   5.089
   93    HA   LYS  17           HA       LYS  17 -10.314   8.688   5.031
   94    HB3  LYS  17           2HB      LYS  17 -12.513   8.446   7.042
   95    HG3  LYS  17           2HG      LYS  17 -10.788  10.286   8.149
   96    HD3  LYS  17           2HD      LYS  17 -10.398   8.165   9.752
   97    HE3  LYS  17           2HE      LYS  17 -12.362  10.247   9.493
   98    HZ1  LYS  17           3HZ      LYS  17 -13.316   7.645  10.536
   99    HZ2  LYS  17           1HZ      LYS  17 -14.062   8.652   9.398
  100    HZ3  LYS  17           2HZ      LYS  17 -13.992   9.118  11.023
  101    H    CYS  18           H        CYS  18  -8.422   8.234   6.079
  102    HA   CYS  18           HA       CYS  18  -7.807   5.538   6.611
  103    HB3  CYS  18           2HB      CYS  18  -6.329   8.091   7.260
  104    H    GLU  19           H        GLU  19  -7.616   4.380   8.475
  105    HA   GLU  19           HA       GLU  19  -9.021   5.413  10.783
  106    HB3  GLU  19           2HB      GLU  19  -8.204   2.972  11.580
  107    HG3  GLU  19           2HG      GLU  19 -10.262   2.035  10.791
  108    H    LYS  20           H        LYS  20  -6.342   6.462  10.005
  109    HA   LYS  20           HA       LYS  20  -5.038   6.054  12.609
  110    HB3  LYS  20           2HB      LYS  20  -3.085   6.655  10.587
  111    HG3  LYS  20           2HG      LYS  20  -3.536   4.396  12.499
  112    HD3  LYS  20           2HD      LYS  20  -1.211   4.652  10.592
  113    HE3  LYS  20           2HE      LYS  20  -0.222   2.953  11.694
  114    HZ1  LYS  20           3HZ      LYS  20  -0.481   3.071  13.998
  115    HZ2  LYS  20           1HZ      LYS  20  -2.119   3.484  13.898
  116    HZ3  LYS  20           2HZ      LYS  20  -0.935   4.608  13.455
  117    H    CYS  21           H        CYS  21  -4.670   8.058   9.676
  118    HA   CYS  21           HA       CYS  21  -4.291  10.397  11.403
  119    HB3  CYS  21           2HB      CYS  21  -2.521  10.155   9.821
  120    H    HIS  22           H        HIS  22  -6.800   8.888  10.062
  121    HA   HIS  22           HA       HIS  22  -8.915   9.473   9.463
  122    HB3  HIS  22           2HB      HIS  22  -9.787  10.980  10.877
  123    HD2  HIS  22           2HD      HIS  22  -7.634   9.289  12.482
  124    HE1  HIS  22           1HE      HIS  22  -6.310  12.981  14.101
  125    HE2  HIS  22           2HE      HIS  22  -6.225  10.472  14.301
  126    H    LEU  23           H        LEU  23  -6.608   9.965   7.639
  127    HA   LEU  23           HA       LEU  23  -7.142  12.311   6.126
  128    HB3  LEU  23           2HB      LEU  23  -5.890  10.685   4.360
  129    HG   LEU  23           HG       LEU  23  -3.680  11.357   5.690
  130   HD11  LEU  23          1HD1      LEU  23  -3.701  13.452   4.463
  131   HD12  LEU  23          2HD1      LEU  23  -5.444  13.322   4.234
  132   HD13  LEU  23          3HD1      LEU  23  -4.365  12.151   3.475
  133   HD21  LEU  23          3HD2      LEU  23  -3.888  13.005   7.245
  134   HD22  LEU  23          1HD2      LEU  23  -5.395  12.141   7.557
  135   HD23  LEU  23          2HD2      LEU  23  -5.405  13.604   6.572
  136    H    VAL  24           H        VAL  24  -8.921  12.658   4.985
  137    HA   VAL  24           HA       VAL  24 -10.719  10.599   4.213
  138    HB   VAL  24           HB       VAL  24 -10.589  13.482   3.315
  139   HG11  VAL  24          1HG1      VAL  24 -12.615  11.317   2.865
  140   HG12  VAL  24          2HG1      VAL  24 -13.074  13.021   2.857
  141   HG13  VAL  24          3HG1      VAL  24 -11.891  12.421   1.695
  142   HG21  VAL  24          3HG2      VAL  24 -10.892  13.120   5.755
  143   HG22  VAL  24          1HG2      VAL  24 -12.269  13.907   4.982
  144   HG23  VAL  24          2HG2      VAL  24 -12.349  12.195   5.398
  145    H    LEU  25           H        LEU  25 -10.451   9.227   2.591
  146    HA   LEU  25           HA       LEU  25  -9.098  10.174   0.151
  147    HB3  LEU  25           2HB      LEU  25  -7.620   8.535   0.301
  148    HG   LEU  25           HG       LEU  25  -8.956   8.041   2.916
  149   HD11  LEU  25          1HD1      LEU  25  -7.999   5.900   1.431
  150   HD12  LEU  25          2HD1      LEU  25  -8.275   5.941   3.173
  151   HD13  LEU  25          3HD1      LEU  25  -6.676   6.307   2.525
  152   HD21  LEU  25          3HD2      LEU  25  -6.626   8.408   3.698
  153   HD22  LEU  25          1HD2      LEU  25  -7.297   9.770   2.800
  154   HD23  LEU  25          2HD2      LEU  25  -6.149   8.681   2.022
  155    H    CYS  26           H        CYS  26  -9.640   8.757  -1.781
  156    HA   CYS  26           HA       CYS  26 -12.540   8.326  -1.799
  157    HB3  CYS  26           2HB      CYS  26 -10.552   9.222  -3.789
  158    H    SER  27           H        SER  27  -9.487   6.768  -2.648
  159    HA   SER  27           HA       SER  27 -10.918   4.194  -2.736
  160    HB3  SER  27           2HB      SER  27  -8.922   5.331  -4.649
  161    HG   SER  27           HG       SER  27  -9.281   2.581  -4.705
  162    HA   PRO  28           HA       PRO  28  -7.635   4.055   0.516
  163    HB3  PRO  28           2HB      PRO  28  -9.188   4.463   2.159
  164    HG3  PRO  28           2HG      PRO  28 -11.440   3.992   1.823
  165    HD3  PRO  28           2HD      PRO  28 -10.997   5.194  -0.093
  166    H    LYS  29           H        LYS  29  -7.502   1.810   2.052
  167    HA   LYS  29           HA       LYS  29  -7.375  -0.393   0.100
  168    HB3  LYS  29           2HB      LYS  29  -5.235  -0.944   0.705
  169    HG3  LYS  29           2HG      LYS  29  -3.818   0.933   0.895
  170    HD3  LYS  29           2HD      LYS  29  -5.859   2.551  -0.352
  171    HE3  LYS  29           2HE      LYS  29  -3.380   2.478  -0.815
  172    HZ1  LYS  29           3HZ      LYS  29  -3.552   0.505  -2.829
  173    HZ2  LYS  29           1HZ      LYS  29  -3.905  -0.191  -1.328
  174    HZ3  LYS  29           2HZ      LYS  29  -2.444   0.630  -1.557
  175    H    GLN  30           H        GLN  30  -9.618  -0.510   1.272
  176    HA   GLN  30           HA       GLN  30 -10.064  -1.264   3.834
  177    HB3  GLN  30           2HB      GLN  30 -11.369  -2.976   1.786
  178    HG3  GLN  30           2HG      GLN  30 -12.552  -1.123   3.838
  179   HE21  GLN  30          1HE2      GLN  30 -14.595  -2.574   4.623
  180   HE22  GLN  30          2HE2      GLN  30 -15.672  -2.936   3.323
  181    H    THR  31           H        THR  31  -9.010  -2.635   5.097
  182    HA   THR  31           HA       THR  31  -7.403  -4.760   4.133
  183    HB   THR  31           HB       THR  31  -6.895  -5.260   6.380
  184    HG1  THR  31           1HG      THR  31  -9.368  -3.996   7.001
  185   HG21  THR  31          3HG2      THR  31  -6.066  -3.257   7.106
  186   HG22  THR  31          1HG2      THR  31  -7.578  -2.398   6.813
  187   HG23  THR  31          2HG2      THR  31  -6.514  -2.795   5.463
  188    H    GLU  32           H        GLU  32  -8.118  -6.703   6.202
  189    HA   GLU  32           HA       GLU  32 -10.338  -7.981   4.777
  190    HB3  GLU  32           2HB      GLU  32  -8.723  -9.445   6.807
  191    HG3  GLU  32           2HG      GLU  32  -8.747 -10.983   4.600
  192    H    CYS  33           H        CYS  33 -10.287  -5.936   7.128
  193    HA   CYS  33           HA       CYS  33 -12.131  -7.443   8.866
  194    HB3  CYS  33           2HB      CYS  33  -9.962  -6.631   9.912
  195    H    GLY  34           H        GLY  34 -11.569  -4.537   7.020
  196    HA2  GLY  34           1HA      GLY  34 -13.789  -3.734   6.061
  197    HA3  GLY  34           2HA      GLY  34 -14.261  -3.570   7.745
  198    H    HIS  35           H        HIS  35 -12.032  -2.465   8.880
  199    HA   HIS  35           HA       HIS  35 -12.320   0.233   8.448
  200    HB3  HIS  35           2HB      HIS  35 -10.065   0.467   9.552
  201    HD2  HIS  35           2HD      HIS  35 -12.265   1.363  11.236
  202    HE1  HIS  35           1HE      HIS  35 -12.329  -2.263  13.437
  203    HE2  HIS  35           2HE      HIS  35 -13.174   0.106  13.304
  204    H    ARG  36           H        ARG  36 -10.428   1.730   7.772
  205    HA   ARG  36           HA       ARG  36  -9.089   0.742   5.363
  206    HB3  ARG  36           2HB      ARG  36  -9.747   2.903   4.209
  207    HG3  ARG  36           2HG      ARG  36 -11.646   0.696   4.794
  208    HD3  ARG  36           2HD      ARG  36 -12.601   2.598   2.794
  209    HE   ARG  36           HE       ARG  36 -14.339   1.737   4.917
  210   HH11  ARG  36          1HH1      ARG  36 -12.829   0.851   1.908
  211   HH12  ARG  36          2HH1      ARG  36 -14.017  -0.346   1.513
  212   HH21  ARG  36          1HH2      ARG  36 -15.911   0.163   4.408
  213   HH22  ARG  36          2HH2      ARG  36 -15.769  -0.736   2.936
  214    H    PHE  37           H        PHE  37  -7.332   2.113   4.644
  215    HA   PHE  37           HA       PHE  37  -6.405   4.112   6.562
  216    HB3  PHE  37           2HB      PHE  37  -4.077   3.017   6.383
  217    HD1  PHE  37           2HD      PHE  37  -6.562   0.470   7.346
  218    HD2  PHE  37           1HD      PHE  37  -4.037   3.633   8.665
  219    HE1  PHE  37           2HE      PHE  37  -6.979  -0.177   9.683
  220    HE2  PHE  37           1HE      PHE  37  -4.449   2.990  11.005
  221    HZ   PHE  37           HZ       PHE  37  -5.923   1.084  11.516
  222    H    CYS  38           H        CYS  38  -4.318   5.158   5.714
  223    HA   CYS  38           HA       CYS  38  -4.763   5.788   2.897
  224    HB3  CYS  38           2HB      CYS  38  -4.611   7.598   4.639
  225    H    GLU  39           H        GLU  39  -2.823   6.174   1.522
  226    HA   GLU  39           HA       GLU  39  -1.361   3.939   1.044
  227    HB3  GLU  39           2HB      GLU  39   0.428   5.686   0.157
  228    HG3  GLU  39           2HG      GLU  39  -2.320   5.735  -1.053
  229    H    SER  40           H        SER  40  -0.161   6.737   2.902
  230    HA   SER  40           HA       SER  40   2.292   5.671   3.646
  231    HB3  SER  40           2HB      SER  40   0.488   7.660   5.027
  232    HG   SER  40           HG       SER  40   1.917   7.868   6.579
  233    H    CYS  41           H        CYS  41  -0.098   6.177   6.183
  234    HA   CYS  41           HA       CYS  41   0.700   4.439   8.035
  235    HB3  CYS  41           2HB      CYS  41  -1.658   4.118   8.718
  236    H    MET  42           H        MET  42  -1.216   3.513   5.198
  237    HA   MET  42           HA       MET  42  -1.568   0.815   5.798
  238    HB3  MET  42           2HB      MET  42  -1.328   2.253   3.158
  239    HG3  MET  42           2HG      MET  42  -0.761  -0.095   2.784
  240    HE1  MET  42           3HE      MET  42  -3.470   0.227   5.613
  241    HE2  MET  42           1HE      MET  42  -4.313   0.459   4.082
  242    HE3  MET  42           2HE      MET  42  -4.644  -0.969   5.062
  243    H    ALA  43           H        ALA  43   0.960   2.294   3.760
  244    HA   ALA  43           HA       ALA  43   2.427  -0.054   3.326
  245    HB1  ALA  43           3HB      ALA  43   3.008   2.855   3.103
  246    HB2  ALA  43           1HB      ALA  43   4.354   1.717   3.034
  247    HB3  ALA  43           2HB      ALA  43   3.036   1.598   1.867
  248    H    ALA  44           H        ALA  44   2.260   2.065   6.056
  249    HA   ALA  44           HA       ALA  44   4.745   1.315   7.244
  250    HB1  ALA  44           3HB      ALA  44   4.211   3.178   8.342
  251    HB2  ALA  44           1HB      ALA  44   2.509   3.043   7.897
  252    HB3  ALA  44           2HB      ALA  44   3.124   2.181   9.308
  253    H    LEU  45           H        LEU  45   1.372   0.525   8.108
  254    HA   LEU  45           HA       LEU  45   1.908  -1.349  10.073
  255    HB3  LEU  45           2HB      LEU  45  -0.323  -2.221   9.668
  256    HG   LEU  45           HG       LEU  45  -0.256   0.772   9.308
  257   HD11  LEU  45          1HD1      LEU  45  -2.559   0.836   9.810
  258   HD12  LEU  45          2HD1      LEU  45  -2.600  -0.883  10.201
  259   HD13  LEU  45          3HD1      LEU  45  -2.374  -0.364   8.531
  260   HD21  LEU  45          3HD2      LEU  45  -1.103  -0.546  11.817
  261   HD22  LEU  45          1HD2      LEU  45  -0.214   0.957  11.566
  262   HD23  LEU  45          2HD2      LEU  45   0.618  -0.592  11.430
  263    H    LEU  46           H        LEU  46   1.299  -1.957   6.615
  264    HA   LEU  46           HA       LEU  46   1.594  -4.694   6.579
  265    HB3  LEU  46           2HB      LEU  46   2.234  -4.474   4.237
  266    HG   LEU  46           HG       LEU  46   0.117  -2.495   5.058
  267   HD11  LEU  46          1HD1      LEU  46   1.073  -3.295   2.328
  268   HD12  LEU  46          2HD1      LEU  46   0.803  -1.677   2.973
  269   HD13  LEU  46          3HD1      LEU  46  -0.570  -2.722   2.613
  270   HD21  LEU  46          3HD2      LEU  46  -1.226  -4.259   5.153
  271   HD22  LEU  46          1HD2      LEU  46   0.184  -5.297   4.936
  272   HD23  LEU  46          2HD2      LEU  46  -0.746  -4.768   3.533
  273    H    SER  47           H        SER  47   4.081  -2.217   6.675
  274    HA   SER  47           HA       SER  47   6.226  -4.130   6.342
  275    HB3  SER  47           2HB      SER  47   6.703  -1.339   7.304
  276    HG   SER  47           HG       SER  47   8.042  -2.263   5.121
  277    H    SER  48           H        SER  48   4.303  -4.238   8.657
  278    HA   SER  48           HA       SER  48   6.205  -3.920  10.877
  279    HB3  SER  48           2HB      SER  48   3.202  -4.305  10.976
  280    HG   SER  48           HG       SER  48   5.144  -4.384  12.868
  281    H    SER  49           H        SER  49   5.629  -6.189   8.777
  282    HA   SER  49           HA       SER  49   6.052  -8.435   8.773
  283    HB3  SER  49           2HB      SER  49   6.101  -8.698  11.732
  284    HG   SER  49           HG       SER  49   8.011  -9.865  11.154
  285    H    SER  50           H        SER  50   4.149  -7.736  11.711
  286    HA   SER  50           HA       SER  50   2.122  -9.633  10.726
  287    HB3  SER  50           2HB      SER  50   1.492  -9.549  13.304
  288    HG   SER  50           HG       SER  50   2.748 -11.386  13.554
  289    HA   PRO  51           HA       PRO  51   0.269  -5.344  10.825
  290    HB3  PRO  51           2HB      PRO  51   0.910  -4.883   8.667
  291    HG3  PRO  51           2HG      PRO  51   1.386  -6.595   7.166
  292    HD3  PRO  51           2HD      PRO  51   2.673  -7.267   8.956
  293    H    LYS  52           H        LYS  52  -1.625  -5.299  11.843
  294    HA   LYS  52           HA       LYS  52  -3.665  -7.299  11.127
  295    HB3  LYS  52           2HB      LYS  52  -4.402  -7.338  13.333
  296    HG3  LYS  52           2HG      LYS  52  -1.442  -6.924  13.324
  297    HD3  LYS  52           2HD      LYS  52  -2.984  -7.775  15.761
  298    HE3  LYS  52           2HE      LYS  52  -0.141  -7.191  15.082
  299    HZ1  LYS  52           3HZ      LYS  52   0.439  -6.566  17.189
  300    HZ2  LYS  52           1HZ      LYS  52  -0.954  -7.211  17.902
  301    HZ3  LYS  52           2HZ      LYS  52  -1.040  -5.756  17.042
  302    H    CYS  53           H        CYS  53  -3.718  -4.120  12.737
  303    HA   CYS  53           HA       CYS  53  -4.794  -2.493  10.898
  304    HB3  CYS  53           2HB      CYS  53  -6.862  -4.434  11.852
  305    H    THR  54           H        THR  54  -3.985  -0.901  12.175
  306    HA   THR  54           HA       THR  54  -3.923  -0.462  14.793
  307    HB   THR  54           HB       THR  54  -4.014   1.276  12.510
  308    HG1  THR  54           1HG      THR  54  -2.970   1.448  15.152
  309   HG21  THR  54          3HG2      THR  54  -6.128   2.096  13.421
  310   HG22  THR  54          1HG2      THR  54  -4.860   3.309  13.600
  311   HG23  THR  54          2HG2      THR  54  -5.365   2.349  14.991
  312    H    ALA  55           H        ALA  55  -6.825   0.040  12.820
  313    HA   ALA  55           HA       ALA  55  -8.532   1.130  14.684
  314    HB1  ALA  55           3HB      ALA  55 -10.020   0.897  13.051
  315    HB2  ALA  55           1HB      ALA  55  -8.777   0.048  12.130
  316    HB3  ALA  55           2HB      ALA  55  -9.915  -0.863  13.124
  317    H    CYS  56           H        CYS  56  -8.899  -2.291  13.825
  318    HA   CYS  56           HA       CYS  56  -9.375  -2.863  16.675
  319    HB3  CYS  56           2HB      CYS  56 -11.373  -3.196  15.332
  320    H    GLN  57           H        GLN  57  -7.628  -3.774  13.810
  321    HA   GLN  57           HA       GLN  57  -5.641  -4.933  13.672
  322    HB3  GLN  57           2HB      GLN  57  -4.535  -5.736  15.548
  323    HG3  GLN  57           2HG      GLN  57  -6.012  -4.216  17.453
  324   HE21  GLN  57          1HE2      GLN  57  -4.429  -1.837  16.203
  325   HE22  GLN  57          2HE2      GLN  57  -2.821  -2.123  16.767
  326    H    GLU  58           H        GLU  58  -6.185  -6.376  12.141
  327    HA   GLU  58           HA       GLU  58  -7.153  -8.985  13.042
  328    HB3  GLU  58           2HB      GLU  58  -8.403  -8.666  10.586
  329    HG3  GLU  58           2HG      GLU  58 -10.099  -7.936  12.845
  330    H    SER  59           H        SER  59  -6.265  -7.243  10.055
  331    HA   SER  59           HA       SER  59  -3.869  -8.534   9.570
  332    HB3  SER  59           2HB      SER  59  -5.616  -9.859   7.636
  333    HG   SER  59           HG       SER  59  -3.450 -10.428   7.899
  334    H    ILE  60           H        ILE  60  -2.871  -7.315   8.111
  335    HA   ILE  60           HA       ILE  60  -4.499  -5.982   6.047
  336    HB   ILE  60           HB       ILE  60  -1.992  -4.675   6.953
  337   HG13  ILE  60          2HG1      ILE  60  -3.216  -5.371   9.045
  338   HG21  ILE  60          1HG2      ILE  60  -2.826  -3.139   5.585
  339   HG22  ILE  60          2HG2      ILE  60  -4.331  -4.042   5.422
  340   HG23  ILE  60          3HG2      ILE  60  -4.138  -2.881   6.735
  341   HD11  ILE  60          3HD1      ILE  60  -1.831  -3.218   8.811
  342   HD12  ILE  60          1HD1      ILE  60  -3.394  -2.400   8.798
  343   HD13  ILE  60          2HD1      ILE  60  -2.923  -3.382  10.186
  344    H    VAL  61           H        VAL  61  -4.017  -6.877   4.154
  345    HA   VAL  61           HA       VAL  61  -1.182  -7.248   3.469
  346    HB   VAL  61           HB       VAL  61  -3.416  -9.199   2.909
  347   HG11  VAL  61          1HG1      VAL  61  -1.245 -10.453   1.972
  348   HG12  VAL  61          2HG1      VAL  61  -2.292  -9.458   0.958
  349   HG13  VAL  61          3HG1      VAL  61  -0.794  -8.788   1.605
  350   HG21  VAL  61          3HG2      VAL  61  -1.685 -10.744   4.039
  351   HG22  VAL  61          1HG2      VAL  61  -0.970  -9.247   4.637
  352   HG23  VAL  61          2HG2      VAL  61  -2.635  -9.657   5.053
  353    H    LYS  62           H        LYS  62  -0.624  -6.277   1.634
  354    HA   LYS  62           HA       LYS  62  -2.296  -4.645   0.158
  355    HB3  LYS  62           2HB      LYS  62   0.055  -4.319   0.000
  356    HG3  LYS  62           2HG      LYS  62   0.656  -6.688  -1.632
  357    HD3  LYS  62           2HD      LYS  62   2.425  -6.240   0.555
  358    HE3  LYS  62           2HE      LYS  62   4.019  -5.746  -1.185
  359    HZ1  LYS  62           3HZ      LYS  62   2.323  -7.997  -1.285
  360    HZ2  LYS  62           1HZ      LYS  62   3.969  -7.893  -1.663
  361    HZ3  LYS  62           2HZ      LYS  62   2.808  -7.598  -2.856
  362    H    ASP  63           H        ASP  63  -1.393  -8.011  -0.432
  363    HA   ASP  63           HA       ASP  63  -2.646  -8.262  -2.948
  364    HB3  ASP  63           2HB      ASP  63  -2.426 -10.658  -2.631
  365    H    LYS  64           H        LYS  64  -3.823  -8.521   0.334
  366    HA   LYS  64           HA       LYS  64  -6.447  -9.414  -0.610
  367    HB3  LYS  64           2HB      LYS  64  -6.965  -9.918   1.659
  368    HG3  LYS  64           2HG      LYS  64  -4.498 -10.878   2.389
  369    HD3  LYS  64           2HD      LYS  64  -6.099 -12.355   0.353
  370    HE3  LYS  64           2HE      LYS  64  -5.160 -13.158   3.100
  371    HZ1  LYS  64           3HZ      LYS  64  -5.217 -15.390   1.861
  372    HZ2  LYS  64           1HZ      LYS  64  -6.234 -14.601   0.764
  373    HZ3  LYS  64           2HZ      LYS  64  -6.680 -14.728   2.390
  374    H    VAL  65           H        VAL  65  -4.902  -6.570  -0.313
  375    HA   VAL  65           HA       VAL  65  -7.062  -5.058   0.914
  376    HB   VAL  65           HB       VAL  65  -4.275  -4.602   0.441
  377   HG11  VAL  65          1HG1      VAL  65  -5.058  -3.401  -1.570
  378   HG12  VAL  65          2HG1      VAL  65  -6.058  -2.376  -0.539
  379   HG13  VAL  65          3HG1      VAL  65  -4.301  -2.334  -0.389
  380   HG21  VAL  65          3HG2      VAL  65  -4.970  -4.151   2.577
  381   HG22  VAL  65          1HG2      VAL  65  -4.965  -2.522   1.903
  382   HG23  VAL  65          2HG2      VAL  65  -6.481  -3.412   2.048
  383    H    PHE  66           H        PHE  66  -8.442  -3.688  -0.139
  384    HA   PHE  66           HA       PHE  66  -8.157  -3.078  -2.929
  385    HB3  PHE  66           2HB      PHE  66 -10.315  -4.157  -3.596
  386    HD1  PHE  66           2HD      PHE  66  -7.957  -4.444  -4.868
  387    HD2  PHE  66           1HD      PHE  66  -9.597  -7.138  -2.009
  388    HE1  PHE  66           2HE      PHE  66  -6.596  -6.265  -5.807
  389    HE2  PHE  66           1HE      PHE  66  -8.237  -8.963  -2.943
  390    HZ   PHE  66           HZ       PHE  66  -6.734  -8.528  -4.846
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -37.402  19.346 -12.186
    2    HA2  GLY   1           1HA      GLY   1 -39.075  21.327 -11.250
    3    HA3  GLY   1           2HA      GLY   1 -37.986  22.136 -12.367
    4    H    SER   2           H        SER   2 -39.464  18.904 -12.483
    5    HA   SER   2           HA       SER   2 -41.008  19.727 -14.831
    6    HB3  SER   2           2HB      SER   2 -38.767  17.796 -14.791
    7    HG   SER   2           HG       SER   2 -40.406  17.033 -16.743
    8    H    SER   3           H        SER   3 -40.240  16.865 -12.842
    9    HA   SER   3           HA       SER   3 -41.576  15.397 -11.724
   10    HB3  SER   3           2HB      SER   3 -43.135  17.845 -11.795
   11    HG   SER   3           HG       SER   3 -45.147  16.963 -11.574
   12    H    GLY   4           H        GLY   4 -42.832  13.608 -12.219
   13    HA2  GLY   4           1HA      GLY   4 -44.515  12.507 -13.551
   14    HA3  GLY   4           2HA      GLY   4 -44.122  13.601 -14.869
   15    H    SER   5           H        SER   5 -43.752  10.513 -13.737
   16    HA   SER   5           HA       SER   5 -42.509   8.722 -14.385
   17    HB3  SER   5           2HB      SER   5 -41.165   9.349 -16.676
   18    HG   SER   5           HG       SER   5 -43.750   8.471 -16.110
   19    H    SER   6           H        SER   6 -40.257  10.927 -15.916
   20    HA   SER   6           HA       SER   6 -38.034   9.861 -14.539
   21    HB3  SER   6           2HB      SER   6 -37.674  12.549 -15.678
   22    HG   SER   6           HG       SER   6 -35.895  11.618 -16.406
   23    H    GLY   7           H        GLY   7 -39.472  13.126 -14.356
   24    HA2  GLY   7           1HA      GLY   7 -39.384  14.716 -12.699
   25    HA3  GLY   7           2HA      GLY   7 -39.586  13.351 -11.610
   26    H    PHE   8           H        PHE   8 -38.256  15.219 -10.459
   27    HA   PHE   8           HA       PHE   8 -35.417  15.087 -11.018
   28    HB3  PHE   8           2HB      PHE   8 -35.842  16.376  -8.546
   29    HD1  PHE   8           2HD      PHE   8 -36.234  17.261 -12.155
   30    HD2  PHE   8           1HD      PHE   8 -34.147  17.907  -8.502
   31    HE1  PHE   8           2HE      PHE   8 -34.784  18.902 -13.277
   32    HE2  PHE   8           1HE      PHE   8 -32.696  19.551  -9.618
   33    HZ   PHE   8           HZ       PHE   8 -33.013  20.050 -12.008
   34    H    VAL   9           H        VAL   9 -33.944  13.880  -9.978
   35    HA   VAL   9           HA       VAL   9 -34.824  12.363  -7.609
   36    HB   VAL   9           HB       VAL   9 -34.742  10.841  -9.494
   37   HG11  VAL   9          1HG1      VAL   9 -33.366  11.477 -11.155
   38   HG12  VAL   9          2HG1      VAL   9 -32.238  12.271 -10.054
   39   HG13  VAL   9          3HG1      VAL   9 -32.166  10.524 -10.283
   40   HG21  VAL   9          3HG2      VAL   9 -33.817  10.246  -7.160
   41   HG22  VAL   9          1HG2      VAL   9 -33.479   9.155  -8.504
   42   HG23  VAL   9          2HG2      VAL   9 -32.238  10.277  -7.946
   43    H    LYS  10           H        LYS  10 -33.216  11.860  -6.067
   44    HA   LYS  10           HA       LYS  10 -30.846  13.600  -6.223
   45    HB3  LYS  10           2HB      LYS  10 -31.246  12.752  -3.556
   46    HG3  LYS  10           2HG      LYS  10 -31.554  15.338  -5.011
   47    HD3  LYS  10           2HD      LYS  10 -31.772  15.405  -2.071
   48    HE3  LYS  10           2HE      LYS  10 -33.410  16.865  -4.121
   49    HZ1  LYS  10           3HZ      LYS  10 -34.167  17.825  -2.287
   50    HZ2  LYS  10           1HZ      LYS  10 -32.633  18.496  -2.050
   51    HZ3  LYS  10           2HZ      LYS  10 -33.039  17.032  -1.309
   52    H    THR  11           H        THR  11 -28.841  12.811  -5.522
   53    HA   THR  11           HA       THR  11 -28.657   9.872  -5.480
   54    HB   THR  11           HB       THR  11 -26.194  11.422  -5.985
   55    HG1  THR  11           1HG      THR  11 -26.903  11.655  -8.250
   56   HG21  THR  11          3HG2      THR  11 -26.358   9.617  -7.957
   57   HG22  THR  11          1HG2      THR  11 -27.452   8.865  -6.798
   58   HG23  THR  11          2HG2      THR  11 -25.785   9.212  -6.339
   59    H    VAL  12           H        VAL  12 -26.313   9.314  -4.467
   60    HA   VAL  12           HA       VAL  12 -26.169  10.693  -1.866
   61    HB   VAL  12           HB       VAL  12 -27.201   8.638  -1.347
   62   HG11  VAL  12          1HG1      VAL  12 -25.989   6.462  -2.104
   63   HG12  VAL  12          2HG1      VAL  12 -27.060   7.302  -3.226
   64   HG13  VAL  12          3HG1      VAL  12 -25.312   7.495  -3.362
   65   HG21  VAL  12          3HG2      VAL  12 -24.515   7.611  -0.799
   66   HG22  VAL  12          1HG2      VAL  12 -24.760   9.290  -0.320
   67   HG23  VAL  12          2HG2      VAL  12 -25.819   8.029   0.312
   68    H    GLU  13           H        GLU  13 -24.251  11.593  -1.550
   69    HA   GLU  13           HA       GLU  13 -21.903  10.404  -2.874
   70    HB3  GLU  13           2HB      GLU  13 -20.994  12.839  -2.369
   71    HG3  GLU  13           2HG      GLU  13 -22.268  13.605  -4.544
   72    H    ASP  14           H        ASP  14 -20.090   9.974  -1.701
   73    HA   ASP  14           HA       ASP  14 -19.844  10.881   1.038
   74    HB3  ASP  14           2HB      ASP  14 -20.018   8.843   2.126
   75    H    LYS  15           H        LYS  15 -17.909   9.019   1.853
   76    HA   LYS  15           HA       LYS  15 -15.867   8.650  -0.079
   77    HB3  LYS  15           2HB      LYS  15 -15.354  10.904  -0.111
   78    HG3  LYS  15           2HG      LYS  15 -16.995  11.451   1.767
   79    HD3  LYS  15           2HD      LYS  15 -14.446  11.150   3.356
   80    HE3  LYS  15           2HE      LYS  15 -17.113  12.357   4.078
   81    HZ1  LYS  15           3HZ      LYS  15 -14.872  12.151   5.966
   82    HZ2  LYS  15           1HZ      LYS  15 -15.911  10.829   5.781
   83    HZ3  LYS  15           2HZ      LYS  15 -16.526  12.324   6.277
   84    H    TYR  16           H        TYR  16 -13.636   8.405   1.233
   85    HA   TYR  16           HA       TYR  16 -14.283   6.809   3.624
   86    HB3  TYR  16           2HB      TYR  16 -12.452   5.317   3.042
   87    HD1  TYR  16           2HD      TYR  16 -14.389   3.851   2.969
   88    HD2  TYR  16           1HD      TYR  16 -13.374   6.291  -0.365
   89    HE1  TYR  16           2HE      TYR  16 -15.900   2.529   1.549
   90    HE2  TYR  16           1HE      TYR  16 -14.884   4.977  -1.794
   91    HH   TYR  16           HH       TYR  16 -17.031   2.562  -0.467
   92    H    LYS  17           H        LYS  17 -12.300   6.473   5.051
   93    HA   LYS  17           HA       LYS  17 -10.405   8.671   5.038
   94    HB3  LYS  17           2HB      LYS  17 -12.599   8.379   7.049
   95    HG3  LYS  17           2HG      LYS  17 -10.875  10.196   8.194
   96    HD3  LYS  17           2HD      LYS  17 -10.474   8.044   9.746
   97    HE3  LYS  17           2HE      LYS  17 -12.586  10.039   9.469
   98    HZ1  LYS  17           3HZ      LYS  17 -13.276   7.946  11.378
   99    HZ2  LYS  17           1HZ      LYS  17 -13.669   7.659   9.758
  100    HZ3  LYS  17           2HZ      LYS  17 -14.277   9.025  10.546
  101    H    CYS  18           H        CYS  18  -8.510   8.194   6.075
  102    HA   CYS  18           HA       CYS  18  -7.895   5.486   6.542
  103    HB3  CYS  18           2HB      CYS  18  -6.415   8.025   7.243
  104    H    GLU  19           H        GLU  19  -7.707   4.285   8.376
  105    HA   GLU  19           HA       GLU  19  -9.101   5.269  10.714
  106    HB3  GLU  19           2HB      GLU  19  -8.268   2.799  11.438
  107    HG3  GLU  19           2HG      GLU  19 -10.363   1.947  10.857
  108    H    LYS  20           H        LYS  20  -6.422   6.328   9.954
  109    HA   LYS  20           HA       LYS  20  -5.104   5.840  12.536
  110    HB3  LYS  20           2HB      LYS  20  -3.189   6.520  10.484
  111    HG3  LYS  20           2HG      LYS  20  -3.542   4.261  12.415
  112    HD3  LYS  20           2HD      LYS  20  -1.248   4.536  10.479
  113    HE3  LYS  20           2HE      LYS  20  -0.291   2.772  11.518
  114    HZ1  LYS  20           3HZ      LYS  20  -2.135   3.424  13.744
  115    HZ2  LYS  20           1HZ      LYS  20  -0.831   4.411  13.310
  116    HZ3  LYS  20           2HZ      LYS  20  -0.554   2.833  13.849
  117    H    CYS  21           H        CYS  21  -4.745   7.948   9.677
  118    HA   CYS  21           HA       CYS  21  -4.376  10.226  11.484
  119    HB3  CYS  21           2HB      CYS  21  -2.602  10.063   9.908
  120    H    HIS  22           H        HIS  22  -6.873   8.754  10.066
  121    HA   HIS  22           HA       HIS  22  -8.988   9.353   9.477
  122    HB3  HIS  22           2HB      HIS  22  -9.867  10.766  10.977
  123    HD2  HIS  22           2HD      HIS  22  -7.689   9.085  12.526
  124    HE1  HIS  22           1HE      HIS  22  -6.377  12.752  14.206
  125    HE2  HIS  22           2HE      HIS  22  -6.269  10.240  14.352
  126    H    LEU  23           H        LEU  23  -6.717   9.893   7.664
  127    HA   LEU  23           HA       LEU  23  -7.238  12.323   6.267
  128    HB3  LEU  23           2HB      LEU  23  -5.990  10.682   4.454
  129    HG   LEU  23           HG       LEU  23  -4.830  12.478   6.552
  130   HD11  LEU  23          1HD1      LEU  23  -3.459  10.292   5.385
  131   HD12  LEU  23          2HD1      LEU  23  -2.812  11.579   6.399
  132   HD13  LEU  23          3HD1      LEU  23  -2.846  11.772   4.647
  133   HD21  LEU  23          3HD2      LEU  23  -4.595  12.633   3.563
  134   HD22  LEU  23          1HD2      LEU  23  -4.386  13.915   4.756
  135   HD23  LEU  23          2HD2      LEU  23  -5.995  13.272   4.425
  136    H    VAL  24           H        VAL  24  -8.936  12.735   5.033
  137    HA   VAL  24           HA       VAL  24 -10.777  10.725   4.217
  138    HB   VAL  24           HB       VAL  24 -10.538  13.657   3.587
  139   HG11  VAL  24          1HG1      VAL  24 -12.299  11.602   2.343
  140   HG12  VAL  24          2HG1      VAL  24 -12.956  13.210   2.658
  141   HG13  VAL  24          3HG1      VAL  24 -11.538  13.021   1.624
  142   HG21  VAL  24          3HG2      VAL  24 -11.488  12.393   5.788
  143   HG22  VAL  24          1HG2      VAL  24 -12.033  13.978   5.239
  144   HG23  VAL  24          2HG2      VAL  24 -12.957  12.535   4.824
  145    H    LEU  25           H        LEU  25 -10.459   9.348   2.605
  146    HA   LEU  25           HA       LEU  25  -9.086  10.313   0.184
  147    HB3  LEU  25           2HB      LEU  25  -7.575   8.713   0.407
  148    HG   LEU  25           HG       LEU  25  -9.050   8.108   2.912
  149   HD11  LEU  25          1HD1      LEU  25  -6.782   6.323   2.387
  150   HD12  LEU  25          2HD1      LEU  25  -8.238   5.969   1.459
  151   HD13  LEU  25          3HD1      LEU  25  -8.306   6.014   3.220
  152   HD21  LEU  25          3HD2      LEU  25  -6.762   8.381   3.831
  153   HD22  LEU  25          1HD2      LEU  25  -7.336   9.792   2.944
  154   HD23  LEU  25          2HD2      LEU  25  -6.180   8.690   2.195
  155    H    CYS  26           H        CYS  26  -9.605   8.923  -1.764
  156    HA   CYS  26           HA       CYS  26 -12.499   8.432  -1.796
  157    HB3  CYS  26           2HB      CYS  26 -11.899   8.392  -4.391
  158    H    SER  27           H        SER  27  -9.399   6.940  -2.455
  159    HA   SER  27           HA       SER  27 -10.776   4.358  -2.754
  160    HB3  SER  27           2HB      SER  27  -9.900   5.262  -4.952
  161    HG   SER  27           HG       SER  27  -7.462   4.678  -4.962
  162    HA   PRO  28           HA       PRO  28  -7.695   4.172   0.688
  163    HB3  PRO  28           2HB      PRO  28  -9.353   4.505   2.244
  164    HG3  PRO  28           2HG      PRO  28 -11.572   4.008   1.757
  165    HD3  PRO  28           2HD      PRO  28 -11.033   5.275  -0.093
  166    H    LYS  29           H        LYS  29  -7.616   1.884   2.163
  167    HA   LYS  29           HA       LYS  29  -7.334  -0.258   0.160
  168    HB3  LYS  29           2HB      LYS  29  -5.279  -0.952   1.124
  169    HG3  LYS  29           2HG      LYS  29  -3.809   0.975   1.029
  170    HD3  LYS  29           2HD      LYS  29  -6.056   0.913  -0.971
  171    HE3  LYS  29           2HE      LYS  29  -3.468   2.457  -1.139
  172    HZ1  LYS  29           3HZ      LYS  29  -5.173   1.424  -3.152
  173    HZ2  LYS  29           1HZ      LYS  29  -3.717   2.269  -3.318
  174    HZ3  LYS  29           2HZ      LYS  29  -5.176   3.114  -3.203
  175    H    GLN  30           H        GLN  30  -9.661  -0.265   1.355
  176    HA   GLN  30           HA       GLN  30 -10.226  -1.148   3.807
  177    HB3  GLN  30           2HB      GLN  30 -11.435  -2.913   1.790
  178    HG3  GLN  30           2HG      GLN  30 -12.536  -0.868   3.699
  179   HE21  GLN  30          1HE2      GLN  30 -14.734  -2.853   4.012
  180   HE22  GLN  30          2HE2      GLN  30 -15.803  -2.546   2.691
  181    H    THR  31           H        THR  31  -9.143  -2.485   5.090
  182    HA   THR  31           HA       THR  31  -7.499  -4.598   4.168
  183    HB   THR  31           HB       THR  31  -7.113  -5.145   6.462
  184    HG1  THR  31           1HG      THR  31  -9.029  -3.403   7.486
  185   HG21  THR  31          3HG2      THR  31  -6.280  -3.119   7.271
  186   HG22  THR  31          1HG2      THR  31  -7.609  -2.188   6.584
  187   HG23  THR  31          2HG2      THR  31  -6.364  -2.856   5.530
  188    H    GLU  32           H        GLU  32  -8.016  -6.711   5.882
  189    HA   GLU  32           HA       GLU  32 -10.302  -7.921   4.543
  190    HB3  GLU  32           2HB      GLU  32  -8.821  -9.588   6.441
  191    HG3  GLU  32           2HG      GLU  32  -8.820 -10.024   3.501
  192    H    CYS  33           H        CYS  33 -10.251  -5.989   6.987
  193    HA   CYS  33           HA       CYS  33 -12.020  -7.620   8.691
  194    HB3  CYS  33           2HB      CYS  33  -9.860  -6.776   9.728
  195    H    GLY  34           H        GLY  34 -11.586  -4.618   6.963
  196    HA2  GLY  34           1HA      GLY  34 -13.880  -3.880   6.087
  197    HA3  GLY  34           2HA      GLY  34 -14.277  -3.749   7.793
  198    H    HIS  35           H        HIS  35 -12.103  -2.576   8.884
  199    HA   HIS  35           HA       HIS  35 -12.454   0.110   8.457
  200    HB3  HIS  35           2HB      HIS  35 -10.221   0.416   9.550
  201    HD2  HIS  35           2HD      HIS  35 -12.410   1.145  11.310
  202    HE1  HIS  35           1HE      HIS  35 -12.273  -2.558  13.377
  203    HE2  HIS  35           2HE      HIS  35 -13.225  -0.225  13.347
  204    H    ARG  36           H        ARG  36 -10.439   1.587   7.837
  205    HA   ARG  36           HA       ARG  36  -9.195   0.657   5.364
  206    HB3  ARG  36           2HB      ARG  36  -9.868   2.838   4.257
  207    HG3  ARG  36           2HG      ARG  36 -11.685   0.576   4.791
  208    HD3  ARG  36           2HD      ARG  36 -12.917   2.497   3.010
  209    HE   ARG  36           HE       ARG  36 -14.483   0.988   3.739
  210   HH11  ARG  36          1HH1      ARG  36 -12.852   2.377   6.484
  211   HH12  ARG  36          2HH1      ARG  36 -13.930   1.674   7.644
  212   HH21  ARG  36          1HH2      ARG  36 -15.909   0.058   5.256
  213   HH22  ARG  36          2HH2      ARG  36 -15.667   0.355   6.945
  214    H    PHE  37           H        PHE  37  -7.474   2.085   4.614
  215    HA   PHE  37           HA       PHE  37  -6.507   4.047   6.540
  216    HB3  PHE  37           2HB      PHE  37  -4.185   2.940   6.348
  217    HD1  PHE  37           2HD      PHE  37  -6.630   0.374   7.332
  218    HD2  PHE  37           1HD      PHE  37  -4.171   3.596   8.630
  219    HE1  PHE  37           2HE      PHE  37  -7.034  -0.266   9.673
  220    HE2  PHE  37           1HE      PHE  37  -4.570   2.961  10.974
  221    HZ   PHE  37           HZ       PHE  37  -6.004   1.029  11.497
  222    H    CYS  38           H        CYS  38  -4.389   5.049   5.671
  223    HA   CYS  38           HA       CYS  38  -4.850   5.666   2.849
  224    HB3  CYS  38           2HB      CYS  38  -4.745   7.514   4.530
  225    H    GLU  39           H        GLU  39  -2.853   6.128   1.527
  226    HA   GLU  39           HA       GLU  39  -1.379   3.890   1.052
  227    HB3  GLU  39           2HB      GLU  39   0.403   5.606   0.164
  228    HG3  GLU  39           2HG      GLU  39  -2.288   5.963  -1.070
  229    H    SER  40           H        SER  40  -0.056   6.727   2.767
  230    HA   SER  40           HA       SER  40   2.327   5.655   3.598
  231    HB3  SER  40           2HB      SER  40   0.507   7.719   4.793
  232    HG   SER  40           HG       SER  40   3.046   7.211   5.894
  233    H    CYS  41           H        CYS  41  -0.106   6.147   6.102
  234    HA   CYS  41           HA       CYS  41   0.687   4.430   7.977
  235    HB3  CYS  41           2HB      CYS  41  -1.699   4.052   8.592
  236    H    MET  42           H        MET  42  -1.262   3.447   5.171
  237    HA   MET  42           HA       MET  42  -1.568   0.762   5.752
  238    HB3  MET  42           2HB      MET  42  -1.233   2.154   3.096
  239    HG3  MET  42           2HG      MET  42  -0.865  -0.482   3.271
  240    HE1  MET  42           3HE      MET  42  -3.484   0.399   5.290
  241    HE2  MET  42           1HE      MET  42  -4.254  -1.184   5.416
  242    HE3  MET  42           2HE      MET  42  -2.502  -1.042   5.562
  243    H    ALA  43           H        ALA  43   0.972   2.169   3.674
  244    HA   ALA  43           HA       ALA  43   2.469  -0.181   3.394
  245    HB1  ALA  43           3HB      ALA  43   2.875   2.675   2.859
  246    HB2  ALA  43           1HB      ALA  43   4.355   1.759   3.145
  247    HB3  ALA  43           2HB      ALA  43   3.246   1.267   1.864
  248    H    ALA  44           H        ALA  44   2.157   1.968   6.047
  249    HA   ALA  44           HA       ALA  44   4.677   1.368   7.282
  250    HB1  ALA  44           3HB      ALA  44   4.113   2.908   8.840
  251    HB2  ALA  44           1HB      ALA  44   2.944   3.382   7.608
  252    HB3  ALA  44           2HB      ALA  44   2.444   2.349   8.949
  253    H    LEU  45           H        LEU  45   1.304   0.412   7.910
  254    HA   LEU  45           HA       LEU  45   1.841  -1.318  10.049
  255    HB3  LEU  45           2HB      LEU  45  -0.357  -2.303   9.560
  256    HG   LEU  45           HG       LEU  45  -0.394   0.700   9.262
  257   HD11  LEU  45          1HD1      LEU  45  -2.679   0.678   9.693
  258   HD12  LEU  45          2HD1      LEU  45  -2.657  -0.994  10.254
  259   HD13  LEU  45          3HD1      LEU  45  -2.467  -0.638   8.537
  260   HD21  LEU  45          3HD2      LEU  45   0.270  -0.993  11.443
  261   HD22  LEU  45          1HD2      LEU  45  -1.282  -0.230  11.790
  262   HD23  LEU  45          2HD2      LEU  45   0.125   0.766  11.416
  263    H    LEU  46           H        LEU  46   1.612  -1.936   6.565
  264    HA   LEU  46           HA       LEU  46   1.834  -4.698   6.575
  265    HB3  LEU  46           2HB      LEU  46   2.779  -4.469   4.312
  266    HG   LEU  46           HG       LEU  46   0.517  -2.540   4.823
  267   HD11  LEU  46          1HD1      LEU  46   0.177  -2.331   2.555
  268   HD12  LEU  46          2HD1      LEU  46   1.102  -3.782   2.172
  269   HD13  LEU  46          3HD1      LEU  46   1.937  -2.307   2.655
  270   HD21  LEU  46          3HD2      LEU  46  -0.739  -4.354   5.040
  271   HD22  LEU  46          1HD2      LEU  46   0.685  -5.378   4.848
  272   HD23  LEU  46          2HD2      LEU  46  -0.246  -4.889   3.432
  273    H    SER  47           H        SER  47   4.264  -2.264   7.120
  274    HA   SER  47           HA       SER  47   6.422  -4.222   6.995
  275    HB3  SER  47           2HB      SER  47   7.011  -1.477   7.925
  276    HG   SER  47           HG       SER  47   8.705  -2.790   7.347
  277    H    SER  48           H        SER  48   4.387  -4.481   9.036
  278    HA   SER  48           HA       SER  48   5.956  -3.916  11.464
  279    HB3  SER  48           2HB      SER  48   3.002  -4.553  11.309
  280    HG   SER  48           HG       SER  48   2.992  -3.898  13.411
  281    H    SER  49           H        SER  49   6.365  -6.166   9.640
  282    HA   SER  49           HA       SER  49   6.452  -8.465   9.598
  283    HB3  SER  49           2HB      SER  49   7.026  -8.272  12.541
  284    HG   SER  49           HG       SER  49   8.635  -9.762  11.944
  285    H    SER  50           H        SER  50   3.805  -7.311  10.314
  286    HA   SER  50           HA       SER  50   2.249  -9.493  10.578
  287    HB3  SER  50           2HB      SER  50   3.002 -10.320  12.594
  288    HG   SER  50           HG       SER  50   4.335  -9.130  13.675
  289    HA   PRO  51           HA       PRO  51   0.263  -5.255  10.499
  290    HB3  PRO  51           2HB      PRO  51   0.862  -4.865   8.314
  291    HG3  PRO  51           2HG      PRO  51   1.380  -6.621   6.881
  292    HD3  PRO  51           2HD      PRO  51   2.711  -7.172   8.681
  293    H    LYS  52           H        LYS  52  -1.614  -5.239  11.547
  294    HA   LYS  52           HA       LYS  52  -3.614  -7.303  10.895
  295    HB3  LYS  52           2HB      LYS  52  -4.309  -7.355  13.126
  296    HG3  LYS  52           2HG      LYS  52  -1.349  -7.020  12.979
  297    HD3  LYS  52           2HD      LYS  52  -2.729  -7.795  15.529
  298    HE3  LYS  52           2HE      LYS  52  -0.059  -6.506  15.353
  299    HZ1  LYS  52           3HZ      LYS  52  -1.518  -8.225  17.155
  300    HZ2  LYS  52           1HZ      LYS  52  -0.298  -7.099  17.481
  301    HZ3  LYS  52           2HZ      LYS  52   0.106  -8.655  16.956
  302    H    CYS  53           H        CYS  53  -3.688  -4.146  12.545
  303    HA   CYS  53           HA       CYS  53  -4.849  -2.517  10.761
  304    HB3  CYS  53           2HB      CYS  53  -6.851  -4.517  11.738
  305    H    THR  54           H        THR  54  -4.036  -0.932  12.046
  306    HA   THR  54           HA       THR  54  -3.923  -0.530  14.668
  307    HB   THR  54           HB       THR  54  -4.048   1.225  12.425
  308    HG1  THR  54           1HG      THR  54  -2.408   0.875  14.182
  309   HG21  THR  54          3HG2      THR  54  -6.208   1.981  13.244
  310   HG22  THR  54          1HG2      THR  54  -4.992   3.229  13.513
  311   HG23  THR  54          2HG2      THR  54  -5.537   2.223  14.856
  312    H    ALA  55           H        ALA  55  -6.883  -0.069  12.774
  313    HA   ALA  55           HA       ALA  55  -8.565   0.956  14.699
  314    HB1  ALA  55           3HB      ALA  55 -10.087   0.721  13.097
  315    HB2  ALA  55           1HB      ALA  55  -8.851  -0.085  12.131
  316    HB3  ALA  55           2HB      ALA  55  -9.946  -1.036  13.136
  317    H    CYS  56           H        CYS  56  -8.884  -2.456  13.785
  318    HA   CYS  56           HA       CYS  56  -9.288  -3.088  16.633
  319    HB3  CYS  56           2HB      CYS  56 -11.295  -3.448  15.295
  320    H    GLN  57           H        GLN  57  -7.571  -3.911  13.722
  321    HA   GLN  57           HA       GLN  57  -5.557  -5.015  13.531
  322    HB3  GLN  57           2HB      GLN  57  -4.397  -5.828  15.377
  323    HG3  GLN  57           2HG      GLN  57  -5.883  -4.319  17.300
  324   HE21  GLN  57          1HE2      GLN  57  -3.660  -3.104  14.858
  325   HE22  GLN  57          2HE2      GLN  57  -2.297  -2.954  15.909
  326    H    GLU  58           H        GLU  58  -6.248  -6.389  11.962
  327    HA   GLU  58           HA       GLU  58  -7.098  -9.052  12.861
  328    HB3  GLU  58           2HB      GLU  58  -8.338  -8.656  10.378
  329    HG3  GLU  58           2HG      GLU  58 -10.455  -8.516  11.815
  330    H    SER  59           H        SER  59  -6.292  -7.304   9.854
  331    HA   SER  59           HA       SER  59  -3.864  -8.551   9.355
  332    HB3  SER  59           2HB      SER  59  -5.286  -9.925   7.336
  333    HG   SER  59           HG       SER  59  -4.318 -11.210   9.636
  334    H    ILE  60           H        ILE  60  -2.883  -7.357   7.859
  335    HA   ILE  60           HA       ILE  60  -4.539  -6.019   5.822
  336    HB   ILE  60           HB       ILE  60  -2.061  -4.662   6.722
  337   HG13  ILE  60          2HG1      ILE  60  -3.242  -5.403   8.823
  338   HG21  ILE  60          1HG2      ILE  60  -2.947  -2.990   5.558
  339   HG22  ILE  60          2HG2      ILE  60  -4.247  -4.083   5.084
  340   HG23  ILE  60          3HG2      ILE  60  -4.435  -3.052   6.502
  341   HD11  ILE  60          3HD1      ILE  60  -2.020  -3.063   8.402
  342   HD12  ILE  60          1HD1      ILE  60  -3.632  -2.485   8.823
  343   HD13  ILE  60          2HD1      ILE  60  -2.746  -3.518   9.944
  344    H    VAL  61           H        VAL  61  -4.054  -7.231   4.067
  345    HA   VAL  61           HA       VAL  61  -1.204  -7.448   3.341
  346    HB   VAL  61           HB       VAL  61  -3.437  -9.414   2.847
  347   HG11  VAL  61          1HG1      VAL  61  -1.728 -10.726   1.582
  348   HG12  VAL  61          2HG1      VAL  61  -2.250  -9.245   0.777
  349   HG13  VAL  61          3HG1      VAL  61  -0.693  -9.297   1.605
  350   HG21  VAL  61          3HG2      VAL  61  -2.608 -10.224   4.766
  351   HG22  VAL  61          1HG2      VAL  61  -1.256 -10.780   3.779
  352   HG23  VAL  61          2HG2      VAL  61  -1.141  -9.252   4.652
  353    H    LYS  62           H        LYS  62  -0.662  -6.366   1.574
  354    HA   LYS  62           HA       LYS  62  -2.224  -4.732   0.078
  355    HB3  LYS  62           2HB      LYS  62   0.098  -4.555  -0.240
  356    HG3  LYS  62           2HG      LYS  62   0.339  -7.241  -1.525
  357    HD3  LYS  62           2HD      LYS  62   2.137  -5.119  -0.485
  358    HE3  LYS  62           2HE      LYS  62   2.648  -8.064  -0.261
  359    HZ1  LYS  62           3HZ      LYS  62   5.039  -7.373   0.035
  360    HZ2  LYS  62           1HZ      LYS  62   4.638  -5.924  -0.740
  361    HZ3  LYS  62           2HZ      LYS  62   4.468  -7.396  -1.557
  362    H    ASP  63           H        ASP  63  -1.459  -8.110  -0.732
  363    HA   ASP  63           HA       ASP  63  -2.877  -8.293  -3.113
  364    HB3  ASP  63           2HB      ASP  63  -3.135 -10.779  -2.382
  365    H    LYS  64           H        LYS  64  -3.995  -8.750   0.213
  366    HA   LYS  64           HA       LYS  64  -6.707  -9.285  -0.675
  367    HB3  LYS  64           2HB      LYS  64  -7.219  -9.663   1.645
  368    HG3  LYS  64           2HG      LYS  64  -4.606 -10.818   1.983
  369    HD3  LYS  64           2HD      LYS  64  -6.878 -12.454   1.052
  370    HE3  LYS  64           2HE      LYS  64  -5.431 -12.593   3.676
  371    HZ1  LYS  64           3HZ      LYS  64  -5.772 -15.001   3.255
  372    HZ2  LYS  64           1HZ      LYS  64  -6.698 -14.600   1.897
  373    HZ3  LYS  64           2HZ      LYS  64  -7.211 -14.131   3.439
  374    H    VAL  65           H        VAL  65  -4.958  -6.574  -0.501
  375    HA   VAL  65           HA       VAL  65  -7.081  -4.907   0.650
  376    HB   VAL  65           HB       VAL  65  -4.189  -4.651   0.444
  377   HG11  VAL  65          1HG1      VAL  65  -5.874  -2.268  -0.317
  378   HG12  VAL  65          2HG1      VAL  65  -4.152  -2.224   0.068
  379   HG13  VAL  65          3HG1      VAL  65  -4.717  -3.103  -1.353
  380   HG21  VAL  65          3HG2      VAL  65  -4.446  -3.875   2.529
  381   HG22  VAL  65          1HG2      VAL  65  -5.672  -2.707   2.038
  382   HG23  VAL  65          2HG2      VAL  65  -6.128  -4.379   2.364
  383    H    PHE  66           H        PHE  66  -8.366  -3.678  -0.577
  384    HA   PHE  66           HA       PHE  66  -8.515  -3.999  -3.352
  385    HB3  PHE  66           2HB      PHE  66  -9.982  -1.858  -3.163
  386    HD1  PHE  66           2HD      PHE  66 -11.050  -3.752  -4.431
  387    HD2  PHE  66           1HD      PHE  66 -10.970  -3.577  -0.178
  388    HE1  PHE  66           2HE      PHE  66 -12.892  -5.381  -4.333
  389    HE2  PHE  66           1HE      PHE  66 -12.811  -5.207  -0.074
  390    HZ   PHE  66           HZ       PHE  66 -13.775  -6.110  -2.152
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1 -56.144   8.109   0.752
    2    HA2  GLY   1           1HA      GLY   1 -55.475   6.928  -1.726
    3    HA3  GLY   1           2HA      GLY   1 -55.637   8.664  -1.938
    4    H    SER   2           H        SER   2 -53.343   6.562  -1.815
    5    HA   SER   2           HA       SER   2 -51.676   7.244   0.342
    6    HB3  SER   2           2HB      SER   2 -49.845   6.293  -1.045
    7    HG   SER   2           HG       SER   2 -52.296   4.862  -1.089
    8    H    SER   3           H        SER   3 -49.726   8.515   0.334
    9    HA   SER   3           HA       SER   3 -50.084  11.004  -1.146
   10    HB3  SER   3           2HB      SER   3 -48.178  11.758   0.415
   11    HG   SER   3           HG       SER   3 -50.055  12.491   1.120
   12    H    GLY   4           H        GLY   4 -48.936  11.477  -2.897
   13    HA2  GLY   4           1HA      GLY   4 -46.879   9.701  -3.827
   14    HA3  GLY   4           2HA      GLY   4 -47.441  11.160  -4.630
   15    H    SER   5           H        SER   5 -44.779   9.802  -3.429
   16    HA   SER   5           HA       SER   5 -43.484  12.379  -3.047
   17    HB3  SER   5           2HB      SER   5 -42.997  10.224  -0.999
   18    HG   SER   5           HG       SER   5 -42.634  12.496   0.073
   19    H    SER   6           H        SER   6 -42.848  11.447  -5.219
   20    HA   SER   6           HA       SER   6 -41.000   9.248  -5.231
   21    HB3  SER   6           2HB      SER   6 -41.385   9.271  -7.441
   22    HG   SER   6           HG       SER   6 -43.423  10.113  -6.779
   23    H    GLY   7           H        GLY   7 -38.827   9.286  -5.118
   24    HA2  GLY   7           1HA      GLY   7 -37.570  11.824  -4.436
   25    HA3  GLY   7           2HA      GLY   7 -36.855  10.228  -4.266
   26    H    PHE   8           H        PHE   8 -36.310  12.981  -5.737
   27    HA   PHE   8           HA       PHE   8 -35.996  12.284  -8.469
   28    HB3  PHE   8           2HB      PHE   8 -35.117  14.399  -8.757
   29    HD1  PHE   8           2HD      PHE   8 -37.816  13.494  -7.528
   30    HD2  PHE   8           1HD      PHE   8 -35.019  16.544  -6.532
   31    HE1  PHE   8           2HE      PHE   8 -39.627  14.819  -6.517
   32    HE2  PHE   8           1HE      PHE   8 -36.824  17.873  -5.519
   33    HZ   PHE   8           HZ       PHE   8 -39.132  17.012  -5.511
   34    H    VAL   9           H        VAL   9 -34.085  11.840  -9.632
   35    HA   VAL   9           HA       VAL   9 -32.325  10.016  -8.355
   36    HB   VAL   9           HB       VAL   9 -33.046  10.369 -10.923
   37   HG11  VAL   9          1HG1      VAL   9 -31.689  12.445 -11.082
   38   HG12  VAL   9          2HG1      VAL   9 -30.243  11.474 -10.797
   39   HG13  VAL   9          3HG1      VAL   9 -31.219  11.203 -12.242
   40   HG21  VAL   9          3HG2      VAL   9 -30.377   9.169 -10.231
   41   HG22  VAL   9          1HG2      VAL   9 -31.904   8.424  -9.757
   42   HG23  VAL   9          2HG2      VAL   9 -31.524   8.650 -11.465
   43    H    LYS  10           H        LYS  10 -30.422  10.328  -7.390
   44    HA   LYS  10           HA       LYS  10 -28.639  12.446  -8.065
   45    HB3  LYS  10           2HB      LYS  10 -29.057  12.948  -5.302
   46    HG3  LYS  10           2HG      LYS  10 -29.641  14.592  -7.752
   47    HD3  LYS  10           2HD      LYS  10 -29.174  16.153  -5.408
   48    HE3  LYS  10           2HE      LYS  10 -31.554  15.817  -7.229
   49    HZ1  LYS  10           3HZ      LYS  10 -32.485  17.700  -6.310
   50    HZ2  LYS  10           1HZ      LYS  10 -31.049  18.196  -5.566
   51    HZ3  LYS  10           2HZ      LYS  10 -31.921  16.890  -4.937
   52    H    THR  11           H        THR  11 -26.595  12.015  -7.378
   53    HA   THR  11           HA       THR  11 -26.005   9.431  -6.411
   54    HB   THR  11           HB       THR  11 -24.548  11.470  -7.607
   55    HG1  THR  11           1HG      THR  11 -23.097   9.368  -6.515
   56   HG21  THR  11          3HG2      THR  11 -22.741  12.041  -6.214
   57   HG22  THR  11          1HG2      THR  11 -23.178  10.831  -5.007
   58   HG23  THR  11          2HG2      THR  11 -24.170  12.276  -5.208
   59    H    VAL  12           H        VAL  12 -24.385   9.193  -4.504
   60    HA   VAL  12           HA       VAL  12 -25.539  10.596  -2.181
   61    HB   VAL  12           HB       VAL  12 -26.123   8.365  -1.866
   62   HG11  VAL  12          1HG1      VAL  12 -23.416   7.678  -2.984
   63   HG12  VAL  12          2HG1      VAL  12 -24.453   6.495  -2.183
   64   HG13  VAL  12          3HG1      VAL  12 -25.002   7.298  -3.655
   65   HG21  VAL  12          3HG2      VAL  12 -25.159   7.889   0.134
   66   HG22  VAL  12          1HG2      VAL  12 -23.520   8.085  -0.486
   67   HG23  VAL  12          2HG2      VAL  12 -24.487   9.505  -0.089
   68    H    GLU  13           H        GLU  13 -23.941  12.285  -2.513
   69    HA   GLU  13           HA       GLU  13 -21.250  12.146  -2.673
   70    HB3  GLU  13           2HB      GLU  13 -22.376  14.273  -2.537
   71    HG3  GLU  13           2HG      GLU  13 -22.636  14.368   0.369
   72    H    ASP  14           H        ASP  14 -19.820  10.913  -1.666
   73    HA   ASP  14           HA       ASP  14 -19.726  10.858   1.227
   74    HB3  ASP  14           2HB      ASP  14 -19.478   8.133   0.206
   75    H    LYS  15           H        LYS  15 -17.873   8.961   1.686
   76    HA   LYS  15           HA       LYS  15 -15.766   8.697  -0.117
   77    HB3  LYS  15           2HB      LYS  15 -15.285  10.971  -0.161
   78    HG3  LYS  15           2HG      LYS  15 -16.801  11.812   1.498
   79    HD3  LYS  15           2HD      LYS  15 -14.894  10.624   3.514
   80    HE3  LYS  15           2HE      LYS  15 -16.439  12.946   3.734
   81    HZ1  LYS  15           3HZ      LYS  15 -18.339  11.308   3.998
   82    HZ2  LYS  15           1HZ      LYS  15 -18.147  12.457   5.225
   83    HZ3  LYS  15           2HZ      LYS  15 -17.626  10.867   5.468
   84    H    TYR  16           H        TYR  16 -13.590   8.344   1.165
   85    HA   TYR  16           HA       TYR  16 -14.283   6.833   3.597
   86    HB3  TYR  16           2HB      TYR  16 -12.496   5.292   3.059
   87    HD1  TYR  16           1HD      TYR  16 -13.357   6.381  -0.349
   88    HD2  TYR  16           2HD      TYR  16 -14.364   3.793   2.874
   89    HE1  TYR  16           1HE      TYR  16 -14.845   5.113  -1.841
   90    HE2  TYR  16           2HE      TYR  16 -15.854   2.516   1.391
   91    HH   TYR  16           HH       TYR  16 -16.446   3.538  -1.940
   92    H    LYS  17           H        LYS  17 -12.301   6.474   5.037
   93    HA   LYS  17           HA       LYS  17 -10.397   8.667   5.031
   94    HB3  LYS  17           2HB      LYS  17 -12.596   8.372   7.037
   95    HG3  LYS  17           2HG      LYS  17 -10.872  10.185   8.189
   96    HD3  LYS  17           2HD      LYS  17 -10.476   8.027   9.737
   97    HE3  LYS  17           2HE      LYS  17 -12.524  10.065   9.488
   98    HZ1  LYS  17           3HZ      LYS  17 -14.226   8.572   9.624
   99    HZ2  LYS  17           1HZ      LYS  17 -13.881   8.748  11.272
  100    HZ3  LYS  17           2HZ      LYS  17 -13.307   7.400  10.427
  101    H    CYS  18           H        CYS  18  -8.506   8.184   6.070
  102    HA   CYS  18           HA       CYS  18  -7.897   5.473   6.532
  103    HB3  CYS  18           2HB      CYS  18  -6.414   8.010   7.227
  104    H    GLU  19           H        GLU  19  -7.709   4.270   8.366
  105    HA   GLU  19           HA       GLU  19  -9.105   5.253  10.704
  106    HB3  GLU  19           2HB      GLU  19  -8.280   2.783  11.427
  107    HG3  GLU  19           2HG      GLU  19 -10.373   1.935  10.840
  108    H    LYS  20           H        LYS  20  -6.434   6.324   9.957
  109    HA   LYS  20           HA       LYS  20  -5.115   5.824  12.536
  110    HB3  LYS  20           2HB      LYS  20  -3.191   6.507  10.499
  111    HG3  LYS  20           2HG      LYS  20  -3.569   4.229  12.402
  112    HD3  LYS  20           2HD      LYS  20  -1.268   4.510  10.474
  113    HE3  LYS  20           2HE      LYS  20  -0.351   2.671  11.455
  114    HZ1  LYS  20           3HZ      LYS  20  -0.427   4.204  13.252
  115    HZ2  LYS  20           1HZ      LYS  20  -0.785   2.676  13.886
  116    HZ3  LYS  20           2HZ      LYS  20  -2.025   3.797  13.629
  117    H    CYS  21           H        CYS  21  -4.756   7.938   9.680
  118    HA   CYS  21           HA       CYS  21  -4.384  10.212  11.492
  119    HB3  CYS  21           2HB      CYS  21  -2.612  10.052   9.914
  120    H    HIS  22           H        HIS  22  -6.878   8.743  10.052
  121    HA   HIS  22           HA       HIS  22  -8.995   9.345   9.475
  122    HB3  HIS  22           2HB      HIS  22  -9.873  10.756  10.976
  123    HD2  HIS  22           2HD      HIS  22  -7.697   9.068  12.522
  124    HE1  HIS  22           1HE      HIS  22  -6.383  12.730  14.212
  125    HE2  HIS  22           2HE      HIS  22  -6.277  10.218  14.352
  126    H    LEU  23           H        LEU  23  -6.710   9.901   7.672
  127    HA   LEU  23           HA       LEU  23  -7.232  12.328   6.277
  128    HB3  LEU  23           2HB      LEU  23  -5.992  10.690   4.457
  129    HG   LEU  23           HG       LEU  23  -4.824  12.472   6.563
  130   HD11  LEU  23          1HD1      LEU  23  -2.843  11.760   4.654
  131   HD12  LEU  23          2HD1      LEU  23  -3.462  10.283   5.391
  132   HD13  LEU  23          3HD1      LEU  23  -2.809  11.568   6.408
  133   HD21  LEU  23          3HD2      LEU  23  -4.623  13.992   4.890
  134   HD22  LEU  23          1HD2      LEU  23  -5.977  13.072   4.236
  135   HD23  LEU  23          2HD2      LEU  23  -4.341  12.765   3.655
  136    H    VAL  24           H        VAL  24  -8.937  12.748   5.054
  137    HA   VAL  24           HA       VAL  24 -10.789  10.754   4.236
  138    HB   VAL  24           HB       VAL  24 -10.559  13.632   3.347
  139   HG11  VAL  24          1HG1      VAL  24 -13.201  12.876   3.164
  140   HG12  VAL  24          2HG1      VAL  24 -12.075  13.046   1.816
  141   HG13  VAL  24          3HG1      VAL  24 -12.334  11.466   2.556
  142   HG21  VAL  24          3HG2      VAL  24 -10.924  13.699   5.654
  143   HG22  VAL  24          1HG2      VAL  24 -12.542  13.832   4.965
  144   HG23  VAL  24          2HG2      VAL  24 -11.987  12.292   5.621
  145    H    LEU  25           H        LEU  25 -10.466   9.362   2.637
  146    HA   LEU  25           HA       LEU  25  -9.077  10.303   0.216
  147    HB3  LEU  25           2HB      LEU  25  -7.616   8.654   0.409
  148    HG   LEU  25           HG       LEU  25  -9.051   8.133   2.962
  149   HD11  LEU  25          1HD1      LEU  25  -6.799   6.335   2.508
  150   HD12  LEU  25          2HD1      LEU  25  -8.205   5.973   1.509
  151   HD13  LEU  25          3HD1      LEU  25  -8.363   6.031   3.263
  152   HD21  LEU  25          3HD2      LEU  25  -6.731   8.409   3.823
  153   HD22  LEU  25          1HD2      LEU  25  -7.340   9.811   2.943
  154   HD23  LEU  25          2HD2      LEU  25  -6.200   8.710   2.168
  155    H    CYS  26           H        CYS  26  -9.588   8.808  -1.706
  156    HA   CYS  26           HA       CYS  26 -12.502   8.425  -1.768
  157    HB3  CYS  26           2HB      CYS  26 -11.840   8.334  -4.365
  158    H    SER  27           H        SER  27  -9.429   6.872  -2.463
  159    HA   SER  27           HA       SER  27 -10.854   4.309  -2.691
  160    HB3  SER  27           2HB      SER  27 -10.036   5.164  -4.925
  161    HG   SER  27           HG       SER  27  -7.474   4.360  -4.445
  162    HA   PRO  28           HA       PRO  28  -7.681   4.110   0.665
  163    HB3  PRO  28           2HB      PRO  28  -9.293   4.474   2.261
  164    HG3  PRO  28           2HG      PRO  28 -11.529   3.998   1.837
  165    HD3  PRO  28           2HD      PRO  28 -11.027   5.244  -0.035
  166    H    LYS  29           H        LYS  29  -7.589   1.833   2.155
  167    HA   LYS  29           HA       LYS  29  -7.368  -0.322   0.158
  168    HB3  LYS  29           2HB      LYS  29  -5.314  -1.045   1.115
  169    HG3  LYS  29           2HG      LYS  29  -3.820   0.874   0.997
  170    HD3  LYS  29           2HD      LYS  29  -6.053   0.774  -1.017
  171    HE3  LYS  29           2HE      LYS  29  -3.569   2.457  -0.978
  172    HZ1  LYS  29           3HZ      LYS  29  -4.914   1.252  -3.298
  173    HZ2  LYS  29           1HZ      LYS  29  -3.264   1.519  -3.033
  174    HZ3  LYS  29           2HZ      LYS  29  -4.276   2.814  -3.432
  175    H    GLN  30           H        GLN  30  -9.684  -0.271   1.399
  176    HA   GLN  30           HA       GLN  30 -10.230  -1.151   3.852
  177    HB3  GLN  30           2HB      GLN  30 -11.466  -2.862   1.778
  178    HG3  GLN  30           2HG      GLN  30 -12.612  -0.944   3.794
  179   HE21  GLN  30          1HE2      GLN  30 -14.861  -1.117   4.107
  180   HE22  GLN  30          2HE2      GLN  30 -15.900  -1.671   2.844
  181    H    THR  31           H        THR  31  -9.083  -2.476   5.100
  182    HA   THR  31           HA       THR  31  -7.502  -4.616   4.171
  183    HB   THR  31           HB       THR  31  -7.107  -5.176   6.457
  184    HG1  THR  31           1HG      THR  31  -9.533  -3.783   6.919
  185   HG21  THR  31          3HG2      THR  31  -6.375  -2.869   5.529
  186   HG22  THR  31          1HG2      THR  31  -6.240  -3.172   7.261
  187   HG23  THR  31          2HG2      THR  31  -7.589  -2.223   6.634
  188    H    GLU  32           H        GLU  32  -8.039  -6.730   5.887
  189    HA   GLU  32           HA       GLU  32 -10.338  -7.913   4.544
  190    HB3  GLU  32           2HB      GLU  32  -8.556  -9.382   6.457
  191    HG3  GLU  32           2HG      GLU  32  -8.968 -10.804   4.079
  192    H    CYS  33           H        CYS  33 -10.259  -5.992   6.998
  193    HA   CYS  33           HA       CYS  33 -12.032  -7.612   8.706
  194    HB3  CYS  33           2HB      CYS  33  -9.868  -6.768   9.734
  195    H    GLY  34           H        GLY  34 -11.597  -4.609   6.977
  196    HA2  GLY  34           1HA      GLY  34 -13.890  -3.870   6.102
  197    HA3  GLY  34           2HA      GLY  34 -14.289  -3.743   7.807
  198    H    HIS  35           H        HIS  35 -12.050  -2.597   8.868
  199    HA   HIS  35           HA       HIS  35 -12.422   0.104   8.446
  200    HB3  HIS  35           2HB      HIS  35 -10.202   0.405   9.562
  201    HD2  HIS  35           2HD      HIS  35 -12.443   1.129  11.277
  202    HE1  HIS  35           1HE      HIS  35 -12.275  -2.545  13.391
  203    HE2  HIS  35           2HE      HIS  35 -13.262  -0.229  13.320
  204    H    ARG  36           H        ARG  36 -10.499   1.613   7.791
  205    HA   ARG  36           HA       ARG  36  -9.204   0.656   5.346
  206    HB3  ARG  36           2HB      ARG  36  -9.856   2.885   4.273
  207    HG3  ARG  36           2HG      ARG  36 -11.620   0.556   4.668
  208    HD3  ARG  36           2HD      ARG  36 -12.909   2.422   2.912
  209    HE   ARG  36           HE       ARG  36 -14.401   0.881   3.738
  210   HH11  ARG  36          1HH1      ARG  36 -12.855   2.549   6.373
  211   HH12  ARG  36          2HH1      ARG  36 -13.923   1.909   7.578
  212   HH21  ARG  36          1HH2      ARG  36 -15.813   0.030   5.315
  213   HH22  ARG  36          2HH2      ARG  36 -15.604   0.474   6.975
  214    H    PHE  37           H        PHE  37  -7.481   2.090   4.594
  215    HA   PHE  37           HA       PHE  37  -6.504   4.039   6.528
  216    HB3  PHE  37           2HB      PHE  37  -4.187   2.917   6.333
  217    HD1  PHE  37           1HD      PHE  37  -6.678   0.394   7.330
  218    HD2  PHE  37           2HD      PHE  37  -4.138   3.559   8.613
  219    HE1  PHE  37           1HE      PHE  37  -7.084  -0.235   9.674
  220    HE2  PHE  37           2HE      PHE  37  -4.538   2.934  10.958
  221    HZ   PHE  37           HZ       PHE  37  -6.012   1.035  11.492
  222    H    CYS  38           H        CYS  38  -4.402   5.054   5.670
  223    HA   CYS  38           HA       CYS  38  -4.844   5.664   2.842
  224    HB3  CYS  38           2HB      CYS  38  -4.747   7.512   4.526
  225    H    GLU  39           H        GLU  39  -2.869   6.090   1.506
  226    HA   GLU  39           HA       GLU  39  -1.383   3.864   1.052
  227    HB3  GLU  39           2HB      GLU  39   0.402   5.590   0.170
  228    HG3  GLU  39           2HG      GLU  39  -2.373   5.644  -0.987
  229    H    SER  40           H        SER  40  -0.064   6.709   2.757
  230    HA   SER  40           HA       SER  40   2.318   5.644   3.597
  231    HB3  SER  40           2HB      SER  40   0.491   7.703   4.790
  232    HG   SER  40           HG       SER  40   2.968   7.595   5.928
  233    H    CYS  41           H        CYS  41  -0.120   6.137   6.097
  234    HA   CYS  41           HA       CYS  41   0.673   4.426   7.976
  235    HB3  CYS  41           2HB      CYS  41  -1.716   4.041   8.584
  236    H    MET  42           H        MET  42  -1.276   3.431   5.174
  237    HA   MET  42           HA       MET  42  -1.571   0.747   5.763
  238    HB3  MET  42           2HB      MET  42  -1.250   2.134   3.103
  239    HG3  MET  42           2HG      MET  42  -0.869  -0.500   3.281
  240    HE1  MET  42           3HE      MET  42  -2.509  -1.054   5.584
  241    HE2  MET  42           1HE      MET  42  -3.487   0.386   5.299
  242    HE3  MET  42           2HE      MET  42  -4.260  -1.193   5.434
  243    H    ALA  43           H        ALA  43   0.962   2.164   3.683
  244    HA   ALA  43           HA       ALA  43   2.466  -0.179   3.392
  245    HB1  ALA  43           3HB      ALA  43   3.149   2.729   3.132
  246    HB2  ALA  43           1HB      ALA  43   4.365   1.473   2.898
  247    HB3  ALA  43           2HB      ALA  43   2.936   1.521   1.864
  248    H    ALA  44           H        ALA  44   2.179   1.995   6.042
  249    HA   ALA  44           HA       ALA  44   4.690   1.373   7.277
  250    HB1  ALA  44           3HB      ALA  44   2.244   2.538   8.593
  251    HB2  ALA  44           1HB      ALA  44   3.920   2.659   9.132
  252    HB3  ALA  44           2HB      ALA  44   3.405   3.484   7.661
  253    H    LEU  45           H        LEU  45   1.315   0.425   7.896
  254    HA   LEU  45           HA       LEU  45   1.839  -1.300  10.043
  255    HB3  LEU  45           2HB      LEU  45  -0.356  -2.292   9.533
  256    HG   LEU  45           HG       LEU  45  -0.391   0.714   9.268
  257   HD11  LEU  45          1HD1      LEU  45  -2.699   0.626   9.877
  258   HD12  LEU  45          2HD1      LEU  45  -2.634  -1.124  10.083
  259   HD13  LEU  45          3HD1      LEU  45  -2.466  -0.418   8.475
  260   HD21  LEU  45          3HD2      LEU  45   0.226  -1.026  11.442
  261   HD22  LEU  45          1HD2      LEU  45  -1.295  -0.200  11.781
  262   HD23  LEU  45          2HD2      LEU  45   0.155   0.736  11.417
  263    H    LEU  46           H        LEU  46   1.623  -1.930   6.561
  264    HA   LEU  46           HA       LEU  46   1.848  -4.692   6.583
  265    HB3  LEU  46           2HB      LEU  46   2.783  -4.478   4.322
  266    HG   LEU  46           HG       LEU  46   0.526  -2.555   4.859
  267   HD11  LEU  46          1HD1      LEU  46   0.150  -2.361   2.554
  268   HD12  LEU  46          2HD1      LEU  46   1.287  -3.653   2.171
  269   HD13  LEU  46          3HD1      LEU  46   1.883  -2.099   2.753
  270   HD21  LEU  46          3HD2      LEU  46  -0.870  -4.302   4.629
  271   HD22  LEU  46          1HD2      LEU  46   0.546  -5.253   5.074
  272   HD23  LEU  46          2HD2      LEU  46   0.114  -5.059   3.375
  273    H    SER  47           H        SER  47   4.275  -2.252   7.117
  274    HA   SER  47           HA       SER  47   6.435  -4.208   7.008
  275    HB3  SER  47           2HB      SER  47   7.163  -1.547   7.958
  276    HG   SER  47           HG       SER  47   8.756  -1.861   6.544
  277    H    SER  48           H        SER  48   4.399  -4.467   9.045
  278    HA   SER  48           HA       SER  48   5.961  -3.889  11.474
  279    HB3  SER  48           2HB      SER  48   2.992  -4.417  11.184
  280    HG   SER  48           HG       SER  48   4.650  -4.455  13.333
  281    H    SER  49           H        SER  49   6.376  -6.145   9.658
  282    HA   SER  49           HA       SER  49   6.465  -8.445   9.623
  283    HB3  SER  49           2HB      SER  49   7.220  -9.217  12.081
  284    HG   SER  49           HG       SER  49   9.049  -7.533  10.838
  285    H    SER  50           H        SER  50   3.816  -7.291  10.333
  286    HA   SER  50           HA       SER  50   2.262  -9.473  10.600
  287    HB3  SER  50           2HB      SER  50   2.968 -10.307  12.619
  288    HG   SER  50           HG       SER  50   3.265  -8.278  14.274
  289    HA   PRO  51           HA       PRO  51   0.272  -5.238  10.506
  290    HB3  PRO  51           2HB      PRO  51   0.872  -4.854   8.321
  291    HG3  PRO  51           2HG      PRO  51   1.394  -6.614   6.894
  292    HD3  PRO  51           2HD      PRO  51   2.725  -7.157   8.697
  293    H    LYS  52           H        LYS  52  -1.604  -5.226  11.558
  294    HA   LYS  52           HA       LYS  52  -3.602  -7.292  10.908
  295    HB3  LYS  52           2HB      LYS  52  -4.327  -7.295  13.145
  296    HG3  LYS  52           2HG      LYS  52  -1.366  -7.143  12.934
  297    HD3  LYS  52           2HD      LYS  52  -2.682  -7.733  15.561
  298    HE3  LYS  52           2HE      LYS  52   0.099  -6.923  14.720
  299    HZ1  LYS  52           3HZ      LYS  52  -1.194  -6.827  17.278
  300    HZ2  LYS  52           1HZ      LYS  52   0.290  -6.176  16.793
  301    HZ3  LYS  52           2HZ      LYS  52   0.198  -7.789  17.291
  302    H    CYS  53           H        CYS  53  -3.684  -4.131  12.551
  303    HA   CYS  53           HA       CYS  53  -4.843  -2.508  10.760
  304    HB3  CYS  53           2HB      CYS  53  -6.843  -4.509  11.735
  305    H    THR  54           H        THR  54  -4.033  -0.920  12.047
  306    HA   THR  54           HA       THR  54  -3.929  -0.514  14.669
  307    HB   THR  54           HB       THR  54  -4.054   1.239  12.420
  308    HG1  THR  54           1HG      THR  54  -3.199   2.362  14.752
  309   HG21  THR  54          3HG2      THR  54  -5.550   2.227  14.851
  310   HG22  THR  54          1HG2      THR  54  -6.208   2.005  13.230
  311   HG23  THR  54          2HG2      THR  54  -4.990   3.244  13.525
  312    H    ALA  55           H        ALA  55  -6.885  -0.072  12.764
  313    HA   ALA  55           HA       ALA  55  -8.575   0.960  14.681
  314    HB1  ALA  55           3HB      ALA  55 -10.099   0.710  13.082
  315    HB2  ALA  55           1HB      ALA  55  -8.851  -0.079  12.116
  316    HB3  ALA  55           2HB      ALA  55  -9.938  -1.046  13.114
  317    H    CYS  56           H        CYS  56  -8.875  -2.457  13.776
  318    HA   CYS  56           HA       CYS  56  -9.287  -3.082  16.626
  319    HB3  CYS  56           2HB      CYS  56 -11.293  -3.450  15.294
  320    H    GLN  57           H        GLN  57  -7.558  -3.903  13.723
  321    HA   GLN  57           HA       GLN  57  -5.542  -5.004  13.538
  322    HB3  GLN  57           2HB      GLN  57  -4.397  -5.842  15.391
  323    HG3  GLN  57           2HG      GLN  57  -5.804  -4.300  17.320
  324   HE21  GLN  57          1HE2      GLN  57  -3.818  -2.822  14.871
  325   HE22  GLN  57          2HE2      GLN  57  -2.368  -2.750  15.806
  326    H    GLU  58           H        GLU  58  -6.232  -6.377  11.966
  327    HA   GLU  58           HA       GLU  58  -7.080  -9.042  12.859
  328    HB3  GLU  58           2HB      GLU  58  -8.302  -8.616  10.360
  329    HG3  GLU  58           2HG      GLU  58 -10.394  -8.391  12.000
  330    H    SER  59           H        SER  59  -6.271  -7.298   9.851
  331    HA   SER  59           HA       SER  59  -3.837  -8.537   9.363
  332    HB3  SER  59           2HB      SER  59  -5.291  -9.911   7.348
  333    HG   SER  59           HG       SER  59  -3.503 -10.901   7.963
  334    H    ILE  60           H        ILE  60  -2.854  -7.340   7.870
  335    HA   ILE  60           HA       ILE  60  -4.507  -6.014   5.823
  336    HB   ILE  60           HB       ILE  60  -2.043  -4.638   6.733
  337   HG13  ILE  60          2HG1      ILE  60  -3.226  -5.387   8.831
  338   HG21  ILE  60          1HG2      ILE  60  -4.389  -3.015   6.518
  339   HG22  ILE  60          2HG2      ILE  60  -2.934  -3.006   5.523
  340   HG23  ILE  60          3HG2      ILE  60  -4.274  -4.078   5.116
  341   HD11  ILE  60          3HD1      ILE  60  -1.981  -3.085   8.468
  342   HD12  ILE  60          1HD1      ILE  60  -3.602  -2.451   8.753
  343   HD13  ILE  60          2HD1      ILE  60  -2.825  -3.468   9.968
  344    H    VAL  61           H        VAL  61  -4.001  -7.051   3.993
  345    HA   VAL  61           HA       VAL  61  -1.146  -7.303   3.311
  346    HB   VAL  61           HB       VAL  61  -3.339  -9.288   2.697
  347   HG11  VAL  61          1HG1      VAL  61  -2.174  -9.878   0.902
  348   HG12  VAL  61          2HG1      VAL  61  -0.915  -8.699   1.278
  349   HG13  VAL  61          3HG1      VAL  61  -0.837 -10.324   1.963
  350   HG21  VAL  61          3HG2      VAL  61  -1.636 -10.806   3.901
  351   HG22  VAL  61          1HG2      VAL  61  -0.962  -9.299   4.522
  352   HG23  VAL  61          2HG2      VAL  61  -2.637  -9.728   4.873
  353    H    LYS  62           H        LYS  62  -0.624  -6.175   1.568
  354    HA   LYS  62           HA       LYS  62  -2.214  -4.575   0.066
  355    HB3  LYS  62           2HB      LYS  62   0.151  -4.405  -0.168
  356    HG3  LYS  62           2HG      LYS  62   0.533  -6.796  -1.832
  357    HD3  LYS  62           2HD      LYS  62   2.133  -4.891  -0.662
  358    HE3  LYS  62           2HE      LYS  62   3.061  -7.314   0.717
  359    HZ1  LYS  62           3HZ      LYS  62   4.250  -5.788   1.770
  360    HZ2  LYS  62           1HZ      LYS  62   2.865  -4.958   2.276
  361    HZ3  LYS  62           2HZ      LYS  62   3.567  -4.600   0.780
  362    H    ASP  63           H        ASP  63  -1.328  -7.915  -0.791
  363    HA   ASP  63           HA       ASP  63  -2.768  -8.094  -3.167
  364    HB3  ASP  63           2HB      ASP  63  -2.365 -10.360  -1.210
  365    H    LYS  64           H        LYS  64  -3.790  -8.724   0.161
  366    HA   LYS  64           HA       LYS  64  -6.486  -9.381  -0.693
  367    HB3  LYS  64           2HB      LYS  64  -6.916  -9.961   1.562
  368    HG3  LYS  64           2HG      LYS  64  -4.928 -11.271   2.320
  369    HD3  LYS  64           2HD      LYS  64  -5.324 -11.728  -0.611
  370    HE3  LYS  64           2HE      LYS  64  -3.974 -13.313   0.685
  371    HZ1  LYS  64           3HZ      LYS  64  -5.194 -14.726   2.318
  372    HZ2  LYS  64           1HZ      LYS  64  -6.438 -13.580   2.312
  373    HZ3  LYS  64           2HZ      LYS  64  -4.893 -13.147   2.847
  374    H    VAL  65           H        VAL  65  -4.812  -6.582  -0.254
  375    HA   VAL  65           HA       VAL  65  -6.956  -5.066   0.995
  376    HB   VAL  65           HB       VAL  65  -4.138  -4.674   0.600
  377   HG11  VAL  65          1HG1      VAL  65  -5.883  -2.382  -0.293
  378   HG12  VAL  65          2HG1      VAL  65  -4.144  -2.304  -0.006
  379   HG13  VAL  65          3HG1      VAL  65  -4.780  -3.304  -1.312
  380   HG21  VAL  65          3HG2      VAL  65  -4.846  -4.363   2.757
  381   HG22  VAL  65          1HG2      VAL  65  -4.797  -2.689   2.206
  382   HG23  VAL  65          2HG2      VAL  65  -6.333  -3.551   2.269
  383    H    PHE  66           H        PHE  66  -8.057  -3.347  -0.015
  384    HA   PHE  66           HA       PHE  66  -8.147  -3.558  -2.952
  385    HB3  PHE  66           2HB      PHE  66 -10.475  -2.800  -2.805
  386    HD1  PHE  66           1HD      PHE  66 -10.209  -4.668   0.336
  387    HD2  PHE  66           2HD      PHE  66 -10.738  -4.927  -3.880
  388    HE1  PHE  66           1HE      PHE  66 -10.915  -7.013   0.572
  389    HE2  PHE  66           2HE      PHE  66 -11.447  -7.273  -3.649
  390    HZ   PHE  66           HZ       PHE  66 -11.536  -8.318  -1.421
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1 -39.176  29.672  11.103
    2    HA2  GLY   1           1HA      GLY   1 -41.412  27.970  11.958
    3    HA3  GLY   1           2HA      GLY   1 -40.485  27.494  10.543
    4    H    SER   2           H        SER   2 -38.939  26.066  10.915
    5    HA   SER   2           HA       SER   2 -37.326  24.836  11.945
    6    HB3  SER   2           2HB      SER   2 -37.074  27.489  13.294
    7    HG   SER   2           HG       SER   2 -35.287  26.570  14.492
    8    H    SER   3           H        SER   3 -36.676  23.932  14.193
    9    HA   SER   3           HA       SER   3 -39.049  23.721  15.916
   10    HB3  SER   3           2HB      SER   3 -37.607  21.226  15.860
   11    HG   SER   3           HG       SER   3 -40.226  21.909  14.998
   12    H    GLY   4           H        GLY   4 -38.619  23.098  18.105
   13    HA2  GLY   4           1HA      GLY   4 -35.884  23.821  18.935
   14    HA3  GLY   4           2HA      GLY   4 -37.325  24.030  19.918
   15    H    SER   5           H        SER   5 -37.610  21.109  18.414
   16    HA   SER   5           HA       SER   5 -36.900  19.700  20.850
   17    HB3  SER   5           2HB      SER   5 -38.736  18.559  20.241
   18    HG   SER   5           HG       SER   5 -39.850  19.296  18.615
   19    H    SER   6           H        SER   6 -36.056  17.303  20.235
   20    HA   SER   6           HA       SER   6 -34.044  17.222  18.204
   21    HB3  SER   6           2HB      SER   6 -32.703  16.856  20.786
   22    HG   SER   6           HG       SER   6 -31.325  18.483  19.521
   23    H    GLY   7           H        GLY   7 -33.135  15.155  17.944
   24    HA2  GLY   7           1HA      GLY   7 -33.236  13.015  19.685
   25    HA3  GLY   7           2HA      GLY   7 -34.788  13.018  18.860
   26    H    PHE   8           H        PHE   8 -34.910  11.871  17.054
   27    HA   PHE   8           HA       PHE   8 -33.116  10.196  16.014
   28    HB3  PHE   8           2HB      PHE   8 -34.557  11.672  13.896
   29    HD1  PHE   8           1HD      PHE   8 -35.088   8.527  15.827
   30    HD2  PHE   8           2HD      PHE   8 -34.096  10.320  12.096
   31    HE1  PHE   8           1HE      PHE   8 -35.047   6.304  14.773
   32    HE2  PHE   8           2HE      PHE   8 -34.055   8.100  11.036
   33    HZ   PHE   8           HZ       PHE   8 -34.533   6.089  12.374
   34    H    VAL   9           H        VAL   9 -30.991  10.727  15.901
   35    HA   VAL   9           HA       VAL   9 -30.181  13.112  14.423
   36    HB   VAL   9           HB       VAL   9 -29.104  12.636  16.597
   37   HG11  VAL   9          1HG1      VAL   9 -27.979  10.725  17.094
   38   HG12  VAL   9          2HG1      VAL   9 -29.138  10.056  15.943
   39   HG13  VAL   9          3HG1      VAL   9 -27.497  10.442  15.421
   40   HG21  VAL   9          3HG2      VAL   9 -27.055  12.349  14.420
   41   HG22  VAL   9          1HG2      VAL   9 -27.981  13.833  14.638
   42   HG23  VAL   9          2HG2      VAL   9 -26.938  13.247  15.933
   43    H    LYS  10           H        LYS  10 -29.754  12.991  12.331
   44    HA   LYS  10           HA       LYS  10 -29.267  10.401  11.092
   45    HB3  LYS  10           2HB      LYS  10 -29.159  12.465   9.161
   46    HG3  LYS  10           2HG      LYS  10 -31.780  11.231   9.545
   47    HD3  LYS  10           2HD      LYS  10 -29.938  10.683   7.268
   48    HE3  LYS  10           2HE      LYS  10 -32.854  11.437   7.445
   49    HZ1  LYS  10           3HZ      LYS  10 -32.991  11.139   5.202
   50    HZ2  LYS  10           1HZ      LYS  10 -31.634  10.133   5.121
   51    HZ3  LYS  10           2HZ      LYS  10 -31.438  11.804   5.298
   52    H    THR  11           H        THR  11 -27.428   9.853   9.963
   53    HA   THR  11           HA       THR  11 -25.150  11.709  10.197
   54    HB   THR  11           HB       THR  11 -24.499   8.833  10.163
   55    HG1  THR  11           1HG      THR  11 -26.414   9.188  11.638
   56   HG21  THR  11          3HG2      THR  11 -23.540  11.324  11.520
   57   HG22  THR  11          1HG2      THR  11 -22.659  10.210  10.474
   58   HG23  THR  11          2HG2      THR  11 -23.053   9.742  12.128
   59    H    VAL  12           H        VAL  12 -24.012  12.064   8.388
   60    HA   VAL  12           HA       VAL  12 -24.466  10.275   6.090
   61    HB   VAL  12           HB       VAL  12 -25.690  12.305   5.661
   62   HG11  VAL  12          1HG1      VAL  12 -23.598  13.527   7.104
   63   HG12  VAL  12          2HG1      VAL  12 -23.594  14.236   5.487
   64   HG13  VAL  12          3HG1      VAL  12 -25.062  14.276   6.465
   65   HG21  VAL  12          3HG2      VAL  12 -24.623  11.364   3.732
   66   HG22  VAL  12          1HG2      VAL  12 -24.493  13.120   3.630
   67   HG23  VAL  12          2HG2      VAL  12 -23.099  12.160   4.126
   68    H    GLU  13           H        GLU  13 -22.641   9.283   5.565
   69    HA   GLU  13           HA       GLU  13 -20.079  10.558   6.177
   70    HB3  GLU  13           2HB      GLU  13 -19.341   8.135   5.318
   71    HG3  GLU  13           2HG      GLU  13 -20.332   8.973   8.000
   72    H    ASP  14           H        ASP  14 -18.736  11.302   4.653
   73    HA   ASP  14           HA       ASP  14 -19.388  10.717   1.838
   74    HB3  ASP  14           2HB      ASP  14 -18.093  13.104   1.685
   75    H    LYS  15           H        LYS  15 -17.839   9.690   0.777
   76    HA   LYS  15           HA       LYS  15 -15.804   8.909   0.129
   77    HB3  LYS  15           2HB      LYS  15 -13.952  10.351   0.185
   78    HG3  LYS  15           2HG      LYS  15 -16.505  11.564  -0.241
   79    HD3  LYS  15           2HD      LYS  15 -15.414  12.980   1.706
   80    HE3  LYS  15           2HE      LYS  15 -13.281  13.202   0.329
   81    HZ1  LYS  15           3HZ      LYS  15 -14.536  15.473  -1.011
   82    HZ2  LYS  15           1HZ      LYS  15 -14.798  13.941  -1.679
   83    HZ3  LYS  15           2HZ      LYS  15 -13.222  14.523  -1.494
   84    H    TYR  16           H        TYR  16 -13.650   8.097   1.020
   85    HA   TYR  16           HA       TYR  16 -14.196   6.828   3.584
   86    HB3  TYR  16           2HB      TYR  16 -12.385   5.318   3.030
   87    HD1  TYR  16           2HD      TYR  16 -13.317   6.456  -0.350
   88    HD2  TYR  16           1HD      TYR  16 -14.189   3.761   2.825
   89    HE1  TYR  16           2HE      TYR  16 -14.793   5.180  -1.847
   90    HE2  TYR  16           1HE      TYR  16 -15.666   2.477   1.337
   91    HH   TYR  16           HH       TYR  16 -16.599   3.636  -1.775
   92    H    LYS  17           H        LYS  17 -12.222   6.481   5.030
   93    HA   LYS  17           HA       LYS  17 -10.329   8.681   5.046
   94    HB3  LYS  17           2HB      LYS  17 -12.545   8.383   7.033
   95    HG3  LYS  17           2HG      LYS  17 -10.826  10.208   8.186
   96    HD3  LYS  17           2HD      LYS  17 -10.460   8.062   9.758
   97    HE3  LYS  17           2HE      LYS  17 -12.402  10.160   9.521
   98    HZ1  LYS  17           3HZ      LYS  17 -13.615   7.690   9.640
   99    HZ2  LYS  17           1HZ      LYS  17 -14.325   9.188   9.974
  100    HZ3  LYS  17           2HZ      LYS  17 -13.653   8.272  11.228
  101    H    CYS  18           H        CYS  18  -8.447   8.200   6.101
  102    HA   CYS  18           HA       CYS  18  -7.836   5.492   6.569
  103    HB3  CYS  18           2HB      CYS  18  -6.373   8.036   7.273
  104    H    GLU  19           H        GLU  19  -7.635   4.292   8.412
  105    HA   GLU  19           HA       GLU  19  -9.074   5.262  10.731
  106    HB3  GLU  19           2HB      GLU  19  -8.190   2.780  11.432
  107    HG3  GLU  19           2HG      GLU  19 -10.308   1.937  10.927
  108    H    LYS  20           H        LYS  20  -6.420   6.373  10.032
  109    HA   LYS  20           HA       LYS  20  -5.133   5.890  12.628
  110    HB3  LYS  20           2HB      LYS  20  -3.154   6.535  10.645
  111    HG3  LYS  20           2HG      LYS  20  -3.630   4.242  12.507
  112    HD3  LYS  20           2HD      LYS  20  -1.280   4.509  10.634
  113    HE3  LYS  20           2HE      LYS  20  -0.331   2.784  11.720
  114    HZ1  LYS  20           3HZ      LYS  20  -0.977   4.326  13.535
  115    HZ2  LYS  20           1HZ      LYS  20  -0.774   2.724  14.042
  116    HZ3  LYS  20           2HZ      LYS  20  -2.329   3.355  13.838
  117    H    CYS  21           H        CYS  21  -4.733   7.957   9.743
  118    HA   CYS  21           HA       CYS  21  -4.373  10.259  11.523
  119    HB3  CYS  21           2HB      CYS  21  -2.587  10.050   9.954
  120    H    HIS  22           H        HIS  22  -6.861   8.774  10.101
  121    HA   HIS  22           HA       HIS  22  -8.973   9.372   9.501
  122    HB3  HIS  22           2HB      HIS  22  -9.864  10.849  10.933
  123    HD2  HIS  22           2HD      HIS  22  -7.731   9.113  12.523
  124    HE1  HIS  22           1HE      HIS  22  -6.438  12.761  14.260
  125    HE2  HIS  22           2HE      HIS  22  -6.351  10.248  14.394
  126    H    LEU  23           H        LEU  23  -6.634   9.919   7.722
  127    HA   LEU  23           HA       LEU  23  -7.153  12.294   6.255
  128    HB3  LEU  23           2HB      LEU  23  -5.885  10.728   4.460
  129    HG   LEU  23           HG       LEU  23  -3.689  11.309   5.867
  130   HD11  LEU  23          1HD1      LEU  23  -3.745  13.535   4.771
  131   HD12  LEU  23          2HD1      LEU  23  -5.431  13.241   4.347
  132   HD13  LEU  23          3HD1      LEU  23  -4.165  12.204   3.692
  133   HD21  LEU  23          3HD2      LEU  23  -3.915  12.890   7.482
  134   HD22  LEU  23          1HD2      LEU  23  -5.456  12.065   7.708
  135   HD23  LEU  23          2HD2      LEU  23  -5.387  13.562   6.778
  136    H    VAL  24           H        VAL  24  -8.893  12.681   5.071
  137    HA   VAL  24           HA       VAL  24 -10.704  10.649   4.245
  138    HB   VAL  24           HB       VAL  24 -10.534  13.560   3.459
  139   HG11  VAL  24          1HG1      VAL  24 -12.757  13.343   2.560
  140   HG12  VAL  24          2HG1      VAL  24 -11.701  12.171   1.769
  141   HG13  VAL  24          3HG1      VAL  24 -12.821  11.644   3.027
  142   HG21  VAL  24          3HG2      VAL  24 -12.815  12.979   5.012
  143   HG22  VAL  24          1HG2      VAL  24 -11.440  12.220   5.815
  144   HG23  VAL  24          2HG2      VAL  24 -11.413  13.948   5.463
  145    H    LEU  25           H        LEU  25 -10.481   9.331   2.573
  146    HA   LEU  25           HA       LEU  25  -9.113  10.323   0.163
  147    HB3  LEU  25           2HB      LEU  25  -7.563   8.758   0.348
  148    HG   LEU  25           HG       LEU  25  -8.972   8.114   2.880
  149   HD11  LEU  25          1HD1      LEU  25  -6.672   6.385   2.238
  150   HD12  LEU  25          2HD1      LEU  25  -8.194   5.985   1.444
  151   HD13  LEU  25          3HD1      LEU  25  -8.109   6.056   3.204
  152   HD21  LEU  25          3HD2      LEU  25  -6.142   8.791   2.095
  153   HD22  LEU  25          1HD2      LEU  25  -6.656   8.426   3.743
  154   HD23  LEU  25          2HD2      LEU  25  -7.310   9.836   2.908
  155    H    CYS  26           H        CYS  26  -9.636   8.969  -1.793
  156    HA   CYS  26           HA       CYS  26 -12.515   8.430  -1.802
  157    HB3  CYS  26           2HB      CYS  26 -12.561   9.128  -3.969
  158    H    SER  27           H        SER  27  -9.415   6.939  -2.501
  159    HA   SER  27           HA       SER  27 -10.786   4.343  -2.708
  160    HB3  SER  27           2HB      SER  27  -8.613   5.458  -4.470
  161    HG   SER  27           HG       SER  27  -8.748   3.123  -5.271
  162    HA   PRO  28           HA       PRO  28  -7.651   4.220   0.679
  163    HB3  PRO  28           2HB      PRO  28  -9.296   4.524   2.254
  164    HG3  PRO  28           2HG      PRO  28 -11.510   3.981   1.796
  165    HD3  PRO  28           2HD      PRO  28 -11.021   5.250  -0.065
  166    H    LYS  29           H        LYS  29  -7.507   1.940   2.162
  167    HA   LYS  29           HA       LYS  29  -7.398  -0.283   0.250
  168    HB3  LYS  29           2HB      LYS  29  -5.166  -0.526   0.341
  169    HG3  LYS  29           2HG      LYS  29  -3.827   1.459   1.088
  170    HD3  LYS  29           2HD      LYS  29  -5.696   2.879  -0.519
  171    HE3  LYS  29           2HE      LYS  29  -3.146   1.388  -1.108
  172    HZ1  LYS  29           3HZ      LYS  29  -3.067   2.500  -3.185
  173    HZ2  LYS  29           1HZ      LYS  29  -4.469   3.387  -2.853
  174    HZ3  LYS  29           2HZ      LYS  29  -4.565   1.718  -3.112
  175    H    GLN  30           H        GLN  30  -9.167  -1.211   1.320
  176    HA   GLN  30           HA       GLN  30  -9.581  -1.549   4.007
  177    HB3  GLN  30           2HB      GLN  30 -10.298  -4.001   2.754
  178    HG3  GLN  30           2HG      GLN  30 -11.879  -1.524   3.382
  179   HE21  GLN  30          1HE2      GLN  30 -13.002  -4.716   3.928
  180   HE22  GLN  30          2HE2      GLN  30 -14.241  -4.725   2.723
  181    H    THR  31           H        THR  31  -9.545  -3.884   5.053
  182    HA   THR  31           HA       THR  31  -6.898  -5.092   4.650
  183    HB   THR  31           HB       THR  31  -6.294  -5.015   6.900
  184    HG1  THR  31           1HG      THR  31  -9.024  -4.907   7.302
  185   HG21  THR  31          3HG2      THR  31  -6.722  -2.678   5.625
  186   HG22  THR  31          1HG2      THR  31  -6.007  -2.792   7.233
  187   HG23  THR  31          2HG2      THR  31  -7.726  -2.436   7.055
  188    H    GLU  32           H        GLU  32  -9.963  -5.684   4.348
  189    HA   GLU  32           HA       GLU  32 -11.049  -7.705   4.125
  190    HB3  GLU  32           2HB      GLU  32  -9.341  -9.241   5.965
  191    HG3  GLU  32           2HG      GLU  32  -9.501  -9.966   3.128
  192    H    CYS  33           H        CYS  33 -10.584  -5.842   6.732
  193    HA   CYS  33           HA       CYS  33 -12.388  -7.421   8.445
  194    HB3  CYS  33           2HB      CYS  33 -10.103  -6.781   9.357
  195    H    GLY  34           H        GLY  34 -11.921  -4.427   6.754
  196    HA2  GLY  34           1HA      GLY  34 -14.179  -3.461   6.116
  197    HA3  GLY  34           2HA      GLY  34 -14.470  -3.416   7.849
  198    H    HIS  35           H        HIS  35 -12.027  -2.509   8.776
  199    HA   HIS  35           HA       HIS  35 -12.275   0.261   8.459
  200    HB3  HIS  35           2HB      HIS  35 -10.106   0.392   9.661
  201    HD2  HIS  35           2HD      HIS  35 -12.191   1.156  11.469
  202    HE1  HIS  35           1HE      HIS  35 -12.494  -2.700  13.212
  203    HE2  HIS  35           2HE      HIS  35 -13.196  -0.287  13.366
  204    H    ARG  36           H        ARG  36 -10.533   1.742   7.699
  205    HA   ARG  36           HA       ARG  36  -9.099   0.689   5.360
  206    HB3  ARG  36           2HB      ARG  36  -9.684   2.980   4.289
  207    HG3  ARG  36           2HG      ARG  36 -11.398   0.579   4.475
  208    HD3  ARG  36           2HD      ARG  36 -12.528   2.473   2.626
  209    HE   ARG  36           HE       ARG  36 -14.042   0.835   3.208
  210   HH11  ARG  36          1HH1      ARG  36 -12.935   2.503   6.056
  211   HH12  ARG  36          2HH1      ARG  36 -14.132   1.800   7.092
  212   HH21  ARG  36          1HH2      ARG  36 -15.622  -0.098   4.562
  213   HH22  ARG  36          2HH2      ARG  36 -15.659   0.319   6.242
  214    H    PHE  37           H        PHE  37  -7.385   2.183   4.588
  215    HA   PHE  37           HA       PHE  37  -6.410   4.089   6.563
  216    HB3  PHE  37           2HB      PHE  37  -4.093   2.976   6.359
  217    HD1  PHE  37           2HD      PHE  37  -6.482   0.350   7.279
  218    HD2  PHE  37           1HD      PHE  37  -4.158   3.639   8.656
  219    HE1  PHE  37           2HE      PHE  37  -6.900  -0.333   9.606
  220    HE2  PHE  37           1HE      PHE  37  -4.571   2.959  10.985
  221    HZ   PHE  37           HZ       PHE  37  -5.944   0.972  11.463
  222    H    CYS  38           H        CYS  38  -4.348   5.164   5.734
  223    HA   CYS  38           HA       CYS  38  -4.782   5.832   2.927
  224    HB3  CYS  38           2HB      CYS  38  -4.625   7.617   4.687
  225    H    GLU  39           H        GLU  39  -2.996   6.029   1.447
  226    HA   GLU  39           HA       GLU  39  -1.491   3.845   1.018
  227    HB3  GLU  39           2HB      GLU  39   0.264   5.606   0.051
  228    HG3  GLU  39           2HG      GLU  39  -2.438   5.669  -1.213
  229    H    SER  40           H        SER  40  -0.432   6.634   2.948
  230    HA   SER  40           HA       SER  40   2.117   5.660   3.593
  231    HB3  SER  40           2HB      SER  40   1.659   7.204   5.714
  232    HG   SER  40           HG       SER  40   1.621   8.792   3.507
  233    H    CYS  41           H        CYS  41  -0.225   6.127   6.179
  234    HA   CYS  41           HA       CYS  41   0.648   4.412   8.018
  235    HB3  CYS  41           2HB      CYS  41  -1.701   4.033   8.739
  236    H    MET  42           H        MET  42  -1.156   3.458   5.140
  237    HA   MET  42           HA       MET  42  -1.531   0.756   5.766
  238    HB3  MET  42           2HB      MET  42  -1.238   2.165   3.113
  239    HG3  MET  42           2HG      MET  42  -0.695  -0.211   2.817
  240    HE1  MET  42           3HE      MET  42  -4.288   0.456   3.984
  241    HE2  MET  42           1HE      MET  42  -4.656  -0.929   5.011
  242    HE3  MET  42           2HE      MET  42  -3.460   0.259   5.529
  243    H    ALA  43           H        ALA  43   1.012   2.237   3.748
  244    HA   ALA  43           HA       ALA  43   2.511  -0.093   3.354
  245    HB1  ALA  43           3HB      ALA  43   2.827   2.733   2.855
  246    HB2  ALA  43           1HB      ALA  43   4.351   1.994   3.349
  247    HB3  ALA  43           2HB      ALA  43   3.467   1.353   1.962
  248    H    ALA  44           H        ALA  44   2.342   2.091   6.054
  249    HA   ALA  44           HA       ALA  44   4.783   1.327   7.298
  250    HB1  ALA  44           3HB      ALA  44   3.243   2.212   9.357
  251    HB2  ALA  44           1HB      ALA  44   4.181   3.248   8.282
  252    HB3  ALA  44           2HB      ALA  44   2.464   2.984   7.977
  253    H    LEU  45           H        LEU  45   1.396   0.527   8.098
  254    HA   LEU  45           HA       LEU  45   1.912  -1.339  10.083
  255    HB3  LEU  45           2HB      LEU  45  -0.321  -2.242   9.596
  256    HG   LEU  45           HG       LEU  45  -0.216   0.768   9.459
  257   HD11  LEU  45          1HD1      LEU  45  -2.391  -0.861   8.840
  258   HD12  LEU  45          2HD1      LEU  45  -2.421   0.858   9.230
  259   HD13  LEU  45          3HD1      LEU  45  -2.661  -0.339  10.503
  260   HD21  LEU  45          3HD2      LEU  45  -1.192  -0.666  11.839
  261   HD22  LEU  45          1HD2      LEU  45  -0.175   0.770  11.711
  262   HD23  LEU  45          2HD2      LEU  45   0.531  -0.832  11.497
  263    H    LEU  46           H        LEU  46   1.561  -1.843   6.587
  264    HA   LEU  46           HA       LEU  46   1.709  -4.596   6.482
  265    HB3  LEU  46           2HB      LEU  46   2.744  -4.269   4.228
  266    HG   LEU  46           HG       LEU  46   0.371  -2.492   4.788
  267   HD11  LEU  46          1HD1      LEU  46   1.834  -3.150   2.291
  268   HD12  LEU  46          2HD1      LEU  46   0.987  -1.674   2.755
  269   HD13  LEU  46          3HD1      LEU  46   0.072  -3.086   2.229
  270   HD21  LEU  46          3HD2      LEU  46  -0.027  -4.825   5.324
  271   HD22  LEU  46          1HD2      LEU  46   0.588  -5.314   3.745
  272   HD23  LEU  46          2HD2      LEU  46  -0.902  -4.379   3.858
  273    H    SER  47           H        SER  47   4.296  -2.256   6.900
  274    HA   SER  47           HA       SER  47   6.335  -4.325   6.787
  275    HB3  SER  47           2HB      SER  47   7.027  -1.573   7.669
  276    HG   SER  47           HG       SER  47   8.291  -2.533   5.494
  277    H    SER  48           H        SER  48   4.340  -4.476   8.875
  278    HA   SER  48           HA       SER  48   5.953  -3.926  11.272
  279    HB3  SER  48           2HB      SER  48   2.985  -4.467  11.011
  280    HG   SER  48           HG       SER  48   2.894  -4.170  13.184
  281    H    SER  49           H        SER  49   6.321  -6.192   9.430
  282    HA   SER  49           HA       SER  49   6.460  -8.483   9.408
  283    HB3  SER  49           2HB      SER  49   7.440  -9.379  11.564
  284    HG   SER  49           HG       SER  49   8.462  -7.136  10.213
  285    H    SER  50           H        SER  50   3.805  -7.327  10.168
  286    HA   SER  50           HA       SER  50   2.251  -9.512  10.401
  287    HB3  SER  50           2HB      SER  50   1.804  -9.163  13.074
  288    HG   SER  50           HG       SER  50   2.132 -11.213  12.828
  289    HA   PRO  51           HA       PRO  51   0.270  -5.271  10.450
  290    HB3  PRO  51           2HB      PRO  51   0.849  -4.822   8.272
  291    HG3  PRO  51           2HG      PRO  51   1.353  -6.538   6.787
  292    HD3  PRO  51           2HD      PRO  51   2.701  -7.138   8.559
  293    H    LYS  52           H        LYS  52  -1.599  -5.283  11.514
  294    HA   LYS  52           HA       LYS  52  -3.589  -7.355  10.860
  295    HB3  LYS  52           2HB      LYS  52  -4.263  -7.416  13.083
  296    HG3  LYS  52           2HG      LYS  52  -1.324  -6.873  13.009
  297    HD3  LYS  52           2HD      LYS  52  -2.789  -7.785  15.473
  298    HE3  LYS  52           2HE      LYS  52  -0.417  -6.611  16.194
  299    HZ1  LYS  52           3HZ      LYS  52  -0.155  -9.414  15.595
  300    HZ2  LYS  52           1HZ      LYS  52  -1.565  -9.041  16.453
  301    HZ3  LYS  52           2HZ      LYS  52  -0.055  -8.611  17.081
  302    H    CYS  53           H        CYS  53  -3.711  -4.176  12.466
  303    HA   CYS  53           HA       CYS  53  -4.875  -2.581  10.657
  304    HB3  CYS  53           2HB      CYS  53  -6.864  -4.596  11.629
  305    H    THR  54           H        THR  54  -4.076  -0.990  11.953
  306    HA   THR  54           HA       THR  54  -4.016  -0.566  14.571
  307    HB   THR  54           HB       THR  54  -4.145   1.180  12.308
  308    HG1  THR  54           1HG      THR  54  -2.453   0.848  13.971
  309   HG21  THR  54          3HG2      THR  54  -5.082   3.178  13.379
  310   HG22  THR  54          1HG2      THR  54  -5.571   2.207  14.766
  311   HG23  THR  54          2HG2      THR  54  -6.303   1.921  13.186
  312    H    ALA  55           H        ALA  55  -6.946  -0.149  12.622
  313    HA   ALA  55           HA       ALA  55  -8.668   0.884  14.511
  314    HB1  ALA  55           3HB      ALA  55 -10.157   0.632  12.881
  315    HB2  ALA  55           1HB      ALA  55  -8.900  -0.180  11.945
  316    HB3  ALA  55           2HB      ALA  55 -10.011  -1.125  12.938
  317    H    CYS  56           H        CYS  56  -8.954  -2.535  13.612
  318    HA   CYS  56           HA       CYS  56  -9.391  -3.154  16.459
  319    HB3  CYS  56           2HB      CYS  56 -11.387  -3.520  15.110
  320    H    GLN  57           H        GLN  57  -7.621  -3.959  13.583
  321    HA   GLN  57           HA       GLN  57  -5.603  -5.062  13.425
  322    HB3  GLN  57           2HB      GLN  57  -4.490  -5.906  15.289
  323    HG3  GLN  57           2HG      GLN  57  -5.926  -4.436  17.235
  324   HE21  GLN  57          1HE2      GLN  57  -3.731  -3.587  14.575
  325   HE22  GLN  57          2HE2      GLN  57  -2.384  -3.200  15.585
  326    H    GLU  58           H        GLU  58  -6.259  -6.416  11.825
  327    HA   GLU  58           HA       GLU  58  -7.179  -9.075  12.673
  328    HB3  GLU  58           2HB      GLU  58  -8.256  -8.694  10.128
  329    HG3  GLU  58           2HG      GLU  58 -10.418  -8.259  11.627
  330    H    SER  59           H        SER  59  -6.235  -7.417   9.658
  331    HA   SER  59           HA       SER  59  -3.758  -8.604   9.314
  332    HB3  SER  59           2HB      SER  59  -5.058 -10.155   7.338
  333    HG   SER  59           HG       SER  59  -3.391 -11.196   8.091
  334    H    ILE  60           H        ILE  60  -2.925  -7.057   8.088
  335    HA   ILE  60           HA       ILE  60  -4.519  -6.000   5.852
  336    HB   ILE  60           HB       ILE  60  -2.041  -4.597   6.649
  337   HG13  ILE  60          2HG1      ILE  60  -3.114  -5.313   8.818
  338   HG21  ILE  60          1HG2      ILE  60  -3.821  -2.683   6.460
  339   HG22  ILE  60          2HG2      ILE  60  -3.181  -3.461   5.013
  340   HG23  ILE  60          3HG2      ILE  60  -4.762  -3.927   5.639
  341   HD11  ILE  60          3HD1      ILE  60  -2.079  -2.841   8.172
  342   HD12  ILE  60          1HD1      ILE  60  -3.600  -2.467   8.984
  343   HD13  ILE  60          2HD1      ILE  60  -2.388  -3.461   9.794
  344    H    VAL  61           H        VAL  61  -4.028  -6.937   3.982
  345    HA   VAL  61           HA       VAL  61  -1.186  -7.305   3.312
  346    HB   VAL  61           HB       VAL  61  -3.401  -9.235   2.607
  347   HG11  VAL  61          1HG1      VAL  61  -2.058  -9.813   0.926
  348   HG12  VAL  61          2HG1      VAL  61  -0.751  -8.789   1.523
  349   HG13  VAL  61          3HG1      VAL  61  -0.943 -10.429   2.144
  350   HG21  VAL  61          3HG2      VAL  61  -1.659 -10.706   4.011
  351   HG22  VAL  61          1HG2      VAL  61  -1.419  -9.145   4.798
  352   HG23  VAL  61          2HG2      VAL  61  -3.026  -9.872   4.750
  353    H    LYS  62           H        LYS  62  -0.672  -6.115   1.609
  354    HA   LYS  62           HA       LYS  62  -2.247  -4.537   0.084
  355    HB3  LYS  62           2HB      LYS  62   0.109  -4.343  -0.143
  356    HG3  LYS  62           2HG      LYS  62   0.531  -6.776  -1.743
  357    HD3  LYS  62           2HD      LYS  62   2.457  -6.509   0.252
  358    HE3  LYS  62           2HE      LYS  62   2.422  -6.743  -2.429
  359    HZ1  LYS  62           3HZ      LYS  62   2.049  -4.413  -2.839
  360    HZ2  LYS  62           1HZ      LYS  62   3.615  -4.822  -3.330
  361    HZ3  LYS  62           2HZ      LYS  62   3.375  -3.985  -1.880
  362    H    ASP  63           H        ASP  63  -1.580  -7.957  -0.497
  363    HA   ASP  63           HA       ASP  63  -2.960  -8.104  -2.975
  364    HB3  ASP  63           2HB      ASP  63  -2.915 -10.595  -1.460
  365    H    LYS  64           H        LYS  64  -3.881  -8.832   0.369
  366    HA   LYS  64           HA       LYS  64  -6.571  -9.559  -0.398
  367    HB3  LYS  64           2HB      LYS  64  -6.939 -10.033   1.904
  368    HG3  LYS  64           2HG      LYS  64  -4.678 -11.127   2.624
  369    HD3  LYS  64           2HD      LYS  64  -6.108 -12.013   0.116
  370    HE3  LYS  64           2HE      LYS  64  -3.878 -13.111   1.183
  371    HZ1  LYS  64           3HZ      LYS  64  -6.015 -14.819   2.280
  372    HZ2  LYS  64           1HZ      LYS  64  -5.331 -13.598   3.230
  373    HZ3  LYS  64           2HZ      LYS  64  -4.357 -14.838   2.617
  374    H    VAL  65           H        VAL  65  -4.965  -6.680   0.012
  375    HA   VAL  65           HA       VAL  65  -7.264  -5.233   1.089
  376    HB   VAL  65           HB       VAL  65  -4.457  -4.348   0.431
  377   HG11  VAL  65          1HG1      VAL  65  -5.303  -2.207   1.641
  378   HG12  VAL  65          2HG1      VAL  65  -5.634  -2.425  -0.078
  379   HG13  VAL  65          3HG1      VAL  65  -6.893  -2.756   1.112
  380   HG21  VAL  65          3HG2      VAL  65  -4.963  -3.730   3.044
  381   HG22  VAL  65          1HG2      VAL  65  -5.864  -5.233   2.839
  382   HG23  VAL  65          2HG2      VAL  65  -4.137  -5.186   2.488
  383    H    PHE  66           H        PHE  66  -8.502  -3.840  -0.070
  384    HA   PHE  66           HA       PHE  66  -7.973  -3.709  -2.965
  385    HB3  PHE  66           2HB      PHE  66 -10.524  -3.180  -3.012
  386    HD1  PHE  66           1HD      PHE  66 -10.088  -4.552  -4.960
  387    HD2  PHE  66           2HD      PHE  66 -10.144  -6.231  -1.050
  388    HE1  PHE  66           1HE      PHE  66 -10.235  -6.806  -5.934
  389    HE2  PHE  66           2HE      PHE  66 -10.289  -8.488  -2.017
  390    HZ   PHE  66           HZ       PHE  66 -10.334  -8.779  -4.463
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1 -29.396  -4.026  22.384
    2    HA2  GLY   1           1HA      GLY   1 -29.203  -3.837  20.099
    3    HA3  GLY   1           2HA      GLY   1 -30.542  -4.966  19.953
    4    H    SER   2           H        SER   2 -30.192  -2.788  18.237
    5    HA   SER   2           HA       SER   2 -32.246  -0.873  19.102
    6    HB3  SER   2           2HB      SER   2 -29.981  -0.054  18.285
    7    HG   SER   2           HG       SER   2 -29.958  -1.578  16.469
    8    H    SER   3           H        SER   3 -33.697  -0.074  17.304
    9    HA   SER   3           HA       SER   3 -34.624  -2.386  15.732
   10    HB3  SER   3           2HB      SER   3 -36.060  -1.127  17.602
   11    HG   SER   3           HG       SER   3 -36.965   0.199  15.292
   12    H    GLY   4           H        GLY   4 -33.609   0.924  15.609
   13    HA2  GLY   4           1HA      GLY   4 -32.808   2.024  13.702
   14    HA3  GLY   4           2HA      GLY   4 -33.557   0.789  12.703
   15    H    SER   5           H        SER   5 -33.678   3.579  12.212
   16    HA   SER   5           HA       SER   5 -36.574   4.017  12.521
   17    HB3  SER   5           2HB      SER   5 -36.205   6.397  12.778
   18    HG   SER   5           HG       SER   5 -35.134   4.582  14.495
   19    H    SER   6           H        SER   6 -35.893   2.695  10.361
   20    HA   SER   6           HA       SER   6 -35.120   4.359   8.159
   21    HB3  SER   6           2HB      SER   6 -36.043   1.525   8.468
   22    HG   SER   6           HG       SER   6 -37.074   1.905   6.612
   23    H    GLY   7           H        GLY   7 -36.395   5.142   6.483
   24    HA2  GLY   7           1HA      GLY   7 -39.156   4.681   6.192
   25    HA3  GLY   7           2HA      GLY   7 -38.929   6.126   7.166
   26    H    PHE   8           H        PHE   8 -36.426   6.810   5.745
   27    HA   PHE   8           HA       PHE   8 -37.304   7.331   3.023
   28    HB3  PHE   8           2HB      PHE   8 -37.063   9.739   3.185
   29    HD1  PHE   8           2HD      PHE   8 -38.292   8.829   6.549
   30    HD2  PHE   8           1HD      PHE   8 -39.321   9.827   2.541
   31    HE1  PHE   8           2HE      PHE   8 -40.651   9.046   7.212
   32    HE2  PHE   8           1HE      PHE   8 -41.682  10.046   3.198
   33    HZ   PHE   8           HZ       PHE   8 -42.350   9.655   5.535
   34    H    VAL   9           H        VAL   9 -35.490   5.940   2.616
   35    HA   VAL   9           HA       VAL   9 -32.884   6.297   3.453
   36    HB   VAL   9           HB       VAL   9 -33.816   4.415   2.017
   37   HG11  VAL   9          1HG1      VAL   9 -34.702   5.958   0.256
   38   HG12  VAL   9          2HG1      VAL   9 -33.034   6.234  -0.253
   39   HG13  VAL   9          3HG1      VAL   9 -33.734   4.618  -0.357
   40   HG21  VAL   9          3HG2      VAL   9 -31.189   5.530   1.058
   41   HG22  VAL   9          1HG2      VAL   9 -31.401   4.782   2.640
   42   HG23  VAL   9          2HG2      VAL   9 -31.672   3.838   1.175
   43    H    LYS  10           H        LYS  10 -31.161   7.525   2.822
   44    HA   LYS  10           HA       LYS  10 -31.497   9.416   0.619
   45    HB3  LYS  10           2HB      LYS  10 -30.556  10.337   3.336
   46    HG3  LYS  10           2HG      LYS  10 -31.738  12.381   1.759
   47    HD3  LYS  10           2HD      LYS  10 -28.985  11.803   2.818
   48    HE3  LYS  10           2HE      LYS  10 -29.707  13.676   0.756
   49    HZ1  LYS  10           3HZ      LYS  10 -30.041  15.408   2.187
   50    HZ2  LYS  10           1HZ      LYS  10 -28.362  15.505   2.006
   51    HZ3  LYS  10           2HZ      LYS  10 -29.024  14.784   3.385
   52    H    THR  11           H        THR  11 -29.791   9.157  -0.646
   53    HA   THR  11           HA       THR  11 -27.564   7.690  -0.291
   54    HB   THR  11           HB       THR  11 -27.452   8.441  -2.408
   55    HG1  THR  11           1HG      THR  11 -25.941  10.165  -2.651
   56   HG21  THR  11          3HG2      THR  11 -28.668  10.989  -1.365
   57   HG22  THR  11          1HG2      THR  11 -29.405   9.769  -2.402
   58   HG23  THR  11          2HG2      THR  11 -28.134  10.814  -3.037
   59    H    VAL  12           H        VAL  12 -25.298   8.233   0.111
   60    HA   VAL  12           HA       VAL  12 -24.994  10.354   2.136
   61    HB   VAL  12           HB       VAL  12 -23.606   7.671   2.129
   62   HG11  VAL  12          1HG1      VAL  12 -22.078   8.946   3.224
   63   HG12  VAL  12          2HG1      VAL  12 -23.267  10.158   3.704
   64   HG13  VAL  12          3HG1      VAL  12 -23.165   8.628   4.577
   65   HG21  VAL  12          3HG2      VAL  12 -25.683   8.690   4.060
   66   HG22  VAL  12          1HG2      VAL  12 -26.039   7.615   2.708
   67   HG23  VAL  12          2HG2      VAL  12 -24.968   7.079   4.002
   68    H    GLU  13           H        GLU  13 -24.432  11.457  -0.022
   69    HA   GLU  13           HA       GLU  13 -22.152  10.904  -1.487
   70    HB3  GLU  13           2HB      GLU  13 -22.150  13.249  -2.132
   71    HG3  GLU  13           2HG      GLU  13 -24.851  12.007  -1.805
   72    H    ASP  14           H        ASP  14 -20.319  10.316  -0.455
   73    HA   ASP  14           HA       ASP  14 -18.652  12.302   0.651
   74    HB3  ASP  14           2HB      ASP  14 -18.678  10.654   2.899
   75    H    LYS  15           H        LYS  15 -16.541  11.485   1.235
   76    HA   LYS  15           HA       LYS  15 -15.943   8.999  -0.180
   77    HB3  LYS  15           2HB      LYS  15 -13.899   9.870  -0.651
   78    HG3  LYS  15           2HG      LYS  15 -15.687  11.758  -0.986
   79    HD3  LYS  15           2HD      LYS  15 -14.613  12.435   1.552
   80    HE3  LYS  15           2HE      LYS  15 -12.831  13.526   0.086
   81    HZ1  LYS  15           3HZ      LYS  15 -14.910  14.451  -1.339
   82    HZ2  LYS  15           1HZ      LYS  15 -13.368  15.146  -1.339
   83    HZ3  LYS  15           2HZ      LYS  15 -14.581  15.781  -0.346
   84    H    TYR  16           H        TYR  16 -13.622   8.189   0.976
   85    HA   TYR  16           HA       TYR  16 -14.574   7.175   3.552
   86    HB3  TYR  16           2HB      TYR  16 -12.825   5.456   3.287
   87    HD1  TYR  16           1HD      TYR  16 -15.749   6.587   1.892
   88    HD2  TYR  16           2HD      TYR  16 -12.757   3.634   1.237
   89    HE1  TYR  16           1HE      TYR  16 -17.367   5.238   0.622
   90    HE2  TYR  16           2HE      TYR  16 -14.366   2.277  -0.037
   91    HH   TYR  16           HH       TYR  16 -16.418   2.495  -1.231
   92    H    LYS  17           H        LYS  17 -12.403   6.512   4.912
   93    HA   LYS  17           HA       LYS  17 -10.491   8.683   4.997
   94    HB3  LYS  17           2HB      LYS  17 -12.671   8.362   7.016
   95    HG3  LYS  17           2HG      LYS  17 -10.879  10.062   8.235
   96    HD3  LYS  17           2HD      LYS  17 -10.543   7.826   9.681
   97    HE3  LYS  17           2HE      LYS  17 -12.480   9.957   9.566
   98    HZ1  LYS  17           3HZ      LYS  17 -14.190   8.892  10.896
   99    HZ2  LYS  17           1HZ      LYS  17 -13.434   7.388  10.714
  100    HZ3  LYS  17           2HZ      LYS  17 -14.095   8.171   9.368
  101    H    CYS  18           H        CYS  18  -8.593   8.108   5.968
  102    HA   CYS  18           HA       CYS  18  -8.018   5.380   6.294
  103    HB3  CYS  18           2HB      CYS  18  -6.522   7.874   7.094
  104    H    GLU  19           H        GLU  19  -7.815   4.071   8.060
  105    HA   GLU  19           HA       GLU  19  -9.225   4.912  10.443
  106    HB3  GLU  19           2HB      GLU  19  -8.562   2.452  11.101
  107    HG3  GLU  19           2HG      GLU  19 -10.510   1.598  10.167
  108    H    LYS  20           H        LYS  20  -6.599   6.085   9.815
  109    HA   LYS  20           HA       LYS  20  -5.288   5.447  12.362
  110    HB3  LYS  20           2HB      LYS  20  -3.320   6.189  10.400
  111    HG3  LYS  20           2HG      LYS  20  -3.781   3.769  12.110
  112    HD3  LYS  20           2HD      LYS  20  -1.420   4.275  10.299
  113    HE3  LYS  20           2HE      LYS  20  -0.644   2.117  11.024
  114    HZ1  LYS  20           3HZ      LYS  20  -0.144   2.570  13.300
  115    HZ2  LYS  20           1HZ      LYS  20  -1.448   3.638  13.443
  116    HZ3  LYS  20           2HZ      LYS  20  -0.128   4.041  12.465
  117    H    CYS  21           H        CYS  21  -4.743   7.647   9.606
  118    HA   CYS  21           HA       CYS  21  -4.395   9.851  11.493
  119    HB3  CYS  21           2HB      CYS  21  -2.651   9.719   9.873
  120    H    HIS  22           H        HIS  22  -6.920   8.469   9.984
  121    HA   HIS  22           HA       HIS  22  -9.036   9.122   9.467
  122    HB3  HIS  22           2HB      HIS  22  -9.905  10.485  11.022
  123    HD2  HIS  22           2HD      HIS  22  -7.793   8.618  12.465
  124    HE1  HIS  22           1HE      HIS  22  -6.406  12.110  14.434
  125    HE2  HIS  22           2HE      HIS  22  -6.370   9.592  14.392
  126    H    LEU  23           H        LEU  23  -6.787   9.725   7.657
  127    HA   LEU  23           HA       LEU  23  -7.301  12.236   6.400
  128    HB3  LEU  23           2HB      LEU  23  -6.061  10.718   4.492
  129    HG   LEU  23           HG       LEU  23  -4.880  12.332   6.721
  130   HD11  LEU  23          1HD1      LEU  23  -2.866  11.439   6.489
  131   HD12  LEU  23          2HD1      LEU  23  -2.913  11.739   4.752
  132   HD13  LEU  23          3HD1      LEU  23  -3.537  10.223   5.401
  133   HD21  LEU  23          3HD2      LEU  23  -4.414  13.897   5.037
  134   HD22  LEU  23          1HD2      LEU  23  -6.035  13.309   4.670
  135   HD23  LEU  23          2HD2      LEU  23  -4.653  12.714   3.750
  136    H    VAL  24           H        VAL  24  -9.008  12.715   5.204
  137    HA   VAL  24           HA       VAL  24 -10.874  10.775   4.306
  138    HB   VAL  24           HB       VAL  24 -10.573  13.724   3.836
  139   HG11  VAL  24          1HG1      VAL  24 -12.939  13.392   2.747
  140   HG12  VAL  24          2HG1      VAL  24 -11.471  13.242   1.779
  141   HG13  VAL  24          3HG1      VAL  24 -12.298  11.795   2.358
  142   HG21  VAL  24          3HG2      VAL  24 -12.267  13.963   5.340
  143   HG22  VAL  24          1HG2      VAL  24 -13.024  12.433   4.897
  144   HG23  VAL  24          2HG2      VAL  24 -11.593  12.443   5.928
  145    H    LEU  25           H        LEU  25 -10.523   9.416   2.683
  146    HA   LEU  25           HA       LEU  25  -9.076  10.404   0.313
  147    HB3  LEU  25           2HB      LEU  25  -7.819   8.570   0.294
  148    HG   LEU  25           HG       LEU  25  -9.010   8.258   3.015
  149   HD11  LEU  25          1HD1      LEU  25  -6.845   6.425   2.611
  150   HD12  LEU  25          2HD1      LEU  25  -8.161   6.060   1.497
  151   HD13  LEU  25          3HD1      LEU  25  -8.467   6.121   3.232
  152   HD21  LEU  25          3HD2      LEU  25  -6.353   8.964   1.832
  153   HD22  LEU  25          1HD2      LEU  25  -6.475   8.396   3.497
  154   HD23  LEU  25          2HD2      LEU  25  -7.330   9.857   2.999
  155    H    CYS  26           H        CYS  26  -9.618   8.587  -1.545
  156    HA   CYS  26           HA       CYS  26 -12.561   8.527  -1.722
  157    HB3  CYS  26           2HB      CYS  26 -12.083  10.106  -3.329
  158    H    SER  27           H        SER  27  -9.741   6.726  -1.666
  159    HA   SER  27           HA       SER  27 -11.108   4.280  -2.139
  160    HB3  SER  27           2HB      SER  27 -10.833   4.954  -4.485
  161    HG   SER  27           HG       SER  27  -9.083   6.114  -4.779
  162    HA   PRO  28           HA       PRO  28  -7.390   4.047   0.571
  163    HB3  PRO  28           2HB      PRO  28  -8.712   4.303   2.433
  164    HG3  PRO  28           2HG      PRO  28 -10.974   3.763   2.381
  165    HD3  PRO  28           2HD      PRO  28 -10.838   5.086   0.498
  166    H    LYS  29           H        LYS  29  -6.980   1.727   1.939
  167    HA   LYS  29           HA       LYS  29  -6.918  -0.302  -0.199
  168    HB3  LYS  29           2HB      LYS  29  -4.841  -1.124   0.755
  169    HG3  LYS  29           2HG      LYS  29  -3.340   0.769   0.442
  170    HD3  LYS  29           2HD      LYS  29  -5.670   0.680  -1.472
  171    HE3  LYS  29           2HE      LYS  29  -2.924   1.556  -2.241
  172    HZ1  LYS  29           3HZ      LYS  29  -5.655   1.846  -3.297
  173    HZ2  LYS  29           1HZ      LYS  29  -4.251   1.327  -4.086
  174    HZ3  LYS  29           2HZ      LYS  29  -4.466   2.968  -3.735
  175    H    GLN  30           H        GLN  30  -9.182  -0.417   1.099
  176    HA   GLN  30           HA       GLN  30  -9.649  -1.475   3.493
  177    HB3  GLN  30           2HB      GLN  30 -10.904  -3.148   1.436
  178    HG3  GLN  30           2HG      GLN  30 -11.949  -1.186   3.459
  179   HE21  GLN  30          1HE2      GLN  30 -14.239  -2.799   3.889
  180   HE22  GLN  30          2HE2      GLN  30 -15.307  -2.561   2.552
  181    H    THR  31           H        THR  31  -8.911  -3.081   4.706
  182    HA   THR  31           HA       THR  31  -7.138  -5.058   3.574
  183    HB   THR  31           HB       THR  31  -6.565  -5.660   5.775
  184    HG1  THR  31           1HG      THR  31  -8.867  -4.290   6.744
  185   HG21  THR  31          3HG2      THR  31  -5.668  -3.708   6.461
  186   HG22  THR  31          1HG2      THR  31  -7.232  -2.898   6.534
  187   HG23  THR  31          2HG2      THR  31  -6.394  -3.062   4.990
  188    H    GLU  32           H        GLU  32  -7.809  -7.101   5.560
  189    HA   GLU  32           HA       GLU  32 -10.049  -8.316   4.113
  190    HB3  GLU  32           2HB      GLU  32  -8.547  -9.960   6.043
  191    HG3  GLU  32           2HG      GLU  32  -8.289 -11.104   3.572
  192    H    CYS  33           H        CYS  33  -9.971  -6.376   6.550
  193    HA   CYS  33           HA       CYS  33 -11.729  -7.977   8.292
  194    HB3  CYS  33           2HB      CYS  33  -9.597  -7.017   9.288
  195    H    GLY  34           H        GLY  34 -11.396  -5.040   6.435
  196    HA2  GLY  34           1HA      GLY  34 -13.649  -4.361   5.495
  197    HA3  GLY  34           2HA      GLY  34 -14.154  -4.291   7.177
  198    H    HIS  35           H        HIS  35 -11.941  -3.080   8.331
  199    HA   HIS  35           HA       HIS  35 -12.465  -0.393   8.035
  200    HB3  HIS  35           2HB      HIS  35 -10.176  -0.048   9.082
  201    HD2  HIS  35           2HD      HIS  35 -12.215   0.786  10.913
  202    HE1  HIS  35           1HE      HIS  35 -12.380  -2.962  12.892
  203    HE2  HIS  35           2HE      HIS  35 -13.126  -0.557  12.926
  204    H    ARG  36           H        ARG  36 -10.404   1.156   7.530
  205    HA   ARG  36           HA       ARG  36  -9.207   0.419   4.975
  206    HB3  ARG  36           2HB      ARG  36  -9.937   2.585   3.963
  207    HG3  ARG  36           2HG      ARG  36 -11.859   0.432   4.636
  208    HD3  ARG  36           2HD      ARG  36 -12.697   2.868   3.083
  209    HE   ARG  36           HE       ARG  36 -13.874   0.362   3.308
  210   HH11  ARG  36          1HH1      ARG  36 -14.749   3.697   3.794
  211   HH12  ARG  36          2HH1      ARG  36 -16.422   3.448   3.419
  212   HH21  ARG  36          1HH2      ARG  36 -16.073   0.022   2.811
  213   HH22  ARG  36          2HH2      ARG  36 -17.174   1.357   2.861
  214    H    PHE  37           H        PHE  37  -7.480   1.851   4.322
  215    HA   PHE  37           HA       PHE  37  -6.540   3.774   6.293
  216    HB3  PHE  37           2HB      PHE  37  -4.224   2.652   6.175
  217    HD1  PHE  37           2HD      PHE  37  -6.727   0.098   7.049
  218    HD2  PHE  37           1HD      PHE  37  -4.273   3.276   8.462
  219    HE1  PHE  37           2HE      PHE  37  -7.215  -0.561   9.369
  220    HE2  PHE  37           1HE      PHE  37  -4.757   2.622  10.784
  221    HZ   PHE  37           HZ       PHE  37  -6.232   0.702  11.240
  222    H    CYS  38           H        CYS  38  -4.584   4.949   5.509
  223    HA   CYS  38           HA       CYS  38  -4.905   5.527   2.679
  224    HB3  CYS  38           2HB      CYS  38  -4.794   7.338   4.412
  225    H    GLU  39           H        GLU  39  -2.840   6.041   1.434
  226    HA   GLU  39           HA       GLU  39  -1.389   3.756   0.966
  227    HB3  GLU  39           2HB      GLU  39   0.396   5.572   0.131
  228    HG3  GLU  39           2HG      GLU  39  -2.182   5.630  -1.344
  229    H    SER  40           H        SER  40  -0.111   6.629   2.656
  230    HA   SER  40           HA       SER  40   2.291   5.610   3.497
  231    HB3  SER  40           2HB      SER  40   1.936   7.172   5.541
  232    HG   SER  40           HG       SER  40   2.556   8.798   4.281
  233    H    CYS  41           H        CYS  41  -0.208   6.031   5.959
  234    HA   CYS  41           HA       CYS  41   0.613   4.368   7.869
  235    HB3  CYS  41           2HB      CYS  41  -1.792   3.852   8.386
  236    H    MET  42           H        MET  42  -1.307   3.248   5.087
  237    HA   MET  42           HA       MET  42  -1.456   0.564   5.677
  238    HB3  MET  42           2HB      MET  42  -1.173   1.949   3.012
  239    HG3  MET  42           2HG      MET  42  -0.651  -0.658   3.205
  240    HE1  MET  42           3HE      MET  42  -3.380   0.144   5.147
  241    HE2  MET  42           1HE      MET  42  -4.064  -1.473   5.315
  242    HE3  MET  42           2HE      MET  42  -2.329  -1.225   5.511
  243    H    ALA  43           H        ALA  43   1.120   2.216   3.858
  244    HA   ALA  43           HA       ALA  43   2.717  -0.078   3.472
  245    HB1  ALA  43           3HB      ALA  43   4.223   2.405   3.637
  246    HB2  ALA  43           1HB      ALA  43   4.001   1.301   2.278
  247    HB3  ALA  43           2HB      ALA  43   2.791   2.540   2.617
  248    H    ALA  44           H        ALA  44   2.294   2.053   6.165
  249    HA   ALA  44           HA       ALA  44   4.753   1.436   7.487
  250    HB1  ALA  44           3HB      ALA  44   2.199   2.569   8.622
  251    HB2  ALA  44           1HB      ALA  44   3.778   2.566   9.409
  252    HB3  ALA  44           2HB      ALA  44   3.527   3.506   7.937
  253    H    LEU  45           H        LEU  45   1.376   0.432   8.032
  254    HA   LEU  45           HA       LEU  45   1.862  -1.352  10.119
  255    HB3  LEU  45           2HB      LEU  45  -0.282  -2.381   9.513
  256    HG   LEU  45           HG       LEU  45  -0.387   0.623   9.253
  257   HD11  LEU  45          1HD1      LEU  45  -2.666   0.556   9.424
  258   HD12  LEU  45          2HD1      LEU  45  -2.674  -1.028  10.199
  259   HD13  LEU  45          3HD1      LEU  45  -2.384  -0.897   8.464
  260   HD21  LEU  45          3HD2      LEU  45   0.359   0.424  11.374
  261   HD22  LEU  45          1HD2      LEU  45  -0.161  -1.256  11.516
  262   HD23  LEU  45          2HD2      LEU  45  -1.333   0.050  11.704
  263    H    LEU  46           H        LEU  46   1.504  -2.067   6.643
  264    HA   LEU  46           HA       LEU  46   1.977  -4.781   6.706
  265    HB3  LEU  46           2HB      LEU  46   2.725  -4.574   4.389
  266    HG   LEU  46           HG       LEU  46   0.399  -2.795   5.078
  267   HD11  LEU  46          1HD1      LEU  46   1.141  -3.693   2.306
  268   HD12  LEU  46          2HD1      LEU  46   1.561  -2.105   2.946
  269   HD13  LEU  46          3HD1      LEU  46  -0.131  -2.571   2.788
  270   HD21  LEU  46          3HD2      LEU  46   0.723  -5.561   4.972
  271   HD22  LEU  46          1HD2      LEU  46  -0.110  -5.138   3.475
  272   HD23  LEU  46          2HD2      LEU  46  -0.797  -4.668   5.030
  273    H    SER  47           H        SER  47   4.251  -2.148   6.984
  274    HA   SER  47           HA       SER  47   6.550  -3.905   6.751
  275    HB3  SER  47           2HB      SER  47   6.484  -0.974   7.505
  276    HG   SER  47           HG       SER  47   8.521  -1.457   7.788
  277    H    SER  48           H        SER  48   4.518  -4.116   8.961
  278    HA   SER  48           HA       SER  48   6.283  -3.654  11.268
  279    HB3  SER  48           2HB      SER  48   3.296  -4.153  11.216
  280    HG   SER  48           HG       SER  48   3.926  -3.069  13.451
  281    H    SER  49           H        SER  49   5.951  -5.976   9.195
  282    HA   SER  49           HA       SER  49   6.472  -8.201   9.260
  283    HB3  SER  49           2HB      SER  49   6.347  -8.296  12.248
  284    HG   SER  49           HG       SER  49   8.081  -9.681  11.920
  285    H    SER  50           H        SER  50   4.363  -7.568  12.070
  286    HA   SER  50           HA       SER  50   2.495  -9.575  10.993
  287    HB3  SER  50           2HB      SER  50   2.201  -8.788  13.822
  288    HG   SER  50           HG       SER  50   1.581 -10.831  13.965
  289    HA   PRO  51           HA       PRO  51   0.429  -5.387  10.827
  290    HB3  PRO  51           2HB      PRO  51   1.193  -4.960   8.703
  291    HG3  PRO  51           2HG      PRO  51   1.855  -6.688   7.295
  292    HD3  PRO  51           2HD      PRO  51   3.047  -7.241   9.189
  293    H    LYS  52           H        LYS  52  -1.529  -5.411  11.716
  294    HA   LYS  52           HA       LYS  52  -3.429  -7.508  10.895
  295    HB3  LYS  52           2HB      LYS  52  -4.336  -7.536  13.063
  296    HG3  LYS  52           2HG      LYS  52  -1.370  -7.321  13.104
  297    HD3  LYS  52           2HD      LYS  52  -2.904  -7.954  15.602
  298    HE3  LYS  52           2HE      LYS  52  -0.295  -6.716  15.830
  299    HZ1  LYS  52           3HZ      LYS  52  -0.675  -9.473  16.622
  300    HZ2  LYS  52           1HZ      LYS  52  -1.778  -8.384  17.300
  301    HZ3  LYS  52           2HZ      LYS  52  -0.119  -8.153  17.523
  302    H    CYS  53           H        CYS  53  -3.706  -4.356  12.535
  303    HA   CYS  53           HA       CYS  53  -4.745  -2.751  10.655
  304    HB3  CYS  53           2HB      CYS  53  -6.786  -4.781  11.483
  305    H    THR  54           H        THR  54  -4.073  -1.143  11.991
  306    HA   THR  54           HA       THR  54  -4.176  -0.737  14.615
  307    HB   THR  54           HB       THR  54  -4.171   1.017  12.355
  308    HG1  THR  54           1HG      THR  54  -2.552   0.749  14.035
  309   HG21  THR  54          3HG2      THR  54  -6.358   1.787  13.013
  310   HG22  THR  54          1HG2      THR  54  -5.172   3.014  13.455
  311   HG23  THR  54          2HG2      THR  54  -5.842   1.949  14.691
  312    H    ALA  55           H        ALA  55  -6.981  -0.507  12.489
  313    HA   ALA  55           HA       ALA  55  -8.840   0.558  14.257
  314    HB1  ALA  55           3HB      ALA  55 -10.295   0.196  12.602
  315    HB2  ALA  55           1HB      ALA  55  -8.907  -0.391  11.686
  316    HB3  ALA  55           2HB      ALA  55  -9.943  -1.530  12.548
  317    H    CYS  56           H        CYS  56  -8.912  -2.882  13.370
  318    HA   CYS  56           HA       CYS  56  -9.571  -3.497  16.175
  319    HB3  CYS  56           2HB      CYS  56 -11.444  -3.962  14.713
  320    H    GLN  57           H        GLN  57  -7.536  -4.241  13.466
  321    HA   GLN  57           HA       GLN  57  -5.475  -5.270  13.478
  322    HB3  GLN  57           2HB      GLN  57  -4.484  -6.061  15.435
  323    HG3  GLN  57           2HG      GLN  57  -6.100  -4.610  17.243
  324   HE21  GLN  57          1HE2      GLN  57  -4.870  -2.075  16.734
  325   HE22  GLN  57          2HE2      GLN  57  -3.180  -2.260  17.045
  326    H    GLU  58           H        GLU  58  -6.185  -6.588  11.807
  327    HA   GLU  58           HA       GLU  58  -6.931  -9.315  12.625
  328    HB3  GLU  58           2HB      GLU  58  -7.946  -8.896  10.031
  329    HG3  GLU  58           2HG      GLU  58 -10.017  -8.626  11.981
  330    H    SER  59           H        SER  59  -6.070  -7.645   9.594
  331    HA   SER  59           HA       SER  59  -3.512  -8.755   9.335
  332    HB3  SER  59           2HB      SER  59  -4.712 -10.195   7.226
  333    HG   SER  59           HG       SER  59  -4.071 -11.923   9.011
  334    H    ILE  60           H        ILE  60  -2.518  -7.362   8.049
  335    HA   ILE  60           HA       ILE  60  -4.062  -6.113   5.870
  336    HB   ILE  60           HB       ILE  60  -1.618  -4.778   6.907
  337   HG13  ILE  60          2HG1      ILE  60  -2.952  -5.509   8.922
  338   HG21  ILE  60          1HG2      ILE  60  -3.793  -3.023   6.581
  339   HG22  ILE  60          2HG2      ILE  60  -2.394  -3.223   5.528
  340   HG23  ILE  60          3HG2      ILE  60  -3.858  -4.164   5.239
  341   HD11  ILE  60          3HD1      ILE  60  -3.397  -2.685   9.172
  342   HD12  ILE  60          1HD1      ILE  60  -2.222  -3.715   9.988
  343   HD13  ILE  60          2HD1      ILE  60  -1.835  -3.007   8.420
  344    H    VAL  61           H        VAL  61  -3.442  -6.725   3.915
  345    HA   VAL  61           HA       VAL  61  -0.596  -7.074   3.348
  346    HB   VAL  61           HB       VAL  61  -2.697  -9.151   2.721
  347   HG11  VAL  61          1HG1      VAL  61  -0.178  -8.509   1.405
  348   HG12  VAL  61          2HG1      VAL  61  -0.269 -10.185   1.951
  349   HG13  VAL  61          3HG1      VAL  61  -1.505  -9.540   0.871
  350   HG21  VAL  61          3HG2      VAL  61  -0.488  -8.937   4.679
  351   HG22  VAL  61          1HG2      VAL  61  -2.038  -9.769   4.801
  352   HG23  VAL  61          2HG2      VAL  61  -0.713 -10.503   3.899
  353    H    LYS  62           H        LYS  62  -0.008  -6.295   1.406
  354    HA   LYS  62           HA       LYS  62  -1.706  -4.664  -0.084
  355    HB3  LYS  62           2HB      LYS  62   0.646  -4.309  -0.226
  356    HG3  LYS  62           2HG      LYS  62   1.251  -6.718  -1.817
  357    HD3  LYS  62           2HD      LYS  62   2.616  -4.735  -0.139
  358    HE3  LYS  62           2HE      LYS  62   3.720  -7.534  -0.244
  359    HZ1  LYS  62           3HZ      LYS  62   4.520  -5.155   1.344
  360    HZ2  LYS  62           1HZ      LYS  62   5.326  -5.725  -0.030
  361    HZ3  LYS  62           2HZ      LYS  62   5.272  -6.670   1.372
  362    H    ASP  63           H        ASP  63  -0.563  -7.957  -0.793
  363    HA   ASP  63           HA       ASP  63  -1.818  -8.311  -3.244
  364    HB3  ASP  63           2HB      ASP  63  -1.964 -10.805  -2.018
  365    H    LYS  64           H        LYS  64  -3.080  -8.763   0.023
  366    HA   LYS  64           HA       LYS  64  -5.666  -9.617  -0.990
  367    HB3  LYS  64           2HB      LYS  64  -6.249 -10.073   1.257
  368    HG3  LYS  64           2HG      LYS  64  -3.739 -10.802   2.156
  369    HD3  LYS  64           2HD      LYS  64  -5.672 -12.268   0.361
  370    HE3  LYS  64           2HE      LYS  64  -3.238 -13.161   1.856
  371    HZ1  LYS  64           3HZ      LYS  64  -4.419 -15.464   1.220
  372    HZ2  LYS  64           1HZ      LYS  64  -5.771 -14.558   1.681
  373    HZ3  LYS  64           2HZ      LYS  64  -4.489 -14.771   2.762
  374    H    VAL  65           H        VAL  65  -4.144  -6.715  -0.577
  375    HA   VAL  65           HA       VAL  65  -6.507  -5.247   0.306
  376    HB   VAL  65           HB       VAL  65  -3.664  -4.739   0.314
  377   HG11  VAL  65          1HG1      VAL  65  -3.699  -2.385  -0.297
  378   HG12  VAL  65          2HG1      VAL  65  -4.165  -3.387  -1.672
  379   HG13  VAL  65          3HG1      VAL  65  -5.395  -2.513  -0.759
  380   HG21  VAL  65          3HG2      VAL  65  -6.117  -3.771   1.691
  381   HG22  VAL  65          1HG2      VAL  65  -4.649  -4.483   2.361
  382   HG23  VAL  65          2HG2      VAL  65  -4.648  -2.804   1.822
  383    H    PHE  66           H        PHE  66  -7.431  -3.548  -0.931
  384    HA   PHE  66           HA       PHE  66  -6.809  -3.568  -3.798
  385    HB3  PHE  66           2HB      PHE  66  -8.805  -4.387  -4.401
  386    HD1  PHE  66           1HD      PHE  66 -10.087  -3.844  -0.989
  387    HD2  PHE  66           2HD      PHE  66  -8.497  -6.646  -3.770
  388    HE1  PHE  66           1HE      PHE  66 -10.714  -5.687   0.515
  389    HE2  PHE  66           2HE      PHE  66  -9.121  -8.494  -2.271
  390    HZ   PHE  66           HZ       PHE  66 -10.232  -8.016  -0.126
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1 -56.358  24.955   4.208
    2    HA2  GLY   1           1HA      GLY   1 -57.301  22.759   3.521
    3    HA3  GLY   1           2HA      GLY   1 -55.886  23.185   2.570
    4    H    SER   2           H        SER   2 -55.731  20.855   2.225
    5    HA   SER   2           HA       SER   2 -54.371  19.530   4.478
    6    HB3  SER   2           2HB      SER   2 -55.533  17.591   4.173
    7    HG   SER   2           HG       SER   2 -57.120  19.350   4.313
    8    H    SER   3           H        SER   3 -52.622  18.163   3.965
    9    HA   SER   3           HA       SER   3 -51.692  18.032   1.220
   10    HB3  SER   3           2HB      SER   3 -49.629  19.049   3.095
   11    HG   SER   3           HG       SER   3 -48.897  19.984   1.236
   12    H    GLY   4           H        GLY   4 -49.455  16.878   1.203
   13    HA2  GLY   4           1HA      GLY   4 -49.544  14.737   3.239
   14    HA3  GLY   4           2HA      GLY   4 -49.179  14.440   1.546
   15    H    SER   5           H        SER   5 -47.448  13.501   3.387
   16    HA   SER   5           HA       SER   5 -45.378  15.278   4.121
   17    HB3  SER   5           2HB      SER   5 -45.104  12.302   3.654
   18    HG   SER   5           HG       SER   5 -43.657  14.257   5.045
   19    H    SER   6           H        SER   6 -44.727  16.515   2.382
   20    HA   SER   6           HA       SER   6 -43.389  15.058   0.196
   21    HB3  SER   6           2HB      SER   6 -45.074  17.512   0.218
   22    HG   SER   6           HG       SER   6 -42.864  17.130  -1.522
   23    H    GLY   7           H        GLY   7 -41.456  14.934   1.459
   24    HA2  GLY   7           1HA      GLY   7 -40.158  17.411   2.243
   25    HA3  GLY   7           2HA      GLY   7 -39.536  15.784   2.480
   26    H    PHE   8           H        PHE   8 -37.838  15.245   1.292
   27    HA   PHE   8           HA       PHE   8 -37.584  16.228  -1.434
   28    HB3  PHE   8           2HB      PHE   8 -35.005  16.581  -0.432
   29    HD1  PHE   8           1HD      PHE   8 -36.183  17.185  -2.936
   30    HD2  PHE   8           2HD      PHE   8 -36.085  19.573   0.587
   31    HE1  PHE   8           1HE      PHE   8 -36.408  19.214  -4.309
   32    HE2  PHE   8           2HE      PHE   8 -36.311  21.605  -0.781
   33    HZ   PHE   8           HZ       PHE   8 -36.473  21.428  -3.231
   34    H    VAL   9           H        VAL   9 -36.161  15.005  -2.722
   35    HA   VAL   9           HA       VAL   9 -34.881  12.680  -1.500
   36    HB   VAL   9           HB       VAL   9 -37.124  11.899  -2.121
   37   HG11  VAL   9          1HG1      VAL   9 -36.664  12.064  -5.010
   38   HG12  VAL   9          2HG1      VAL   9 -38.136  12.334  -4.077
   39   HG13  VAL   9          3HG1      VAL   9 -36.937  13.619  -4.226
   40   HG21  VAL   9          3HG2      VAL   9 -34.829  10.615  -2.526
   41   HG22  VAL   9          1HG2      VAL   9 -36.390   9.906  -2.936
   42   HG23  VAL   9          2HG2      VAL   9 -35.404  10.654  -4.192
   43    H    LYS  10           H        LYS  10 -32.853  13.298  -2.076
   44    HA   LYS  10           HA       LYS  10 -32.317  13.495  -4.964
   45    HB3  LYS  10           2HB      LYS  10 -30.544  15.116  -4.497
   46    HG3  LYS  10           2HG      LYS  10 -32.084  16.899  -3.257
   47    HD3  LYS  10           2HD      LYS  10 -32.276  15.806  -6.045
   48    HE3  LYS  10           2HE      LYS  10 -34.472  16.782  -5.426
   49    HZ1  LYS  10           3HZ      LYS  10 -34.421  19.299  -5.245
   50    HZ2  LYS  10           1HZ      LYS  10 -32.792  19.137  -4.815
   51    HZ3  LYS  10           2HZ      LYS  10 -33.994  18.425  -3.861
   52    H    THR  11           H        THR  11 -29.612  13.504  -4.977
   53    HA   THR  11           HA       THR  11 -28.961  10.887  -3.796
   54    HB   THR  11           HB       THR  11 -27.147  11.875  -5.876
   55    HG1  THR  11           1HG      THR  11 -29.431  10.928  -7.057
   56   HG21  THR  11          3HG2      THR  11 -27.143   9.581  -4.951
   57   HG22  THR  11          1HG2      THR  11 -27.379   9.605  -6.698
   58   HG23  THR  11          2HG2      THR  11 -28.752   9.329  -5.625
   59    H    VAL  12           H        VAL  12 -27.096  10.599  -2.633
   60    HA   VAL  12           HA       VAL  12 -25.384  12.953  -2.210
   61    HB   VAL  12           HB       VAL  12 -26.910  12.826  -0.310
   62   HG11  VAL  12          1HG1      VAL  12 -27.006  10.192  -0.656
   63   HG12  VAL  12          2HG1      VAL  12 -25.786  10.245   0.618
   64   HG13  VAL  12          3HG1      VAL  12 -27.379  10.953   0.890
   65   HG21  VAL  12          3HG2      VAL  12 -24.554  11.825   1.070
   66   HG22  VAL  12          1HG2      VAL  12 -24.159  12.983  -0.201
   67   HG23  VAL  12          2HG2      VAL  12 -25.277  13.434   1.087
   68    H    GLU  13           H        GLU  13 -23.330  12.495  -2.606
   69    HA   GLU  13           HA       GLU  13 -22.442   9.818  -3.044
   70    HB3  GLU  13           2HB      GLU  13 -20.335  10.778  -3.633
   71    HG3  GLU  13           2HG      GLU  13 -22.482  12.750  -4.380
   72    H    ASP  14           H        ASP  14 -19.855   9.836  -2.014
   73    HA   ASP  14           HA       ASP  14 -19.953  10.241   0.838
   74    HB3  ASP  14           2HB      ASP  14 -20.859   8.217   1.268
   75    H    LYS  15           H        LYS  15 -17.896   8.699   1.681
   76    HA   LYS  15           HA       LYS  15 -15.672   8.636  -0.079
   77    HB3  LYS  15           2HB      LYS  15 -15.490  10.955   0.006
   78    HG3  LYS  15           2HG      LYS  15 -15.822  11.110   2.974
   79    HD3  LYS  15           2HD      LYS  15 -16.756  13.197   1.097
   80    HE3  LYS  15           2HE      LYS  15 -15.479  14.593   2.804
   81    HZ1  LYS  15           3HZ      LYS  15 -17.843  12.955   3.430
   82    HZ2  LYS  15           1HZ      LYS  15 -17.740  14.620   3.142
   83    HZ3  LYS  15           2HZ      LYS  15 -17.198  13.981   4.612
   84    H    TYR  16           H        TYR  16 -13.592   8.258   1.172
   85    HA   TYR  16           HA       TYR  16 -14.215   6.744   3.622
   86    HB3  TYR  16           2HB      TYR  16 -12.494   5.190   3.058
   87    HD1  TYR  16           2HD      TYR  16 -13.249   6.529  -0.307
   88    HD2  TYR  16           1HD      TYR  16 -14.241   3.639   2.654
   89    HE1  TYR  16           2HE      TYR  16 -14.666   5.353  -1.937
   90    HE2  TYR  16           1HE      TYR  16 -15.660   2.455   1.032
   91    HH   TYR  16           HH       TYR  16 -15.757   3.392  -2.351
   92    H    LYS  17           H        LYS  17 -12.230   6.446   5.052
   93    HA   LYS  17           HA       LYS  17 -10.344   8.652   4.997
   94    HB3  LYS  17           2HB      LYS  17 -12.537   8.393   7.013
   95    HG3  LYS  17           2HG      LYS  17 -10.821  10.246   8.115
   96    HD3  LYS  17           2HD      LYS  17 -10.410   8.127   9.714
   97    HE3  LYS  17           2HE      LYS  17 -12.476  10.146   9.420
   98    HZ1  LYS  17           3HZ      LYS  17 -13.617   7.766   9.668
   99    HZ2  LYS  17           1HZ      LYS  17 -14.242   9.167  10.383
  100    HZ3  LYS  17           2HZ      LYS  17 -13.311   8.092  11.299
  101    H    CYS  18           H        CYS  18  -8.449   8.203   6.045
  102    HA   CYS  18           HA       CYS  18  -7.829   5.505   6.573
  103    HB3  CYS  18           2HB      CYS  18  -6.347   8.060   7.209
  104    H    GLU  19           H        GLU  19  -7.627   4.354   8.440
  105    HA   GLU  19           HA       GLU  19  -9.018   5.395  10.754
  106    HB3  GLU  19           2HB      GLU  19  -8.189   2.954  11.551
  107    HG3  GLU  19           2HG      GLU  19 -10.269   2.062  10.942
  108    H    LYS  20           H        LYS  20  -6.340   6.435   9.952
  109    HA   LYS  20           HA       LYS  20  -5.012   6.022  12.544
  110    HB3  LYS  20           2HB      LYS  20  -3.119   6.657  10.450
  111    HG3  LYS  20           2HG      LYS  20  -3.418   4.465  12.467
  112    HD3  LYS  20           2HD      LYS  20  -1.149   4.728  10.500
  113    HE3  LYS  20           2HE      LYS  20  -0.123   3.042  11.600
  114    HZ1  LYS  20           3HZ      LYS  20  -0.607   3.047  14.003
  115    HZ2  LYS  20           1HZ      LYS  20  -1.981   3.992  13.712
  116    HZ3  LYS  20           2HZ      LYS  20  -0.443   4.606  13.366
  117    H    CYS  21           H        CYS  21  -4.682   8.060   9.631
  118    HA   CYS  21           HA       CYS  21  -4.313  10.384  11.380
  119    HB3  CYS  21           2HB      CYS  21  -2.547  10.193   9.799
  120    H    HIS  22           H        HIS  22  -6.810   8.865  10.008
  121    HA   HIS  22           HA       HIS  22  -8.931   9.440   9.419
  122    HB3  HIS  22           2HB      HIS  22  -9.807  10.884  10.890
  123    HD2  HIS  22           2HD      HIS  22  -7.608   9.258  12.466
  124    HE1  HIS  22           1HE      HIS  22  -6.308  12.975  14.042
  125    HE2  HIS  22           2HE      HIS  22  -6.183  10.468  14.253
  126    H    LEU  23           H        LEU  23  -6.640   9.982   7.600
  127    HA   LEU  23           HA       LEU  23  -7.169  12.362   6.145
  128    HB3  LEU  23           2HB      LEU  23  -5.973  10.656   4.352
  129    HG   LEU  23           HG       LEU  23  -4.760  12.498   6.378
  130   HD11  LEU  23          1HD1      LEU  23  -2.752  11.580   6.216
  131   HD12  LEU  23          2HD1      LEU  23  -2.818  11.704   4.459
  132   HD13  LEU  23          3HD1      LEU  23  -3.432  10.261   5.265
  133   HD21  LEU  23          3HD2      LEU  23  -5.720  13.644   4.568
  134   HD22  LEU  23          1HD2      LEU  23  -5.123  12.468   3.396
  135   HD23  LEU  23          2HD2      LEU  23  -3.999  13.568   4.193
  136    H    VAL  24           H        VAL  24  -8.916  12.766   4.978
  137    HA   VAL  24           HA       VAL  24 -10.798  10.787   4.224
  138    HB   VAL  24           HB       VAL  24 -10.500  13.654   3.326
  139   HG11  VAL  24          1HG1      VAL  24 -11.709  12.439   1.627
  140   HG12  VAL  24          2HG1      VAL  24 -12.755  11.710   2.847
  141   HG13  VAL  24          3HG1      VAL  24 -12.835  13.445   2.539
  142   HG21  VAL  24          3HG2      VAL  24 -11.799  12.301   5.603
  143   HG22  VAL  24          1HG2      VAL  24 -11.145  13.934   5.472
  144   HG23  VAL  24          2HG2      VAL  24 -12.741  13.568   4.817
  145    H    LEU  25           H        LEU  25 -10.447   9.309   2.707
  146    HA   LEU  25           HA       LEU  25  -9.077  10.138   0.233
  147    HB3  LEU  25           2HB      LEU  25  -7.714   8.400   0.400
  148    HG   LEU  25           HG       LEU  25  -9.001   8.133   3.075
  149   HD11  LEU  25          1HD1      LEU  25  -6.831   6.318   2.920
  150   HD12  LEU  25          2HD1      LEU  25  -7.972   5.911   1.639
  151   HD13  LEU  25          3HD1      LEU  25  -8.517   5.986   3.315
  152   HD21  LEU  25          3HD2      LEU  25  -6.611   8.437   3.759
  153   HD22  LEU  25          1HD2      LEU  25  -7.303   9.792   2.867
  154   HD23  LEU  25          2HD2      LEU  25  -6.217   8.665   2.054
  155    H    CYS  26           H        CYS  26  -9.688   8.797  -1.690
  156    HA   CYS  26           HA       CYS  26 -12.591   8.314  -1.654
  157    HB3  CYS  26           2HB      CYS  26 -11.268   8.558  -4.271
  158    H    SER  27           H        SER  27  -9.545   6.832  -2.056
  159    HA   SER  27           HA       SER  27 -10.847   4.298  -2.679
  160    HB3  SER  27           2HB      SER  27  -8.355   4.993  -4.203
  161    HG   SER  27           HG       SER  27 -10.056   3.578  -5.598
  162    HA   PRO  28           HA       PRO  28  -7.595   4.044   0.623
  163    HB3  PRO  28           2HB      PRO  28  -9.149   4.397   2.278
  164    HG3  PRO  28           2HG      PRO  28 -11.404   3.959   1.919
  165    HD3  PRO  28           2HD      PRO  28 -10.946   5.235   0.055
  166    H    LYS  29           H        LYS  29  -7.478   1.740   2.065
  167    HA   LYS  29           HA       LYS  29  -7.370  -0.385   0.025
  168    HB3  LYS  29           2HB      LYS  29  -5.250  -1.050   0.698
  169    HG3  LYS  29           2HG      LYS  29  -3.795   0.903   0.954
  170    HD3  LYS  29           2HD      LYS  29  -6.046   1.063  -1.031
  171    HE3  LYS  29           2HE      LYS  29  -3.521   2.639  -1.323
  172    HZ1  LYS  29           3HZ      LYS  29  -5.039   2.285  -3.220
  173    HZ2  LYS  29           1HZ      LYS  29  -4.849   3.918  -2.820
  174    HZ3  LYS  29           2HZ      LYS  29  -6.258   3.097  -2.373
  175    H    GLN  30           H        GLN  30  -9.613  -0.503   1.224
  176    HA   GLN  30           HA       GLN  30 -10.154  -1.313   3.703
  177    HB3  GLN  30           2HB      GLN  30 -11.286  -3.234   1.806
  178    HG3  GLN  30           2HG      GLN  30 -12.479  -1.041   3.483
  179   HE21  GLN  30          1HE2      GLN  30 -14.810  -1.997   4.067
  180   HE22  GLN  30          2HE2      GLN  30 -15.789  -2.288   2.675
  181    H    THR  31           H        THR  31  -9.345  -2.715   5.102
  182    HA   THR  31           HA       THR  31  -7.511  -4.764   4.245
  183    HB   THR  31           HB       THR  31  -7.072  -5.165   6.558
  184    HG1  THR  31           1HG      THR  31  -9.584  -3.947   6.907
  185   HG21  THR  31          3HG2      THR  31  -6.111  -3.167   7.062
  186   HG22  THR  31          1HG2      THR  31  -7.592  -2.257   6.766
  187   HG23  THR  31          2HG2      THR  31  -6.599  -2.789   5.410
  188    H    GLU  32           H        GLU  32  -7.961  -6.779   6.095
  189    HA   GLU  32           HA       GLU  32 -10.231  -8.118   4.859
  190    HB3  GLU  32           2HB      GLU  32  -8.571  -9.510   6.887
  191    HG3  GLU  32           2HG      GLU  32  -8.673 -10.685   4.261
  192    H    CYS  33           H        CYS  33 -10.215  -6.019   7.162
  193    HA   CYS  33           HA       CYS  33 -11.988  -7.553   8.951
  194    HB3  CYS  33           2HB      CYS  33  -9.815  -6.704   9.960
  195    H    GLY  34           H        GLY  34 -11.511  -4.666   7.062
  196    HA2  GLY  34           1HA      GLY  34 -13.748  -3.890   6.141
  197    HA3  GLY  34           2HA      GLY  34 -14.204  -3.734   7.831
  198    H    HIS  35           H        HIS  35 -11.929  -2.613   8.913
  199    HA   HIS  35           HA       HIS  35 -12.284   0.089   8.504
  200    HB3  HIS  35           2HB      HIS  35  -9.990   0.342   9.546
  201    HD2  HIS  35           2HD      HIS  35 -12.086   1.304  11.293
  202    HE1  HIS  35           1HE      HIS  35 -12.249  -2.323  13.489
  203    HE2  HIS  35           2HE      HIS  35 -13.001   0.078  13.379
  204    H    ARG  36           H        ARG  36 -10.361   1.590   7.829
  205    HA   ARG  36           HA       ARG  36  -9.064   0.640   5.389
  206    HB3  ARG  36           2HB      ARG  36  -9.789   2.784   4.238
  207    HG3  ARG  36           2HG      ARG  36 -11.509   0.458   4.771
  208    HD3  ARG  36           2HD      ARG  36 -12.946   2.159   3.010
  209    HE   ARG  36           HE       ARG  36 -13.667   0.330   4.812
  210   HH11  ARG  36          1HH1      ARG  36 -14.456   3.709   4.541
  211   HH12  ARG  36          2HH1      ARG  36 -16.013   3.539   5.283
  212   HH21  ARG  36          1HH2      ARG  36 -15.713   0.093   5.791
  213   HH22  ARG  36          2HH2      ARG  36 -16.727   1.482   5.994
  214    H    PHE  37           H        PHE  37  -7.329   2.012   4.663
  215    HA   PHE  37           HA       PHE  37  -6.440   4.067   6.542
  216    HB3  PHE  37           2HB      PHE  37  -4.094   3.012   6.384
  217    HD1  PHE  37           1HD      PHE  37  -6.575   0.470   7.388
  218    HD2  PHE  37           2HD      PHE  37  -4.023   3.632   8.656
  219    HE1  PHE  37           1HE      PHE  37  -6.984  -0.146   9.735
  220    HE2  PHE  37           2HE      PHE  37  -4.426   3.021  11.004
  221    HZ   PHE  37           HZ       PHE  37  -5.908   1.129  11.547
  222    H    CYS  38           H        CYS  38  -4.334   5.095   5.666
  223    HA   CYS  38           HA       CYS  38  -4.802   5.671   2.837
  224    HB3  CYS  38           2HB      CYS  38  -4.706   7.537   4.500
  225    H    GLU  39           H        GLU  39  -2.824   6.123   1.495
  226    HA   GLU  39           HA       GLU  39  -1.331   3.899   1.037
  227    HB3  GLU  39           2HB      GLU  39   0.445   5.655   0.162
  228    HG3  GLU  39           2HG      GLU  39  -2.300   5.688  -1.058
  229    H    SER  40           H        SER  40  -0.047   6.753   2.754
  230    HA   SER  40           HA       SER  40   2.354   5.703   3.579
  231    HB3  SER  40           2HB      SER  40   2.031   7.281   5.616
  232    HG   SER  40           HG       SER  40   1.719   8.374   3.015
  233    H    CYS  41           H        CYS  41  -0.053   6.210   6.101
  234    HA   CYS  41           HA       CYS  41   0.753   4.496   7.972
  235    HB3  CYS  41           2HB      CYS  41  -1.612   4.155   8.641
  236    H    MET  42           H        MET  42  -1.297   3.505   5.236
  237    HA   MET  42           HA       MET  42  -1.587   0.827   5.826
  238    HB3  MET  42           2HB      MET  42  -1.343   2.246   3.179
  239    HG3  MET  42           2HG      MET  42  -0.711  -0.102   2.836
  240    HE1  MET  42           3HE      MET  42  -3.474   0.213   5.576
  241    HE2  MET  42           1HE      MET  42  -4.317   0.408   4.040
  242    HE3  MET  42           2HE      MET  42  -4.626  -1.010   5.041
  243    H    ALA  43           H        ALA  43   0.964   2.277   3.796
  244    HA   ALA  43           HA       ALA  43   2.430  -0.067   3.380
  245    HB1  ALA  43           3HB      ALA  43   2.705   2.070   2.128
  246    HB2  ALA  43           1HB      ALA  43   3.561   2.721   3.526
  247    HB3  ALA  43           2HB      ALA  43   4.223   1.340   2.651
  248    H    ALA  44           H        ALA  44   2.319   2.114   6.092
  249    HA   ALA  44           HA       ALA  44   4.743   1.314   7.328
  250    HB1  ALA  44           3HB      ALA  44   2.380   2.903   8.089
  251    HB2  ALA  44           1HB      ALA  44   3.280   2.171   9.417
  252    HB3  ALA  44           2HB      ALA  44   4.098   3.252   8.286
  253    H    LEU  45           H        LEU  45   1.358   0.487   8.108
  254    HA   LEU  45           HA       LEU  45   1.861  -1.400  10.069
  255    HB3  LEU  45           2HB      LEU  45  -0.350  -2.242   9.670
  256    HG   LEU  45           HG       LEU  45  -0.360   0.706   9.026
  257   HD11  LEU  45          1HD1      LEU  45  -2.448  -0.759   8.529
  258   HD12  LEU  45          2HD1      LEU  45  -2.632   0.754   9.415
  259   HD13  LEU  45          3HD1      LEU  45  -2.624  -0.780  10.284
  260   HD21  LEU  45          3HD2      LEU  45   0.037   1.093  11.179
  261   HD22  LEU  45          1HD2      LEU  45   0.454  -0.614  11.337
  262   HD23  LEU  45          2HD2      LEU  45  -1.190  -0.072  11.679
  263    H    LEU  46           H        LEU  46   1.269  -2.026   6.607
  264    HA   LEU  46           HA       LEU  46   1.657  -4.753   6.588
  265    HB3  LEU  46           2HB      LEU  46   2.207  -4.548   4.240
  266    HG   LEU  46           HG       LEU  46   0.149  -2.500   5.050
  267   HD11  LEU  46          1HD1      LEU  46   0.874  -3.543   2.320
  268   HD12  LEU  46          2HD1      LEU  46   0.915  -1.870   2.877
  269   HD13  LEU  46          3HD1      LEU  46  -0.630  -2.700   2.692
  270   HD21  LEU  46          3HD2      LEU  46  -1.440  -4.219   4.429
  271   HD22  LEU  46          1HD2      LEU  46  -0.328  -4.839   5.649
  272   HD23  LEU  46          2HD2      LEU  46  -0.126  -5.299   3.959
  273    H    SER  47           H        SER  47   4.029  -2.207   6.798
  274    HA   SER  47           HA       SER  47   6.237  -4.080   6.444
  275    HB3  SER  47           2HB      SER  47   6.600  -1.193   7.180
  276    HG   SER  47           HG       SER  47   8.418  -2.577   6.891
  277    H    SER  48           H        SER  48   4.388  -4.181   8.765
  278    HA   SER  48           HA       SER  48   6.293  -3.625  10.940
  279    HB3  SER  48           2HB      SER  48   3.313  -4.120  11.153
  280    HG   SER  48           HG       SER  48   3.671  -4.043  13.213
  281    H    SER  49           H        SER  49   5.870  -6.025   9.013
  282    HA   SER  49           HA       SER  49   6.387  -8.248   9.167
  283    HB3  SER  49           2HB      SER  49   6.301  -8.633  12.040
  284    HG   SER  49           HG       SER  49   7.862  -9.846  11.366
  285    H    SER  50           H        SER  50   4.251  -7.390  11.894
  286    HA   SER  50           HA       SER  50   2.351  -9.417  10.909
  287    HB3  SER  50           2HB      SER  50   2.120  -8.648  13.741
  288    HG   SER  50           HG       SER  50   1.002 -10.412  13.295
  289    HA   PRO  51           HA       PRO  51   0.353  -5.214  10.753
  290    HB3  PRO  51           2HB      PRO  51   0.979  -4.893   8.567
  291    HG3  PRO  51           2HG      PRO  51   1.497  -6.695   7.190
  292    HD3  PRO  51           2HD      PRO  51   2.803  -7.205   9.019
  293    H    LYS  52           H        LYS  52  -1.535  -5.151  11.780
  294    HA   LYS  52           HA       LYS  52  -3.546  -7.217  11.169
  295    HB3  LYS  52           2HB      LYS  52  -4.273  -7.182  13.392
  296    HG3  LYS  52           2HG      LYS  52  -1.309  -6.921  13.254
  297    HD3  LYS  52           2HD      LYS  52  -2.540  -7.689  15.842
  298    HE3  LYS  52           2HE      LYS  52  -0.209  -5.904  15.686
  299    HZ1  LYS  52           3HZ      LYS  52  -0.640  -8.532  17.002
  300    HZ2  LYS  52           1HZ      LYS  52  -0.906  -7.025  17.724
  301    HZ3  LYS  52           2HZ      LYS  52   0.658  -7.482  17.274
  302    H    CYS  53           H        CYS  53  -3.616  -4.010  12.719
  303    HA   CYS  53           HA       CYS  53  -4.736  -2.424  10.875
  304    HB3  CYS  53           2HB      CYS  53  -6.770  -4.384  11.868
  305    H    THR  54           H        THR  54  -3.864  -0.864  12.183
  306    HA   THR  54           HA       THR  54  -3.852  -0.403  14.794
  307    HB   THR  54           HB       THR  54  -3.837   1.312  12.505
  308    HG1  THR  54           1HG      THR  54  -2.991   2.363  14.902
  309   HG21  THR  54          3HG2      THR  54  -5.357   2.377  14.886
  310   HG22  THR  54          1HG2      THR  54  -5.952   2.215  13.236
  311   HG23  THR  54          2HG2      THR  54  -4.681   3.381  13.603
  312    H    ALA  55           H        ALA  55  -6.722  -0.068  12.776
  313    HA   ALA  55           HA       ALA  55  -8.456   1.148  14.563
  314    HB1  ALA  55           3HB      ALA  55  -9.701  -0.978  12.989
  315    HB2  ALA  55           1HB      ALA  55 -10.012   0.759  13.002
  316    HB3  ALA  55           2HB      ALA  55  -8.679   0.108  12.047
  317    H    CYS  56           H        CYS  56  -8.701  -2.327  13.854
  318    HA   CYS  56           HA       CYS  56  -9.262  -2.773  16.713
  319    HB3  CYS  56           2HB      CYS  56 -11.231  -3.198  15.364
  320    H    GLN  57           H        GLN  57  -7.354  -3.678  13.984
  321    HA   GLN  57           HA       GLN  57  -5.344  -4.808  13.973
  322    HB3  GLN  57           2HB      GLN  57  -4.372  -5.654  15.917
  323    HG3  GLN  57           2HG      GLN  57  -6.009  -4.061  17.662
  324   HE21  GLN  57          1HE2      GLN  57  -3.748  -2.275  15.904
  325   HE22  GLN  57          2HE2      GLN  57  -2.400  -2.465  16.967
  326    H    GLU  58           H        GLU  58  -6.099  -6.101  12.315
  327    HA   GLU  58           HA       GLU  58  -6.959  -8.789  13.141
  328    HB3  GLU  58           2HB      GLU  58  -8.178  -6.995  11.071
  329    HG3  GLU  58           2HG      GLU  58  -7.680  -9.809  10.706
  330    H    SER  59           H        SER  59  -6.370  -7.333   9.959
  331    HA   SER  59           HA       SER  59  -3.787  -8.462   9.624
  332    HB3  SER  59           2HB      SER  59  -5.202 -10.531   9.522
  333    HG   SER  59           HG       SER  59  -6.913 -10.482   8.325
  334    H    ILE  60           H        ILE  60  -2.755  -7.483   7.974
  335    HA   ILE  60           HA       ILE  60  -4.364  -6.136   5.917
  336    HB   ILE  60           HB       ILE  60  -1.946  -4.693   6.816
  337   HG13  ILE  60          2HG1      ILE  60  -3.074  -5.440   8.943
  338   HG21  ILE  60          1HG2      ILE  60  -4.383  -4.201   5.365
  339   HG22  ILE  60          2HG2      ILE  60  -4.163  -3.005   6.642
  340   HG23  ILE  60          3HG2      ILE  60  -2.903  -3.243   5.431
  341   HD11  ILE  60          3HD1      ILE  60  -3.571  -2.536   8.891
  342   HD12  ILE  60          1HD1      ILE  60  -2.648  -3.515  10.031
  343   HD13  ILE  60          2HD1      ILE  60  -1.941  -3.068   8.478
  344    H    VAL  61           H        VAL  61  -3.736  -6.803   3.983
  345    HA   VAL  61           HA       VAL  61  -0.880  -7.184   3.454
  346    HB   VAL  61           HB       VAL  61  -3.020  -9.204   2.776
  347   HG11  VAL  61          1HG1      VAL  61  -0.511 -10.237   2.129
  348   HG12  VAL  61          2HG1      VAL  61  -1.781  -9.740   1.008
  349   HG13  VAL  61          3HG1      VAL  61  -0.520  -8.599   1.475
  350   HG21  VAL  61          3HG2      VAL  61  -0.515  -9.547   4.417
  351   HG22  VAL  61          1HG2      VAL  61  -2.109  -9.227   5.104
  352   HG23  VAL  61          2HG2      VAL  61  -1.821 -10.711   4.194
  353    H    LYS  62           H        LYS  62  -0.278  -6.188   1.648
  354    HA   LYS  62           HA       LYS  62  -1.870  -4.583   0.102
  355    HB3  LYS  62           2HB      LYS  62   0.497  -4.347  -0.035
  356    HG3  LYS  62           2HG      LYS  62   0.830  -6.899  -1.547
  357    HD3  LYS  62           2HD      LYS  62   3.129  -6.672  -0.565
  358    HE3  LYS  62           2HE      LYS  62   2.670  -4.118  -1.978
  359    HZ1  LYS  62           3HZ      LYS  62   4.803  -5.633  -1.642
  360    HZ2  LYS  62           1HZ      LYS  62   4.591  -4.657  -3.007
  361    HZ3  LYS  62           2HZ      LYS  62   4.238  -6.309  -3.087
  362    H    ASP  63           H        ASP  63  -1.012  -7.967  -0.503
  363    HA   ASP  63           HA       ASP  63  -2.346  -8.174  -2.992
  364    HB3  ASP  63           2HB      ASP  63  -1.756 -10.397  -2.956
  365    H    LYS  64           H        LYS  64  -3.375  -8.589   0.334
  366    HA   LYS  64           HA       LYS  64  -6.000  -9.549  -0.491
  367    HB3  LYS  64           2HB      LYS  64  -6.439  -9.869   1.865
  368    HG3  LYS  64           2HG      LYS  64  -4.402 -11.194   2.594
  369    HD3  LYS  64           2HD      LYS  64  -5.297 -11.929  -0.175
  370    HE3  LYS  64           2HE      LYS  64  -4.043 -13.260   2.046
  371    HZ1  LYS  64           3HZ      LYS  64  -6.533 -13.801   2.362
  372    HZ2  LYS  64           1HZ      LYS  64  -5.406 -15.063   2.389
  373    HZ3  LYS  64           2HZ      LYS  64  -6.331 -14.787   1.002
  374    H    VAL  65           H        VAL  65  -4.550  -6.622  -0.304
  375    HA   VAL  65           HA       VAL  65  -6.803  -5.174   0.844
  376    HB   VAL  65           HB       VAL  65  -4.018  -4.620   0.478
  377   HG11  VAL  65          1HG1      VAL  65  -4.120  -2.343  -0.365
  378   HG12  VAL  65          2HG1      VAL  65  -4.722  -3.474  -1.577
  379   HG13  VAL  65          3HG1      VAL  65  -5.855  -2.502  -0.637
  380   HG21  VAL  65          3HG2      VAL  65  -6.329  -3.425   1.946
  381   HG22  VAL  65          1HG2      VAL  65  -4.878  -4.201   2.578
  382   HG23  VAL  65          2HG2      VAL  65  -4.784  -2.575   1.903
  383    H    PHE  66           H        PHE  66  -7.985  -3.587  -0.299
  384    HA   PHE  66           HA       PHE  66  -8.335  -4.241  -3.116
  385    HB3  PHE  66           2HB      PHE  66 -10.272  -2.487  -2.755
  386    HD1  PHE  66           2HD      PHE  66  -9.542  -5.557  -0.758
  387    HD2  PHE  66           1HD      PHE  66 -12.112  -3.601  -3.529
  388    HE1  PHE  66           2HE      PHE  66 -10.936  -7.581  -0.888
  389    HE2  PHE  66           1HE      PHE  66 -13.511  -5.621  -3.663
  390    HZ   PHE  66           HZ       PHE  66 -12.922  -7.615  -2.343
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -47.562  -6.829  -1.622
    2    HA2  GLY   1           1HA      GLY   1 -49.315  -8.204  -3.238
    3    HA3  GLY   1           2HA      GLY   1 -49.344  -6.554  -3.839
    4    H    SER   2           H        SER   2 -47.254  -5.596  -4.454
    5    HA   SER   2           HA       SER   2 -45.021  -7.342  -4.919
    6    HB3  SER   2           2HB      SER   2 -45.629  -6.349  -7.527
    7    HG   SER   2           HG       SER   2 -45.808  -8.756  -7.820
    8    H    SER   3           H        SER   3 -43.162  -6.214  -5.160
    9    HA   SER   3           HA       SER   3 -43.347  -3.321  -4.948
   10    HB3  SER   3           2HB      SER   3 -41.709  -5.133  -3.738
   11    HG   SER   3           HG       SER   3 -39.968  -5.432  -4.860
   12    H    GLY   4           H        GLY   4 -41.302  -2.218  -6.109
   13    HA2  GLY   4           1HA      GLY   4 -40.308  -3.029  -8.529
   14    HA3  GLY   4           2HA      GLY   4 -41.902  -2.393  -8.909
   15    H    SER   5           H        SER   5 -42.077  -0.279  -9.283
   16    HA   SER   5           HA       SER   5 -40.106   1.453  -9.766
   17    HB3  SER   5           2HB      SER   5 -42.207   2.863  -8.312
   18    HG   SER   5           HG       SER   5 -42.237   3.990 -10.146
   19    H    SER   6           H        SER   6 -38.307   1.587  -8.544
   20    HA   SER   6           HA       SER   6 -38.391   3.115  -6.137
   21    HB3  SER   6           2HB      SER   6 -39.011   0.964  -5.164
   22    HG   SER   6           HG       SER   6 -37.976  -0.843  -5.620
   23    H    GLY   7           H        GLY   7 -36.882   4.471  -6.979
   24    HA2  GLY   7           1HA      GLY   7 -34.159   3.436  -7.131
   25    HA3  GLY   7           2HA      GLY   7 -34.794   4.187  -8.588
   26    H    PHE   8           H        PHE   8 -32.545   5.198  -7.409
   27    HA   PHE   8           HA       PHE   8 -33.354   7.478  -5.783
   28    HB3  PHE   8           2HB      PHE   8 -30.888   7.934  -5.696
   29    HD1  PHE   8           2HD      PHE   8 -32.115   7.634  -3.463
   30    HD2  PHE   8           1HD      PHE   8 -30.408   4.418  -5.668
   31    HE1  PHE   8           2HE      PHE   8 -32.086   6.257  -1.424
   32    HE2  PHE   8           1HE      PHE   8 -30.376   3.036  -3.632
   33    HZ   PHE   8           HZ       PHE   8 -31.215   3.955  -1.507
   34    H    VAL   9           H        VAL   9 -32.932   9.642  -6.370
   35    HA   VAL   9           HA       VAL   9 -32.339  10.124  -9.206
   36    HB   VAL   9           HB       VAL   9 -34.830  10.131  -8.791
   37   HG11  VAL   9          1HG1      VAL   9 -34.139  12.613  -7.221
   38   HG12  VAL   9          2HG1      VAL   9 -35.768  12.131  -7.701
   39   HG13  VAL   9          3HG1      VAL   9 -34.844  11.128  -6.582
   40   HG21  VAL   9          3HG2      VAL   9 -34.595  12.824  -9.660
   41   HG22  VAL   9          1HG2      VAL   9 -33.193  11.932 -10.254
   42   HG23  VAL   9          2HG2      VAL   9 -34.822  11.371 -10.633
   43    H    LYS  10           H        LYS  10 -30.935  10.485  -6.564
   44    HA   LYS  10           HA       LYS  10 -30.179  13.283  -7.001
   45    HB3  LYS  10           2HB      LYS  10 -29.932  13.460  -4.453
   46    HG3  LYS  10           2HG      LYS  10 -32.566  13.425  -5.861
   47    HD3  LYS  10           2HD      LYS  10 -32.693  12.779  -3.335
   48    HE3  LYS  10           2HE      LYS  10 -33.012  15.354  -2.368
   49    HZ1  LYS  10           3HZ      LYS  10 -30.499  14.392  -1.594
   50    HZ2  LYS  10           1HZ      LYS  10 -31.535  13.064  -1.748
   51    HZ3  LYS  10           2HZ      LYS  10 -31.950  14.347  -0.727
   52    H    THR  11           H        THR  11 -28.030  13.784  -6.479
   53    HA   THR  11           HA       THR  11 -26.127  11.828  -6.991
   54    HB   THR  11           HB       THR  11 -24.820  13.779  -5.435
   55    HG1  THR  11           1HG      THR  11 -25.730  15.680  -6.579
   56   HG21  THR  11          3HG2      THR  11 -25.190  14.022  -8.398
   57   HG22  THR  11          1HG2      THR  11 -24.302  12.658  -7.719
   58   HG23  THR  11          2HG2      THR  11 -23.745  14.306  -7.427
   59    H    VAL  12           H        VAL  12 -24.217  11.407  -5.427
   60    HA   VAL  12           HA       VAL  12 -25.214  10.822  -2.724
   61    HB   VAL  12           HB       VAL  12 -23.710   8.895  -4.500
   62   HG11  VAL  12          1HG1      VAL  12 -24.663   8.360  -1.701
   63   HG12  VAL  12          2HG1      VAL  12 -23.558   7.402  -2.688
   64   HG13  VAL  12          3HG1      VAL  12 -23.042   8.962  -2.045
   65   HG21  VAL  12          3HG2      VAL  12 -26.219   8.068  -3.228
   66   HG22  VAL  12          1HG2      VAL  12 -26.393   9.359  -4.418
   67   HG23  VAL  12          2HG2      VAL  12 -25.650   7.828  -4.880
   68    H    GLU  13           H        GLU  13 -24.007  12.374  -1.714
   69    HA   GLU  13           HA       GLU  13 -21.179  12.640  -2.273
   70    HB3  GLU  13           2HB      GLU  13 -21.209  14.491  -0.757
   71    HG3  GLU  13           2HG      GLU  13 -23.918  15.033  -1.642
   72    H    ASP  14           H        ASP  14 -19.725  11.346  -1.387
   73    HA   ASP  14           HA       ASP  14 -19.604  10.849   1.403
   74    HB3  ASP  14           2HB      ASP  14 -21.361   9.239   0.954
   75    H    LYS  15           H        LYS  15 -17.750   9.461   1.983
   76    HA   LYS  15           HA       LYS  15 -15.875   8.701  -0.045
   77    HB3  LYS  15           2HB      LYS  15 -15.051  10.810  -0.275
   78    HG3  LYS  15           2HG      LYS  15 -16.719  11.889   1.173
   79    HD3  LYS  15           2HD      LYS  15 -14.919  10.820   3.296
   80    HE3  LYS  15           2HE      LYS  15 -14.812  13.261   3.570
   81    HZ1  LYS  15           3HZ      LYS  15 -16.988  13.751   2.524
   82    HZ2  LYS  15           1HZ      LYS  15 -16.771  14.519   4.016
   83    HZ3  LYS  15           2HZ      LYS  15 -17.759  13.152   3.906
   84    H    TYR  16           H        TYR  16 -13.625   8.294   1.143
   85    HA   TYR  16           HA       TYR  16 -14.291   6.838   3.612
   86    HB3  TYR  16           2HB      TYR  16 -12.494   5.304   3.073
   87    HD1  TYR  16           1HD      TYR  16 -13.362   6.333  -0.345
   88    HD2  TYR  16           2HD      TYR  16 -14.394   3.826   2.933
   89    HE1  TYR  16           1HE      TYR  16 -14.860   5.045  -1.810
   90    HE2  TYR  16           2HE      TYR  16 -15.894   2.529   1.477
   91    HH   TYR  16           HH       TYR  16 -15.815   2.666  -1.832
   92    H    LYS  17           H        LYS  17 -12.300   6.483   5.044
   93    HA   LYS  17           HA       LYS  17 -10.400   8.679   5.029
   94    HB3  LYS  17           2HB      LYS  17 -12.592   8.388   7.043
   95    HG3  LYS  17           2HG      LYS  17 -10.863  10.209   8.178
   96    HD3  LYS  17           2HD      LYS  17 -10.467   8.059   9.738
   97    HE3  LYS  17           2HE      LYS  17 -12.453  10.135   9.515
   98    HZ1  LYS  17           3HZ      LYS  17 -13.570   8.214  11.297
   99    HZ2  LYS  17           1HZ      LYS  17 -13.611   7.659   9.700
  100    HZ3  LYS  17           2HZ      LYS  17 -14.331   9.137  10.100
  101    H    CYS  18           H        CYS  18  -8.506   8.197   6.063
  102    HA   CYS  18           HA       CYS  18  -7.894   5.489   6.530
  103    HB3  CYS  18           2HB      CYS  18  -6.413   8.029   7.215
  104    H    GLU  19           H        GLU  19  -7.693   4.292   8.370
  105    HA   GLU  19           HA       GLU  19  -9.090   5.275  10.706
  106    HB3  GLU  19           2HB      GLU  19  -8.283   2.819  11.452
  107    HG3  GLU  19           2HG      GLU  19 -10.351   1.948  10.806
  108    H    LYS  20           H        LYS  20  -6.429   6.358   9.954
  109    HA   LYS  20           HA       LYS  20  -5.105   5.875  12.535
  110    HB3  LYS  20           2HB      LYS  20  -3.183   6.554  10.496
  111    HG3  LYS  20           2HG      LYS  20  -3.557   4.283  12.406
  112    HD3  LYS  20           2HD      LYS  20  -1.262   4.555  10.471
  113    HE3  LYS  20           2HE      LYS  20  -0.284   2.835  11.542
  114    HZ1  LYS  20           3HZ      LYS  20  -0.934   4.401  13.357
  115    HZ2  LYS  20           1HZ      LYS  20  -0.639   2.815  13.866
  116    HZ3  LYS  20           2HZ      LYS  20  -2.229   3.373  13.714
  117    H    CYS  21           H        CYS  21  -4.726   7.972   9.669
  118    HA   CYS  21           HA       CYS  21  -4.370  10.258  11.469
  119    HB3  CYS  21           2HB      CYS  21  -2.601  10.095   9.887
  120    H    HIS  22           H        HIS  22  -6.863   8.774  10.040
  121    HA   HIS  22           HA       HIS  22  -8.983   9.369   9.464
  122    HB3  HIS  22           2HB      HIS  22  -9.865  10.794  10.952
  123    HD2  HIS  22           2HD      HIS  22  -7.693   9.102  12.505
  124    HE1  HIS  22           1HE      HIS  22  -6.379  12.765  14.195
  125    HE2  HIS  22           2HE      HIS  22  -6.276  10.252  14.338
  126    H    LEU  23           H        LEU  23  -6.694   9.928   7.657
  127    HA   LEU  23           HA       LEU  23  -7.225  12.342   6.248
  128    HB3  LEU  23           2HB      LEU  23  -5.992  10.692   4.434
  129    HG   LEU  23           HG       LEU  23  -4.814  12.486   6.523
  130   HD11  LEU  23          1HD1      LEU  23  -2.843  11.760   4.610
  131   HD12  LEU  23          2HD1      LEU  23  -3.458  10.288   5.361
  132   HD13  LEU  23          3HD1      LEU  23  -2.801  11.581   6.364
  133   HD21  LEU  23          3HD2      LEU  23  -4.818  12.564   3.507
  134   HD22  LEU  23          1HD2      LEU  23  -4.197  13.810   4.590
  135   HD23  LEU  23          2HD2      LEU  23  -5.924  13.455   4.553
  136    H    VAL  24           H        VAL  24  -8.930  12.758   5.025
  137    HA   VAL  24           HA       VAL  24 -10.784  10.757   4.222
  138    HB   VAL  24           HB       VAL  24 -10.527  13.691   3.637
  139   HG11  VAL  24          1HG1      VAL  24 -12.203  11.678   2.233
  140   HG12  VAL  24          2HG1      VAL  24 -12.918  13.249   2.604
  141   HG13  VAL  24          3HG1      VAL  24 -11.456  13.153   1.621
  142   HG21  VAL  24          3HG2      VAL  24 -11.555  12.395   5.766
  143   HG22  VAL  24          1HG2      VAL  24 -12.124  13.968   5.208
  144   HG23  VAL  24          2HG2      VAL  24 -12.987  12.502   4.744
  145    H    LEU  25           H        LEU  25 -10.465   9.363   2.626
  146    HA   LEU  25           HA       LEU  25  -9.101  10.306   0.190
  147    HB3  LEU  25           2HB      LEU  25  -7.605   8.690   0.404
  148    HG   LEU  25           HG       LEU  25  -9.050   8.133   2.939
  149   HD11  LEU  25          1HD1      LEU  25  -6.790   6.341   2.442
  150   HD12  LEU  25          2HD1      LEU  25  -8.232   5.978   1.494
  151   HD13  LEU  25          3HD1      LEU  25  -8.325   6.039   3.254
  152   HD21  LEU  25          3HD2      LEU  25  -6.193   8.712   2.173
  153   HD22  LEU  25          1HD2      LEU  25  -6.744   8.411   3.821
  154   HD23  LEU  25          2HD2      LEU  25  -7.340   9.816   2.935
  155    H    CYS  26           H        CYS  26  -9.626   8.870  -1.738
  156    HA   CYS  26           HA       CYS  26 -12.527   8.421  -1.765
  157    HB3  CYS  26           2HB      CYS  26 -10.587   8.834  -4.050
  158    H    SER  27           H        SER  27  -9.443   6.901  -2.499
  159    HA   SER  27           HA       SER  27 -10.846   4.321  -2.712
  160    HB3  SER  27           2HB      SER  27  -8.572   5.344  -4.420
  161    HG   SER  27           HG       SER  27  -9.557   2.708  -4.084
  162    HA   PRO  28           HA       PRO  28  -7.707   4.148   0.673
  163    HB3  PRO  28           2HB      PRO  28  -9.339   4.494   2.253
  164    HG3  PRO  28           2HG      PRO  28 -11.566   3.997   1.806
  165    HD3  PRO  28           2HD      PRO  28 -11.056   5.250  -0.061
  166    H    LYS  29           H        LYS  29  -7.608   1.870   2.164
  167    HA   LYS  29           HA       LYS  29  -7.356  -0.285   0.168
  168    HB3  LYS  29           2HB      LYS  29  -5.290  -0.974   1.106
  169    HG3  LYS  29           2HG      LYS  29  -3.816   0.921   0.960
  170    HD3  LYS  29           2HD      LYS  29  -5.977   1.678  -0.950
  171    HE3  LYS  29           2HE      LYS  29  -3.024   1.531  -0.878
  172    HZ1  LYS  29           3HZ      LYS  29  -3.381   0.029  -2.664
  173    HZ2  LYS  29           1HZ      LYS  29  -2.994   1.527  -3.351
  174    HZ3  LYS  29           2HZ      LYS  29  -4.599   0.993  -3.333
  175    H    GLN  30           H        GLN  30  -9.672  -0.220   1.443
  176    HA   GLN  30           HA       GLN  30 -10.166  -1.131   3.905
  177    HB3  GLN  30           2HB      GLN  30 -11.502  -2.786   1.856
  178    HG3  GLN  30           2HG      GLN  30 -12.559  -0.809   3.865
  179   HE21  GLN  30          1HE2      GLN  30 -14.680  -2.625   4.472
  180   HE22  GLN  30          2HE2      GLN  30 -15.802  -2.557   3.161
  181    H    THR  31           H        THR  31  -8.911  -2.464   5.054
  182    HA   THR  31           HA       THR  31  -7.401  -4.597   4.072
  183    HB   THR  31           HB       THR  31  -6.959  -5.208   6.307
  184    HG1  THR  31           1HG      THR  31  -9.334  -3.822   7.071
  185   HG21  THR  31          3HG2      THR  31  -6.172  -3.237   7.180
  186   HG22  THR  31          1HG2      THR  31  -7.659  -2.358   6.824
  187   HG23  THR  31          2HG2      THR  31  -6.518  -2.721   5.529
  188    H    GLU  32           H        GLU  32  -8.177  -6.637   6.021
  189    HA   GLU  32           HA       GLU  32 -10.391  -7.814   4.492
  190    HB3  GLU  32           2HB      GLU  32  -8.615  -9.331   6.382
  191    HG3  GLU  32           2HG      GLU  32  -8.955 -10.978   4.344
  192    H    CYS  33           H        CYS  33 -10.308  -5.956   6.996
  193    HA   CYS  33           HA       CYS  33 -12.106  -7.597   8.657
  194    HB3  CYS  33           2HB      CYS  33  -9.995  -6.812   9.762
  195    H    GLY  34           H        GLY  34 -11.661  -4.561   6.983
  196    HA2  GLY  34           1HA      GLY  34 -13.956  -3.827   6.092
  197    HA3  GLY  34           2HA      GLY  34 -14.362  -3.713   7.799
  198    H    HIS  35           H        HIS  35 -12.073  -2.591   8.840
  199    HA   HIS  35           HA       HIS  35 -12.463   0.117   8.480
  200    HB3  HIS  35           2HB      HIS  35 -10.208   0.399   9.540
  201    HD2  HIS  35           2HD      HIS  35 -12.252   1.160  11.405
  202    HE1  HIS  35           1HE      HIS  35 -12.309  -2.626  13.318
  203    HE2  HIS  35           2HE      HIS  35 -13.108  -0.239  13.406
  204    H    ARG  36           H        ARG  36 -10.382   1.562   7.883
  205    HA   ARG  36           HA       ARG  36  -9.203   0.677   5.369
  206    HB3  ARG  36           2HB      ARG  36  -9.882   2.836   4.271
  207    HG3  ARG  36           2HG      ARG  36 -11.852   0.722   4.975
  208    HD3  ARG  36           2HD      ARG  36 -12.635   2.884   3.077
  209    HE   ARG  36           HE       ARG  36 -14.556   1.511   4.749
  210   HH11  ARG  36          1HH1      ARG  36 -12.819   1.550   1.732
  211   HH12  ARG  36          2HH1      ARG  36 -13.956   0.530   0.915
  212   HH21  ARG  36          1HH2      ARG  36 -16.060   0.167   3.683
  213   HH22  ARG  36          2HH2      ARG  36 -15.800  -0.255   2.024
  214    H    PHE  37           H        PHE  37  -7.493   2.125   4.612
  215    HA   PHE  37           HA       PHE  37  -6.494   4.061   6.542
  216    HB3  PHE  37           2HB      PHE  37  -4.181   2.932   6.341
  217    HD1  PHE  37           1HD      PHE  37  -6.552   0.326   7.349
  218    HD2  PHE  37           2HD      PHE  37  -4.246   3.669   8.623
  219    HE1  PHE  37           1HE      PHE  37  -6.950  -0.297   9.695
  220    HE2  PHE  37           2HE      PHE  37  -4.641   3.051  10.971
  221    HZ   PHE  37           HZ       PHE  37  -5.993   1.065  11.510
  222    H    CYS  38           H        CYS  38  -4.395   5.069   5.672
  223    HA   CYS  38           HA       CYS  38  -4.844   5.668   2.844
  224    HB3  CYS  38           2HB      CYS  38  -4.747   7.524   4.518
  225    H    GLU  39           H        GLU  39  -2.872   6.090   1.502
  226    HA   GLU  39           HA       GLU  39  -1.385   3.863   1.054
  227    HB3  GLU  39           2HB      GLU  39   0.415   5.697   0.255
  228    HG3  GLU  39           2HG      GLU  39  -2.091   5.809  -1.303
  229    H    SER  40           H        SER  40  -0.063   6.713   2.751
  230    HA   SER  40           HA       SER  40   2.318   5.647   3.592
  231    HB3  SER  40           2HB      SER  40   1.844   7.207   5.697
  232    HG   SER  40           HG       SER  40   1.881   8.697   3.377
  233    H    CYS  41           H        CYS  41  -0.118   6.153   6.091
  234    HA   CYS  41           HA       CYS  41   0.674   4.448   7.977
  235    HB3  CYS  41           2HB      CYS  41  -1.715   4.068   8.586
  236    H    MET  42           H        MET  42  -1.277   3.445   5.178
  237    HA   MET  42           HA       MET  42  -1.576   0.763   5.777
  238    HB3  MET  42           2HB      MET  42  -1.245   2.139   3.112
  239    HG3  MET  42           2HG      MET  42  -0.872  -0.496   3.303
  240    HE1  MET  42           3HE      MET  42  -3.487   0.401   5.312
  241    HE2  MET  42           1HE      MET  42  -4.271  -1.173   5.450
  242    HE3  MET  42           2HE      MET  42  -2.518  -1.043   5.601
  243    H    ALA  43           H        ALA  43   0.959   2.158   3.685
  244    HA   ALA  43           HA       ALA  43   2.459  -0.184   3.407
  245    HB1  ALA  43           3HB      ALA  43   2.801   2.636   2.803
  246    HB2  ALA  43           1HB      ALA  43   4.317   1.848   3.237
  247    HB3  ALA  43           2HB      ALA  43   3.342   1.214   1.912
  248    H    ALA  44           H        ALA  44   2.173   1.994   6.055
  249    HA   ALA  44           HA       ALA  44   4.677   1.378   7.299
  250    HB1  ALA  44           3HB      ALA  44   2.211   2.512   8.607
  251    HB2  ALA  44           1HB      ALA  44   3.879   2.635   9.166
  252    HB3  ALA  44           2HB      ALA  44   3.377   3.473   7.696
  253    H    LEU  45           H        LEU  45   1.309   0.394   7.909
  254    HA   LEU  45           HA       LEU  45   1.847  -1.344  10.040
  255    HB3  LEU  45           2HB      LEU  45  -0.341  -2.309   9.587
  256    HG   LEU  45           HG       LEU  45  -0.392   0.673   9.137
  257   HD11  LEU  45          1HD1      LEU  45  -2.452  -0.635   8.426
  258   HD12  LEU  45          2HD1      LEU  45  -2.691   0.649   9.610
  259   HD13  LEU  45          3HD1      LEU  45  -2.653  -1.034  10.133
  260   HD21  LEU  45          3HD2      LEU  45   0.032   0.873  11.306
  261   HD22  LEU  45          1HD2      LEU  45   0.304  -0.867  11.390
  262   HD23  LEU  45          2HD2      LEU  45  -1.303  -0.211  11.700
  263    H    LEU  46           H        LEU  46   1.644  -1.941   6.552
  264    HA   LEU  46           HA       LEU  46   1.884  -4.702   6.547
  265    HB3  LEU  46           2HB      LEU  46   2.798  -4.471   4.290
  266    HG   LEU  46           HG       LEU  46   0.605  -2.469   4.821
  267   HD11  LEU  46          1HD1      LEU  46   1.473  -1.799   2.761
  268   HD12  LEU  46          2HD1      LEU  46   0.159  -2.894   2.334
  269   HD13  LEU  46          3HD1      LEU  46   1.829  -3.455   2.266
  270   HD21  LEU  46          3HD2      LEU  46  -0.512  -4.370   5.232
  271   HD22  LEU  46          1HD2      LEU  46   0.728  -5.379   4.487
  272   HD23  LEU  46          2HD2      LEU  46  -0.478  -4.576   3.480
  273    H    SER  47           H        SER  47   4.294  -2.255   7.121
  274    HA   SER  47           HA       SER  47   6.463  -4.202   7.003
  275    HB3  SER  47           2HB      SER  47   6.769  -1.316   7.803
  276    HG   SER  47           HG       SER  47   8.808  -1.670   7.294
  277    H    SER  48           H        SER  48   4.392  -4.416   9.044
  278    HA   SER  48           HA       SER  48   5.959  -3.865  11.474
  279    HB3  SER  48           2HB      SER  48   3.010  -4.512  11.336
  280    HG   SER  48           HG       SER  48   3.177  -4.378  13.414
  281    H    SER  49           H        SER  49   6.388  -6.118   9.672
  282    HA   SER  49           HA       SER  49   6.457  -8.420   9.633
  283    HB3  SER  49           2HB      SER  49   7.001  -8.676  12.485
  284    HG   SER  49           HG       SER  49   8.984  -8.713  10.523
  285    H    SER  50           H        SER  50   3.812  -7.266  10.324
  286    HA   SER  50           HA       SER  50   2.255  -9.444  10.606
  287    HB3  SER  50           2HB      SER  50   1.742  -9.032  13.242
  288    HG   SER  50           HG       SER  50   3.559 -10.845  13.310
  289    HA   PRO  51           HA       PRO  51   0.268  -5.210  10.454
  290    HB3  PRO  51           2HB      PRO  51   0.878  -4.850   8.269
  291    HG3  PRO  51           2HG      PRO  51   1.406  -6.627   6.864
  292    HD3  PRO  51           2HD      PRO  51   2.727  -7.151   8.679
  293    H    LYS  52           H        LYS  52  -1.618  -5.175  11.486
  294    HA   LYS  52           HA       LYS  52  -3.615  -7.248  10.851
  295    HB3  LYS  52           2HB      LYS  52  -4.347  -7.237  13.085
  296    HG3  LYS  52           2HG      LYS  52  -1.395  -7.128  12.849
  297    HD3  LYS  52           2HD      LYS  52  -2.531  -7.672  15.541
  298    HE3  LYS  52           2HE      LYS  52   0.045  -6.478  14.519
  299    HZ1  LYS  52           3HZ      LYS  52  -1.090  -6.317  17.072
  300    HZ2  LYS  52           1HZ      LYS  52   0.448  -5.817  16.576
  301    HZ3  LYS  52           2HZ      LYS  52   0.217  -7.388  17.159
  302    H    CYS  53           H        CYS  53  -3.699  -4.077  12.474
  303    HA   CYS  53           HA       CYS  53  -4.844  -2.459  10.671
  304    HB3  CYS  53           2HB      CYS  53  -6.856  -4.453  11.640
  305    H    THR  54           H        THR  54  -4.029  -0.879  11.967
  306    HA   THR  54           HA       THR  54  -3.955  -0.467  14.589
  307    HB   THR  54           HB       THR  54  -4.078   1.292  12.329
  308    HG1  THR  54           1HG      THR  54  -2.374   0.913  13.977
  309   HG21  THR  54          3HG2      THR  54  -5.473   2.303  14.810
  310   HG22  THR  54          1HG2      THR  54  -6.201   2.082  13.219
  311   HG23  THR  54          2HG2      THR  54  -4.951   3.304  13.455
  312    H    ALA  55           H        ALA  55  -6.887  -0.161  12.651
  313    HA   ALA  55           HA       ALA  55  -8.603   0.947  14.530
  314    HB1  ALA  55           3HB      ALA  55  -8.862  -0.018  11.977
  315    HB2  ALA  55           1HB      ALA  55  -9.856  -1.135  12.913
  316    HB3  ALA  55           2HB      ALA  55 -10.175   0.599  12.980
  317    H    CYS  56           H        CYS  56  -8.799  -2.500  13.681
  318    HA   CYS  56           HA       CYS  56  -9.282  -3.076  16.531
  319    HB3  CYS  56           2HB      CYS  56 -11.263  -3.508  15.205
  320    H    GLN  57           H        GLN  57  -7.439  -3.866  13.705
  321    HA   GLN  57           HA       GLN  57  -5.403  -4.939  13.596
  322    HB3  GLN  57           2HB      GLN  57  -4.325  -5.774  15.486
  323    HG3  GLN  57           2HG      GLN  57  -5.929  -4.265  17.328
  324   HE21  GLN  57          1HE2      GLN  57  -3.580  -2.896  15.131
  325   HE22  GLN  57          2HE2      GLN  57  -2.271  -2.842  16.257
  326    H    GLU  58           H        GLU  58  -6.237  -6.220  11.953
  327    HA   GLU  58           HA       GLU  58  -6.989  -8.941  12.783
  328    HB3  GLU  58           2HB      GLU  58  -8.301  -7.153  10.766
  329    HG3  GLU  58           2HG      GLU  58  -7.676  -9.280   9.604
  330    H    SER  59           H        SER  59  -6.395  -7.330   9.664
  331    HA   SER  59           HA       SER  59  -3.849  -8.491   9.245
  332    HB3  SER  59           2HB      SER  59  -5.305 -10.536   9.069
  333    HG   SER  59           HG       SER  59  -6.695 -10.710   7.372
  334    H    ILE  60           H        ILE  60  -2.823  -7.471   7.613
  335    HA   ILE  60           HA       ILE  60  -4.432  -6.027   5.627
  336    HB   ILE  60           HB       ILE  60  -2.012  -4.626   6.595
  337   HG13  ILE  60          2HG1      ILE  60  -3.170  -5.445   8.678
  338   HG21  ILE  60          1HG2      ILE  60  -4.332  -3.000   6.438
  339   HG22  ILE  60          2HG2      ILE  60  -2.937  -3.036   5.359
  340   HG23  ILE  60          3HG2      ILE  60  -4.323  -4.079   5.043
  341   HD11  ILE  60          3HD1      ILE  60  -2.606  -3.605   9.795
  342   HD12  ILE  60          1HD1      ILE  60  -2.107  -2.975   8.226
  343   HD13  ILE  60          2HD1      ILE  60  -3.705  -2.588   8.865
  344    H    VAL  61           H        VAL  61  -3.863  -7.133   3.842
  345    HA   VAL  61           HA       VAL  61  -0.984  -7.323   3.232
  346    HB   VAL  61           HB       VAL  61  -3.150  -9.313   2.547
  347   HG11  VAL  61          1HG1      VAL  61  -1.212 -10.601   1.544
  348   HG12  VAL  61          2HG1      VAL  61  -1.776  -9.201   0.630
  349   HG13  VAL  61          3HG1      VAL  61  -0.306  -9.089   1.597
  350   HG21  VAL  61          3HG2      VAL  61  -2.412  -9.649   4.777
  351   HG22  VAL  61          1HG2      VAL  61  -1.594 -10.861   3.790
  352   HG23  VAL  61          2HG2      VAL  61  -0.723  -9.424   4.326
  353    H    LYS  62           H        LYS  62  -0.428  -6.127   1.547
  354    HA   LYS  62           HA       LYS  62  -1.962  -4.532   0.005
  355    HB3  LYS  62           2HB      LYS  62   0.394  -4.342  -0.184
  356    HG3  LYS  62           2HG      LYS  62   0.761  -6.842  -1.734
  357    HD3  LYS  62           2HD      LYS  62   2.926  -6.687  -0.292
  358    HE3  LYS  62           2HE      LYS  62   2.125  -4.980  -2.607
  359    HZ1  LYS  62           3HZ      LYS  62   3.700  -3.524  -1.926
  360    HZ2  LYS  62           1HZ      LYS  62   4.732  -4.649  -2.656
  361    HZ3  LYS  62           2HZ      LYS  62   4.524  -4.656  -0.977
  362    H    ASP  63           H        ASP  63  -1.151  -7.903  -0.765
  363    HA   ASP  63           HA       ASP  63  -2.492  -8.047  -3.219
  364    HB3  ASP  63           2HB      ASP  63  -2.361 -10.410  -1.380
  365    H    LYS  64           H        LYS  64  -3.618  -8.651   0.078
  366    HA   LYS  64           HA       LYS  64  -6.294  -9.287  -0.853
  367    HB3  LYS  64           2HB      LYS  64  -6.800  -9.831   1.405
  368    HG3  LYS  64           2HG      LYS  64  -4.391 -10.881   2.128
  369    HD3  LYS  64           2HD      LYS  64  -5.999 -12.183  -0.034
  370    HE3  LYS  64           2HE      LYS  64  -5.155 -13.322   2.608
  371    HZ1  LYS  64           3HZ      LYS  64  -4.899 -15.160   0.608
  372    HZ2  LYS  64           1HZ      LYS  64  -6.302 -14.313   0.187
  373    HZ3  LYS  64           2HZ      LYS  64  -6.184 -15.054   1.703
  374    H    VAL  65           H        VAL  65  -4.568  -6.509  -0.229
  375    HA   VAL  65           HA       VAL  65  -6.849  -4.989   0.776
  376    HB   VAL  65           HB       VAL  65  -4.045  -4.717   1.040
  377   HG11  VAL  65          1HG1      VAL  65  -3.750  -2.345   0.411
  378   HG12  VAL  65          2HG1      VAL  65  -3.999  -3.398  -0.983
  379   HG13  VAL  65          3HG1      VAL  65  -5.320  -2.388  -0.391
  380   HG21  VAL  65          3HG2      VAL  65  -5.146  -4.194   2.949
  381   HG22  VAL  65          1HG2      VAL  65  -5.010  -2.558   2.305
  382   HG23  VAL  65          2HG2      VAL  65  -6.506  -3.466   2.094
  383    H    PHE  66           H        PHE  66  -8.006  -3.568  -0.409
  384    HA   PHE  66           HA       PHE  66  -7.178  -2.314  -2.770
  385    HB3  PHE  66           2HB      PHE  66  -7.215  -4.284  -4.008
  386    HD1  PHE  66           2HD      PHE  66 -10.778  -4.619  -3.162
  387    HD2  PHE  66           1HD      PHE  66  -6.891  -6.320  -2.822
  388    HE1  PHE  66           2HE      PHE  66 -11.771  -6.714  -2.341
  389    HE2  PHE  66           1HE      PHE  66  -7.878  -8.419  -2.002
  390    HZ   PHE  66           HZ       PHE  66 -10.320  -8.618  -1.758
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1 -59.470  11.484  -1.700
    2    HA2  GLY   1           1HA      GLY   1 -57.382  10.866  -0.811
    3    HA3  GLY   1           2HA      GLY   1 -57.560   9.738  -2.148
    4    H    SER   2           H        SER   2 -55.124  10.834  -0.963
    5    HA   SER   2           HA       SER   2 -53.960  11.920  -3.427
    6    HB3  SER   2           2HB      SER   2 -52.911  12.976  -0.845
    7    HG   SER   2           HG       SER   2 -53.106  13.775  -3.519
    8    H    SER   3           H        SER   3 -53.352   9.628  -3.590
    9    HA   SER   3           HA       SER   3 -51.115   8.901  -1.824
   10    HB3  SER   3           2HB      SER   3 -52.329   6.932  -3.715
   11    HG   SER   3           HG       SER   3 -50.922   5.907  -2.503
   12    H    GLY   4           H        GLY   4 -49.618  10.247  -2.952
   13    HA2  GLY   4           1HA      GLY   4 -47.832   9.172  -4.596
   14    HA3  GLY   4           2HA      GLY   4 -49.081   9.618  -5.749
   15    H    SER   5           H        SER   5 -46.361  10.661  -4.052
   16    HA   SER   5           HA       SER   5 -46.730  13.372  -5.097
   17    HB3  SER   5           2HB      SER   5 -46.867  12.720  -2.342
   18    HG   SER   5           HG       SER   5 -45.123  14.112  -1.628
   19    H    SER   6           H        SER   6 -44.592  14.629  -4.866
   20    HA   SER   6           HA       SER   6 -42.626  13.345  -6.359
   21    HB3  SER   6           2HB      SER   6 -42.676  15.858  -4.723
   22    HG   SER   6           HG       SER   6 -40.424  15.518  -6.240
   23    H    GLY   7           H        GLY   7 -41.968  11.397  -5.505
   24    HA2  GLY   7           1HA      GLY   7 -41.132  11.085  -2.794
   25    HA3  GLY   7           2HA      GLY   7 -40.885   9.931  -4.097
   26    H    PHE   8           H        PHE   8 -39.261  11.584  -1.879
   27    HA   PHE   8           HA       PHE   8 -36.952  12.110  -3.630
   28    HB3  PHE   8           2HB      PHE   8 -36.239  13.337  -1.346
   29    HD1  PHE   8           1HD      PHE   8 -38.199  13.522  -4.385
   30    HD2  PHE   8           2HD      PHE   8 -36.143  15.797  -1.433
   31    HE1  PHE   8           1HE      PHE   8 -38.201  15.468  -5.889
   32    HE2  PHE   8           2HE      PHE   8 -36.142  17.748  -2.932
   33    HZ   PHE   8           HZ       PHE   8 -37.172  17.585  -5.163
   34    H    VAL   9           H        VAL   9 -35.190  10.890  -3.413
   35    HA   VAL   9           HA       VAL   9 -35.172   8.809  -1.385
   36    HB   VAL   9           HB       VAL   9 -34.621   8.268  -3.739
   37   HG11  VAL   9          1HG1      VAL   9 -32.989   9.266  -4.924
   38   HG12  VAL   9          2HG1      VAL   9 -33.178  10.563  -3.743
   39   HG13  VAL   9          3HG1      VAL   9 -31.901   9.364  -3.540
   40   HG21  VAL   9          3HG2      VAL   9 -32.932   7.661  -1.418
   41   HG22  VAL   9          1HG2      VAL   9 -33.727   6.578  -2.561
   42   HG23  VAL   9          2HG2      VAL   9 -32.185   7.325  -2.979
   43    H    LYS  10           H        LYS  10 -33.838   8.704   0.330
   44    HA   LYS  10           HA       LYS  10 -32.247  11.053   0.948
   45    HB3  LYS  10           2HB      LYS  10 -31.876   9.478   3.091
   46    HG3  LYS  10           2HG      LYS  10 -33.108  11.712   2.918
   47    HD3  LYS  10           2HD      LYS  10 -35.647  10.382   3.411
   48    HE3  LYS  10           2HE      LYS  10 -34.785  12.888   2.745
   49    HZ1  LYS  10           3HZ      LYS  10 -34.478  12.310   0.434
   50    HZ2  LYS  10           1HZ      LYS  10 -35.798  13.358   0.589
   51    HZ3  LYS  10           2HZ      LYS  10 -36.055  11.706   0.334
   52    H    THR  11           H        THR  11 -30.069  11.152   1.028
   53    HA   THR  11           HA       THR  11 -28.363   8.896   1.225
   54    HB   THR  11           HB       THR  11 -27.556   9.885  -1.311
   55    HG1  THR  11           1HG      THR  11 -29.854  10.439  -1.478
   56   HG21  THR  11          3HG2      THR  11 -26.913   7.734  -1.018
   57   HG22  THR  11          1HG2      THR  11 -28.441   7.389  -1.825
   58   HG23  THR  11          2HG2      THR  11 -28.340   7.325  -0.066
   59    H    VAL  12           H        VAL  12 -26.064   9.489   1.004
   60    HA   VAL  12           HA       VAL  12 -25.576  12.381   1.184
   61    HB   VAL  12           HB       VAL  12 -25.721  11.111   3.463
   62   HG11  VAL  12          1HG1      VAL  12 -23.728  10.045   4.202
   63   HG12  VAL  12          2HG1      VAL  12 -24.169   9.304   2.663
   64   HG13  VAL  12          3HG1      VAL  12 -22.868  10.492   2.730
   65   HG21  VAL  12          3HG2      VAL  12 -23.225  12.564   3.572
   66   HG22  VAL  12          1HG2      VAL  12 -24.415  13.399   2.573
   67   HG23  VAL  12          2HG2      VAL  12 -24.801  12.983   4.244
   68    H    GLU  13           H        GLU  13 -23.938  13.020  -0.053
   69    HA   GLU  13           HA       GLU  13 -22.234  10.995  -1.282
   70    HB3  GLU  13           2HB      GLU  13 -21.457  13.083  -2.619
   71    HG3  GLU  13           2HG      GLU  13 -24.182  11.863  -2.827
   72    H    ASP  14           H        ASP  14 -20.219  10.631  -0.647
   73    HA   ASP  14           HA       ASP  14 -18.460  12.685   0.247
   74    HB3  ASP  14           2HB      ASP  14 -18.315  11.021   2.491
   75    H    LYS  15           H        LYS  15 -16.577  11.265   1.607
   76    HA   LYS  15           HA       LYS  15 -15.949   9.005  -0.174
   77    HB3  LYS  15           2HB      LYS  15 -13.871   9.802  -0.659
   78    HG3  LYS  15           2HG      LYS  15 -15.715  11.792  -0.831
   79    HD3  LYS  15           2HD      LYS  15 -14.275  12.518   1.397
   80    HE3  LYS  15           2HE      LYS  15 -12.314  12.913  -0.124
   81    HZ1  LYS  15           3HZ      LYS  15 -14.082  15.060  -1.162
   82    HZ2  LYS  15           1HZ      LYS  15 -13.405  13.785  -2.046
   83    HZ3  LYS  15           2HZ      LYS  15 -12.410  14.999  -1.414
   84    H    TYR  16           H        TYR  16 -13.591   8.192   0.969
   85    HA   TYR  16           HA       TYR  16 -14.544   7.167   3.541
   86    HB3  TYR  16           2HB      TYR  16 -12.772   5.461   3.271
   87    HD1  TYR  16           2HD      TYR  16 -15.716   6.581   1.880
   88    HD2  TYR  16           1HD      TYR  16 -12.734   3.609   1.264
   89    HE1  TYR  16           2HE      TYR  16 -17.344   5.214   0.644
   90    HE2  TYR  16           1HE      TYR  16 -14.353   2.234   0.025
   91    HH   TYR  16           HH       TYR  16 -16.591   1.951  -0.393
   92    H    LYS  17           H        LYS  17 -12.410   6.522   4.931
   93    HA   LYS  17           HA       LYS  17 -10.489   8.689   5.018
   94    HB3  LYS  17           2HB      LYS  17 -12.671   8.352   7.033
   95    HG3  LYS  17           2HG      LYS  17 -10.888  10.066   8.250
   96    HD3  LYS  17           2HD      LYS  17 -10.543   7.837   9.700
   97    HE3  LYS  17           2HE      LYS  17 -12.494   9.956   9.577
   98    HZ1  LYS  17           3HZ      LYS  17 -13.711   7.519   9.622
   99    HZ2  LYS  17           1HZ      LYS  17 -14.384   8.974  10.163
  100    HZ3  LYS  17           2HZ      LYS  17 -13.620   7.937  11.259
  101    H    CYS  18           H        CYS  18  -8.593   8.121   6.000
  102    HA   CYS  18           HA       CYS  18  -8.018   5.389   6.323
  103    HB3  CYS  18           2HB      CYS  18  -6.522   7.890   7.096
  104    H    GLU  19           H        GLU  19  -7.809   4.087   8.092
  105    HA   GLU  19           HA       GLU  19  -9.213   4.936  10.478
  106    HB3  GLU  19           2HB      GLU  19  -8.528   2.472  11.134
  107    HG3  GLU  19           2HG      GLU  19 -10.498   1.620  10.240
  108    H    LYS  20           H        LYS  20  -6.602   6.122   9.853
  109    HA   LYS  20           HA       LYS  20  -5.280   5.483  12.392
  110    HB3  LYS  20           2HB      LYS  20  -3.314   6.228  10.430
  111    HG3  LYS  20           2HG      LYS  20  -3.776   3.802  12.133
  112    HD3  LYS  20           2HD      LYS  20  -1.421   4.309  10.314
  113    HE3  LYS  20           2HE      LYS  20  -0.651   2.141  11.032
  114    HZ1  LYS  20           3HZ      LYS  20   0.026   2.666  13.176
  115    HZ2  LYS  20           1HZ      LYS  20  -1.398   3.502  13.544
  116    HZ3  LYS  20           2HZ      LYS  20  -0.266   4.183  12.487
  117    H    CYS  21           H        CYS  21  -4.759   7.683   9.632
  118    HA   CYS  21           HA       CYS  21  -4.408   9.889  11.517
  119    HB3  CYS  21           2HB      CYS  21  -2.665   9.764   9.897
  120    H    HIS  22           H        HIS  22  -6.924   8.499   9.988
  121    HA   HIS  22           HA       HIS  22  -9.046   9.146   9.483
  122    HB3  HIS  22           2HB      HIS  22  -9.915  10.515  11.033
  123    HD2  HIS  22           2HD      HIS  22  -7.797   8.658  12.480
  124    HE1  HIS  22           1HE      HIS  22  -6.419  12.161  14.436
  125    HE2  HIS  22           2HE      HIS  22  -6.374   9.643  14.402
  126    H    LEU  23           H        LEU  23  -6.794   9.750   7.672
  127    HA   LEU  23           HA       LEU  23  -7.324  12.251   6.402
  128    HB3  LEU  23           2HB      LEU  23  -6.063  10.740   4.505
  129    HG   LEU  23           HG       LEU  23  -4.903  12.363   6.738
  130   HD11  LEU  23          1HD1      LEU  23  -3.540  10.261   5.428
  131   HD12  LEU  23          2HD1      LEU  23  -2.886  11.477   6.523
  132   HD13  LEU  23          3HD1      LEU  23  -2.918  11.782   4.787
  133   HD21  LEU  23          3HD2      LEU  23  -5.976  13.519   4.875
  134   HD22  LEU  23          1HD2      LEU  23  -4.931  12.667   3.736
  135   HD23  LEU  23          2HD2      LEU  23  -4.235  13.810   4.886
  136    H    VAL  24           H        VAL  24  -9.032  12.709   5.199
  137    HA   VAL  24           HA       VAL  24 -10.870  10.739   4.299
  138    HB   VAL  24           HB       VAL  24 -10.618  13.692   3.781
  139   HG11  VAL  24          1HG1      VAL  24 -12.569  11.744   2.578
  140   HG12  VAL  24          2HG1      VAL  24 -12.903  13.471   2.711
  141   HG13  VAL  24          3HG1      VAL  24 -11.535  12.908   1.750
  142   HG21  VAL  24          3HG2      VAL  24 -11.676  12.229   5.876
  143   HG22  VAL  24          1HG2      VAL  24 -12.006  13.923   5.513
  144   HG23  VAL  24          2HG2      VAL  24 -13.089  12.667   4.914
  145    H    LEU  25           H        LEU  25 -10.488   9.392   2.672
  146    HA   LEU  25           HA       LEU  25  -9.052  10.413   0.310
  147    HB3  LEU  25           2HB      LEU  25  -7.771   8.598   0.289
  148    HG   LEU  25           HG       LEU  25  -8.991   8.221   2.992
  149   HD11  LEU  25          1HD1      LEU  25  -6.748   6.459   2.452
  150   HD12  LEU  25          2HD1      LEU  25  -8.176   6.051   1.504
  151   HD13  LEU  25          3HD1      LEU  25  -8.279   6.130   3.262
  152   HD21  LEU  25          3HD2      LEU  25  -6.491   8.449   3.539
  153   HD22  LEU  25          1HD2      LEU  25  -7.358   9.884   2.991
  154   HD23  LEU  25          2HD2      LEU  25  -6.322   8.999   1.872
  155    H    CYS  26           H        CYS  26  -9.568   8.645  -1.580
  156    HA   CYS  26           HA       CYS  26 -12.509   8.546  -1.763
  157    HB3  CYS  26           2HB      CYS  26 -11.664   8.589  -4.371
  158    H    SER  27           H        SER  27  -9.749   6.727  -1.577
  159    HA   SER  27           HA       SER  27 -11.078   4.290  -2.102
  160    HB3  SER  27           2HB      SER  27 -10.883   4.644  -4.416
  161    HG   SER  27           HG       SER  27  -9.597   6.260  -4.872
  162    HA   PRO  28           HA       PRO  28  -7.369   4.077   0.626
  163    HB3  PRO  28           2HB      PRO  28  -8.699   4.338   2.481
  164    HG3  PRO  28           2HG      PRO  28 -10.959   3.794   2.423
  165    HD3  PRO  28           2HD      PRO  28 -10.819   5.109   0.535
  166    H    LYS  29           H        LYS  29  -6.959   1.763   2.003
  167    HA   LYS  29           HA       LYS  29  -6.856  -0.262  -0.134
  168    HB3  LYS  29           2HB      LYS  29  -4.812  -1.093   0.868
  169    HG3  LYS  29           2HG      LYS  29  -3.303   0.820   0.668
  170    HD3  LYS  29           2HD      LYS  29  -5.494   0.999  -1.397
  171    HE3  LYS  29           2HE      LYS  29  -2.558   1.616  -1.359
  172    HZ1  LYS  29           3HZ      LYS  29  -4.227   0.832  -3.655
  173    HZ2  LYS  29           1HZ      LYS  29  -2.623   0.416  -3.308
  174    HZ3  LYS  29           2HZ      LYS  29  -2.994   1.972  -3.860
  175    H    GLN  30           H        GLN  30  -9.162  -0.396   1.065
  176    HA   GLN  30           HA       GLN  30  -9.726  -1.457   3.437
  177    HB3  GLN  30           2HB      GLN  30 -10.884  -3.134   1.327
  178    HG3  GLN  30           2HG      GLN  30 -12.037  -1.170   3.291
  179   HE21  GLN  30          1HE2      GLN  30 -14.207  -3.211   3.496
  180   HE22  GLN  30          2HE2      GLN  30 -15.263  -2.868   2.173
  181    H    THR  31           H        THR  31  -8.880  -2.976   4.681
  182    HA   THR  31           HA       THR  31  -7.114  -4.975   3.613
  183    HB   THR  31           HB       THR  31  -6.606  -5.564   5.839
  184    HG1  THR  31           1HG      THR  31  -8.875  -4.131   6.777
  185   HG21  THR  31          3HG2      THR  31  -5.943  -3.535   6.801
  186   HG22  THR  31          1HG2      THR  31  -7.354  -2.676   6.186
  187   HG23  THR  31          2HG2      THR  31  -6.069  -3.164   5.081
  188    H    GLU  32           H        GLU  32  -7.817  -7.007   5.601
  189    HA   GLU  32           HA       GLU  32 -10.031  -8.240   4.123
  190    HB3  GLU  32           2HB      GLU  32  -8.755 -10.048   5.948
  191    HG3  GLU  32           2HG      GLU  32  -8.055 -11.197   3.853
  192    H    CYS  33           H        CYS  33  -9.972  -6.317   6.576
  193    HA   CYS  33           HA       CYS  33 -11.730  -7.941   8.294
  194    HB3  CYS  33           2HB      CYS  33  -9.600  -6.997   9.310
  195    H    GLY  34           H        GLY  34 -11.397  -4.999   6.454
  196    HA2  GLY  34           1HA      GLY  34 -13.653  -4.308   5.532
  197    HA3  GLY  34           2HA      GLY  34 -14.146  -4.237   7.216
  198    H    HIS  35           H        HIS  35 -11.948  -3.031   8.374
  199    HA   HIS  35           HA       HIS  35 -12.452  -0.343   8.070
  200    HB3  HIS  35           2HB      HIS  35 -10.167  -0.005   9.123
  201    HD2  HIS  35           2HD      HIS  35 -12.206   0.827  10.954
  202    HE1  HIS  35           1HE      HIS  35 -12.381  -2.926  12.922
  203    HE2  HIS  35           2HE      HIS  35 -13.122  -0.520  12.963
  204    H    ARG  36           H        ARG  36 -10.416   1.211   7.553
  205    HA   ARG  36           HA       ARG  36  -9.209   0.461   5.003
  206    HB3  ARG  36           2HB      ARG  36  -9.923   2.658   4.013
  207    HG3  ARG  36           2HG      ARG  36 -11.772   0.429   4.567
  208    HD3  ARG  36           2HD      ARG  36 -12.962   2.579   2.962
  209    HE   ARG  36           HE       ARG  36 -14.431   1.240   5.063
  210   HH11  ARG  36          1HH1      ARG  36 -13.359   1.165   1.753
  211   HH12  ARG  36          2HH1      ARG  36 -14.593   0.061   1.240
  212   HH21  ARG  36          1HH2      ARG  36 -16.060  -0.213   4.403
  213   HH22  ARG  36          2HH2      ARG  36 -16.130  -0.721   2.749
  214    H    PHE  37           H        PHE  37  -7.466   1.866   4.356
  215    HA   PHE  37           HA       PHE  37  -6.514   3.787   6.324
  216    HB3  PHE  37           2HB      PHE  37  -4.206   2.647   6.198
  217    HD1  PHE  37           1HD      PHE  37  -6.683   0.087   7.093
  218    HD2  PHE  37           2HD      PHE  37  -4.285   3.316   8.484
  219    HE1  PHE  37           1HE      PHE  37  -7.169  -0.558   9.418
  220    HE2  PHE  37           2HE      PHE  37  -4.766   2.676  10.811
  221    HZ   PHE  37           HZ       PHE  37  -6.209   0.737  11.280
  222    H    CYS  38           H        CYS  38  -4.599   4.990   5.541
  223    HA   CYS  38           HA       CYS  38  -4.897   5.547   2.707
  224    HB3  CYS  38           2HB      CYS  38  -4.800   7.364   4.437
  225    H    GLU  39           H        GLU  39  -2.885   5.996   1.419
  226    HA   GLU  39           HA       GLU  39  -1.408   3.737   0.988
  227    HB3  GLU  39           2HB      GLU  39   0.373   5.611   0.176
  228    HG3  GLU  39           2HG      GLU  39  -2.181   5.379  -1.354
  229    H    SER  40           H        SER  40  -0.141   6.628   2.654
  230    HA   SER  40           HA       SER  40   2.268   5.628   3.496
  231    HB3  SER  40           2HB      SER  40   0.392   7.646   4.688
  232    HG   SER  40           HG       SER  40   2.734   6.591   5.847
  233    H    CYS  41           H        CYS  41  -0.219   6.057   5.967
  234    HA   CYS  41           HA       CYS  41   0.612   4.412   7.884
  235    HB3  CYS  41           2HB      CYS  41  -1.795   3.880   8.402
  236    H    MET  42           H        MET  42  -1.313   3.262   5.116
  237    HA   MET  42           HA       MET  42  -1.450   0.583   5.724
  238    HB3  MET  42           2HB      MET  42  -1.171   1.951   3.049
  239    HG3  MET  42           2HG      MET  42  -0.634  -0.652   3.258
  240    HE1  MET  42           3HE      MET  42  -2.309  -1.216   5.569
  241    HE2  MET  42           1HE      MET  42  -3.368   0.145   5.196
  242    HE3  MET  42           2HE      MET  42  -4.043  -1.474   5.373
  243    H    ALA  43           H        ALA  43   1.088   2.176   3.791
  244    HA   ALA  43           HA       ALA  43   2.699  -0.094   3.452
  245    HB1  ALA  43           3HB      ALA  43   3.363   1.521   2.009
  246    HB2  ALA  43           1HB      ALA  43   3.067   2.826   3.157
  247    HB3  ALA  43           2HB      ALA  43   4.527   1.846   3.294
  248    H    ALA  44           H        ALA  44   2.290   2.048   6.142
  249    HA   ALA  44           HA       ALA  44   4.749   1.428   7.458
  250    HB1  ALA  44           3HB      ALA  44   4.146   3.063   8.842
  251    HB2  ALA  44           1HB      ALA  44   2.735   3.296   7.809
  252    HB3  ALA  44           2HB      ALA  44   2.623   2.267   9.236
  253    H    LEU  45           H        LEU  45   1.372   0.428   8.017
  254    HA   LEU  45           HA       LEU  45   1.863  -1.352  10.104
  255    HB3  LEU  45           2HB      LEU  45  -0.283  -2.373   9.521
  256    HG   LEU  45           HG       LEU  45  -0.367   0.627   9.220
  257   HD11  LEU  45          1HD1      LEU  45  -2.688   0.549   9.568
  258   HD12  LEU  45          2HD1      LEU  45  -2.653  -1.162   9.989
  259   HD13  LEU  45          3HD1      LEU  45  -2.365  -0.658   8.323
  260   HD21  LEU  45          3HD2      LEU  45   0.337   0.431  11.357
  261   HD22  LEU  45          1HD2      LEU  45  -0.211  -1.239  11.500
  262   HD23  LEU  45          2HD2      LEU  45  -1.367   0.084  11.655
  263    H    LEU  46           H        LEU  46   1.520  -2.061   6.627
  264    HA   LEU  46           HA       LEU  46   1.974  -4.779   6.683
  265    HB3  LEU  46           2HB      LEU  46   2.731  -4.576   4.376
  266    HG   LEU  46           HG       LEU  46   0.475  -2.678   5.003
  267   HD11  LEU  46          1HD1      LEU  46   1.535  -3.632   2.353
  268   HD12  LEU  46          2HD1      LEU  46   1.322  -1.971   2.903
  269   HD13  LEU  46          3HD1      LEU  46  -0.088  -2.977   2.573
  270   HD21  LEU  46          3HD2      LEU  46   0.635  -5.554   4.136
  271   HD22  LEU  46          1HD2      LEU  46  -0.839  -4.594   4.007
  272   HD23  LEU  46          2HD2      LEU  46  -0.115  -4.890   5.589
  273    H    SER  47           H        SER  47   4.279  -2.156   6.938
  274    HA   SER  47           HA       SER  47   6.562  -3.930   6.741
  275    HB3  SER  47           2HB      SER  47   6.725  -1.076   7.661
  276    HG   SER  47           HG       SER  47   8.697  -1.198   6.712
  277    H    SER  48           H        SER  48   4.501  -4.121   8.936
  278    HA   SER  48           HA       SER  48   6.252  -3.693  11.260
  279    HB3  SER  48           2HB      SER  48   3.285  -4.273  11.302
  280    HG   SER  48           HG       SER  48   4.566  -2.813  13.279
  281    H    SER  49           H        SER  49   5.930  -6.001   9.175
  282    HA   SER  49           HA       SER  49   6.424  -8.231   9.230
  283    HB3  SER  49           2HB      SER  49   6.281  -8.380  12.209
  284    HG   SER  49           HG       SER  49   7.141 -10.177  11.459
  285    H    SER  50           H        SER  50   4.335  -7.638  12.063
  286    HA   SER  50           HA       SER  50   2.440  -9.599  10.951
  287    HB3  SER  50           2HB      SER  50   2.851 -10.569  12.968
  288    HG   SER  50           HG       SER  50   3.467  -7.994  13.999
  289    HA   PRO  51           HA       PRO  51   0.407  -5.397  10.857
  290    HB3  PRO  51           2HB      PRO  51   1.154  -4.953   8.730
  291    HG3  PRO  51           2HG      PRO  51   1.786  -6.671   7.298
  292    HD3  PRO  51           2HD      PRO  51   2.992  -7.255   9.174
  293    H    LYS  52           H        LYS  52  -1.541  -5.415  11.768
  294    HA   LYS  52           HA       LYS  52  -3.464  -7.494  10.955
  295    HB3  LYS  52           2HB      LYS  52  -4.355  -7.511  13.127
  296    HG3  LYS  52           2HG      LYS  52  -1.458  -7.569  12.968
  297    HD3  LYS  52           2HD      LYS  52  -2.383  -7.484  15.774
  298    HE3  LYS  52           2HE      LYS  52   0.010  -7.828  14.605
  299    HZ1  LYS  52           3HZ      LYS  52   0.029  -5.546  13.732
  300    HZ2  LYS  52           1HZ      LYS  52   1.297  -5.827  14.817
  301    HZ3  LYS  52           2HZ      LYS  52  -0.058  -4.944  15.311
  302    H    CYS  53           H        CYS  53  -3.716  -4.332  12.578
  303    HA   CYS  53           HA       CYS  53  -4.752  -2.728  10.695
  304    HB3  CYS  53           2HB      CYS  53  -6.800  -4.747  11.530
  305    H    THR  54           H        THR  54  -4.078  -1.115  12.019
  306    HA   THR  54           HA       THR  54  -4.172  -0.701  14.644
  307    HB   THR  54           HB       THR  54  -4.137   1.038  12.384
  308    HG1  THR  54           1HG      THR  54  -3.540   1.978  14.949
  309   HG21  THR  54          3HG2      THR  54  -6.348   1.800  12.978
  310   HG22  THR  54          1HG2      THR  54  -5.180   3.043  13.427
  311   HG23  THR  54          2HG2      THR  54  -5.872   1.993  14.665
  312    H    ALA  55           H        ALA  55  -6.981  -0.465  12.524
  313    HA   ALA  55           HA       ALA  55  -8.832   0.609  14.294
  314    HB1  ALA  55           3HB      ALA  55  -8.909  -0.352  11.725
  315    HB2  ALA  55           1HB      ALA  55  -9.947  -1.481  12.596
  316    HB3  ALA  55           2HB      ALA  55 -10.292   0.247  12.642
  317    H    CYS  56           H        CYS  56  -8.918  -2.832  13.417
  318    HA   CYS  56           HA       CYS  56  -9.575  -3.436  16.225
  319    HB3  CYS  56           2HB      CYS  56 -11.448  -3.905  14.762
  320    H    GLN  57           H        GLN  57  -7.549  -4.205  13.513
  321    HA   GLN  57           HA       GLN  57  -5.490  -5.238  13.523
  322    HB3  GLN  57           2HB      GLN  57  -4.492  -6.022  15.484
  323    HG3  GLN  57           2HG      GLN  57  -6.247  -4.447  17.157
  324   HE21  GLN  57          1HE2      GLN  57  -3.580  -3.349  15.150
  325   HE22  GLN  57          2HE2      GLN  57  -2.421  -3.239  16.426
  326    H    GLU  58           H        GLU  58  -6.211  -6.576  11.873
  327    HA   GLU  58           HA       GLU  58  -6.943  -9.294  12.730
  328    HB3  GLU  58           2HB      GLU  58  -8.244  -7.541  10.699
  329    HG3  GLU  58           2HG      GLU  58  -7.540  -9.361   9.291
  330    H    SER  59           H        SER  59  -6.101  -7.615   9.697
  331    HA   SER  59           HA       SER  59  -3.559  -8.749   9.403
  332    HB3  SER  59           2HB      SER  59  -5.008 -10.140   7.326
  333    HG   SER  59           HG       SER  59  -2.838 -10.464   8.545
  334    H    ILE  60           H        ILE  60  -2.516  -7.531   7.967
  335    HA   ILE  60           HA       ILE  60  -4.081  -6.223   5.840
  336    HB   ILE  60           HB       ILE  60  -1.656  -4.855   6.876
  337   HG13  ILE  60          2HG1      ILE  60  -2.977  -5.588   8.898
  338   HG21  ILE  60          1HG2      ILE  60  -3.761  -4.287   5.111
  339   HG22  ILE  60          2HG2      ILE  60  -3.990  -3.229   6.502
  340   HG23  ILE  60          3HG2      ILE  60  -2.462  -3.210   5.622
  341   HD11  ILE  60          3HD1      ILE  60  -3.413  -2.705   8.967
  342   HD12  ILE  60          1HD1      ILE  60  -2.437  -3.736  10.013
  343   HD13  ILE  60          2HD1      ILE  60  -1.788  -3.177   8.471
  344    H    VAL  61           H        VAL  61  -3.451  -6.890   3.907
  345    HA   VAL  61           HA       VAL  61  -0.592  -7.220   3.367
  346    HB   VAL  61           HB       VAL  61  -2.691  -9.290   2.713
  347   HG11  VAL  61          1HG1      VAL  61  -0.075  -8.706   1.507
  348   HG12  VAL  61          2HG1      VAL  61  -0.341 -10.395   1.947
  349   HG13  VAL  61          3HG1      VAL  61  -1.459  -9.579   0.852
  350   HG21  VAL  61          3HG2      VAL  61  -2.052  -9.819   4.849
  351   HG22  VAL  61          1HG2      VAL  61  -0.821 -10.688   3.933
  352   HG23  VAL  61          2HG2      VAL  61  -0.442  -9.125   4.657
  353    H    LYS  62           H        LYS  62  -0.027  -6.194   1.567
  354    HA   LYS  62           HA       LYS  62  -1.658  -4.630   0.028
  355    HB3  LYS  62           2HB      LYS  62   0.733  -4.395  -0.084
  356    HG3  LYS  62           2HG      LYS  62   1.028  -6.837  -1.770
  357    HD3  LYS  62           2HD      LYS  62   2.735  -4.869  -1.352
  358    HE3  LYS  62           2HE      LYS  62   2.451  -5.754   1.236
  359    HZ1  LYS  62           3HZ      LYS  62   5.185  -6.519   0.754
  360    HZ2  LYS  62           1HZ      LYS  62   4.056  -7.628   0.154
  361    HZ3  LYS  62           2HZ      LYS  62   4.037  -7.204   1.791
  362    H    ASP  63           H        ASP  63  -0.572  -7.926  -0.772
  363    HA   ASP  63           HA       ASP  63  -1.886  -8.214  -3.197
  364    HB3  ASP  63           2HB      ASP  63  -1.636 -10.580  -2.920
  365    H    LYS  64           H        LYS  64  -3.090  -8.757   0.082
  366    HA   LYS  64           HA       LYS  64  -5.707  -9.536  -0.902
  367    HB3  LYS  64           2HB      LYS  64  -6.248 -10.065   1.329
  368    HG3  LYS  64           2HG      LYS  64  -4.233 -11.193   2.306
  369    HD3  LYS  64           2HD      LYS  64  -4.827 -11.679  -0.614
  370    HE3  LYS  64           2HE      LYS  64  -4.265 -14.101   0.421
  371    HZ1  LYS  64           3HZ      LYS  64  -1.828 -13.391  -0.398
  372    HZ2  LYS  64           1HZ      LYS  64  -2.748 -12.157  -1.100
  373    HZ3  LYS  64           2HZ      LYS  64  -3.096 -13.775  -1.451
  374    H    VAL  65           H        VAL  65  -4.170  -6.670  -0.572
  375    HA   VAL  65           HA       VAL  65  -6.543  -5.206   0.350
  376    HB   VAL  65           HB       VAL  65  -3.731  -4.778   0.675
  377   HG11  VAL  65          1HG1      VAL  65  -5.192  -2.469  -0.603
  378   HG12  VAL  65          2HG1      VAL  65  -3.558  -2.433   0.063
  379   HG13  VAL  65          3HG1      VAL  65  -3.910  -3.413  -1.360
  380   HG21  VAL  65          3HG2      VAL  65  -4.882  -2.746   1.997
  381   HG22  VAL  65          1HG2      VAL  65  -6.291  -3.780   1.760
  382   HG23  VAL  65          2HG2      VAL  65  -4.869  -4.404   2.596
  383    H    PHE  66           H        PHE  66  -7.491  -3.591  -0.889
  384    HA   PHE  66           HA       PHE  66  -7.039  -3.853  -3.761
  385    HB3  PHE  66           2HB      PHE  66  -9.178  -2.169  -3.513
  386    HD1  PHE  66           1HD      PHE  66  -7.995  -5.619  -3.425
  387    HD2  PHE  66           2HD      PHE  66 -11.246  -3.054  -4.408
  388    HE1  PHE  66           1HE      PHE  66  -9.037  -7.439  -4.711
  389    HE2  PHE  66           2HE      PHE  66 -12.295  -4.871  -5.694
  390    HZ   PHE  66           HZ       PHE  66 -11.191  -7.067  -5.846
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1 -35.369  14.993 -28.671
    2    HA2  GLY   1           1HA      GLY   1 -37.489  13.818 -27.026
    3    HA3  GLY   1           2HA      GLY   1 -35.812  13.297 -27.077
    4    H    SER   2           H        SER   2 -34.741  13.693 -25.271
    5    HA   SER   2           HA       SER   2 -35.415  16.125 -23.747
    6    HB3  SER   2           2HB      SER   2 -34.915  14.890 -21.680
    7    HG   SER   2           HG       SER   2 -37.038  14.646 -23.072
    8    H    SER   3           H        SER   3 -33.625  16.833 -22.279
    9    HA   SER   3           HA       SER   3 -30.975  16.212 -23.396
   10    HB3  SER   3           2HB      SER   3 -30.712  18.303 -24.153
   11    HG   SER   3           HG       SER   3 -32.590  19.017 -24.728
   12    H    GLY   4           H        GLY   4 -30.518  14.909 -21.600
   13    HA2  GLY   4           1HA      GLY   4 -29.037  15.171 -19.653
   14    HA3  GLY   4           2HA      GLY   4 -30.136  16.421 -19.089
   15    H    SER   5           H        SER   5 -30.328  15.277 -17.100
   16    HA   SER   5           HA       SER   5 -31.925  12.809 -17.277
   17    HB3  SER   5           2HB      SER   5 -30.964  12.047 -15.304
   18    HG   SER   5           HG       SER   5 -28.660  12.859 -15.406
   19    H    SER   6           H        SER   6 -32.976  12.704 -14.767
   20    HA   SER   6           HA       SER   6 -34.754  15.054 -14.729
   21    HB3  SER   6           2HB      SER   6 -35.275  12.158 -14.044
   22    HG   SER   6           HG       SER   6 -37.482  13.136 -13.672
   23    H    GLY   7           H        GLY   7 -35.871  15.248 -12.474
   24    HA2  GLY   7           1HA      GLY   7 -35.626  15.833 -10.268
   25    HA3  GLY   7           2HA      GLY   7 -34.582  14.425 -10.132
   26    H    PHE   8           H        PHE   8 -33.720  16.141  -8.510
   27    HA   PHE   8           HA       PHE   8 -31.583  17.637  -9.878
   28    HB3  PHE   8           2HB      PHE   8 -31.696  19.166  -7.811
   29    HD1  PHE   8           1HD      PHE   8 -31.325  20.366  -9.998
   30    HD2  PHE   8           2HD      PHE   8 -35.176  19.149  -8.653
   31    HE1  PHE   8           1HE      PHE   8 -32.370  21.961 -11.553
   32    HE2  PHE   8           2HE      PHE   8 -36.226  20.741 -10.207
   33    HZ   PHE   8           HZ       PHE   8 -34.822  22.150 -11.660
   34    H    VAL   9           H        VAL   9 -30.375  15.622  -9.605
   35    HA   VAL   9           HA       VAL   9 -29.049  15.571  -6.995
   36    HB   VAL   9           HB       VAL   9 -30.833  13.734  -7.188
   37   HG11  VAL   9          1HG1      VAL   9 -30.190  11.734  -8.407
   38   HG12  VAL   9          2HG1      VAL   9 -30.319  13.107  -9.509
   39   HG13  VAL   9          3HG1      VAL   9 -28.731  12.536  -8.991
   40   HG21  VAL   9          3HG2      VAL   9 -29.321  12.061  -6.129
   41   HG22  VAL   9          1HG2      VAL   9 -27.953  13.081  -6.580
   42   HG23  VAL   9          2HG2      VAL   9 -29.172  13.686  -5.457
   43    H    LYS  10           H        LYS  10 -26.902  15.514  -7.173
   44    HA   LYS  10           HA       LYS  10 -25.724  14.547  -9.691
   45    HB3  LYS  10           2HB      LYS  10 -24.017  16.351  -9.480
   46    HG3  LYS  10           2HG      LYS  10 -26.677  17.710  -9.497
   47    HD3  LYS  10           2HD      LYS  10 -24.223  18.644 -10.041
   48    HE3  LYS  10           2HE      LYS  10 -24.221  16.877 -11.970
   49    HZ1  LYS  10           3HZ      LYS  10 -26.307  18.599 -12.783
   50    HZ2  LYS  10           1HZ      LYS  10 -25.731  17.198 -13.538
   51    HZ3  LYS  10           2HZ      LYS  10 -25.033  18.697 -13.893
   52    H    THR  11           H        THR  11 -25.359  15.075  -6.237
   53    HA   THR  11           HA       THR  11 -23.344  12.940  -6.186
   54    HB   THR  11           HB       THR  11 -21.727  14.299  -5.486
   55    HG1  THR  11           1HG      THR  11 -22.407  15.603  -3.423
   56   HG21  THR  11          3HG2      THR  11 -22.809  16.066  -6.785
   57   HG22  THR  11          1HG2      THR  11 -22.044  16.727  -5.340
   58   HG23  THR  11          2HG2      THR  11 -23.793  16.501  -5.388
   59    H    VAL  12           H        VAL  12 -22.913  12.405  -3.718
   60    HA   VAL  12           HA       VAL  12 -25.363  12.561  -2.143
   61    HB   VAL  12           HB       VAL  12 -25.329  10.448  -3.648
   62   HG11  VAL  12          1HG1      VAL  12 -23.919   8.730  -3.178
   63   HG12  VAL  12          2HG1      VAL  12 -22.872  10.063  -2.687
   64   HG13  VAL  12          3HG1      VAL  12 -23.782   9.162  -1.474
   65   HG21  VAL  12          3HG2      VAL  12 -26.493   9.185  -1.959
   66   HG22  VAL  12          1HG2      VAL  12 -25.725  10.120  -0.677
   67   HG23  VAL  12          2HG2      VAL  12 -26.880  10.894  -1.763
   68    H    GLU  13           H        GLU  13 -22.666  13.642  -1.889
   69    HA   GLU  13           HA       GLU  13 -20.823  13.618  -0.482
   70    HB3  GLU  13           2HB      GLU  13 -21.465  14.386   1.611
   71    HG3  GLU  13           2HG      GLU  13 -23.857  15.316   1.412
   72    H    ASP  14           H        ASP  14 -19.775  11.669  -0.906
   73    HA   ASP  14           HA       ASP  14 -19.893   9.756   1.276
   74    HB3  ASP  14           2HB      ASP  14 -19.705   8.105  -0.982
   75    H    LYS  15           H        LYS  15 -17.897   9.227   1.869
   76    HA   LYS  15           HA       LYS  15 -15.787   8.834  -0.048
   77    HB3  LYS  15           2HB      LYS  15 -15.391  11.118  -0.003
   78    HG3  LYS  15           2HG      LYS  15 -17.081  11.515   1.879
   79    HD3  LYS  15           2HD      LYS  15 -14.530  11.146   3.434
   80    HE3  LYS  15           2HE      LYS  15 -15.487  13.311   4.043
   81    HZ1  LYS  15           3HZ      LYS  15 -17.876  12.340   3.456
   82    HZ2  LYS  15           1HZ      LYS  15 -17.655  13.655   4.498
   83    HZ3  LYS  15           2HZ      LYS  15 -17.903  12.106   5.131
   84    H    TYR  16           H        TYR  16 -13.649   8.414   1.180
   85    HA   TYR  16           HA       TYR  16 -14.299   6.862   3.598
   86    HB3  TYR  16           2HB      TYR  16 -12.563   5.315   3.004
   87    HD1  TYR  16           1HD      TYR  16 -13.337   6.631  -0.355
   88    HD2  TYR  16           2HD      TYR  16 -14.389   3.818   2.658
   89    HE1  TYR  16           1HE      TYR  16 -14.792   5.465  -1.959
   90    HE2  TYR  16           2HE      TYR  16 -15.846   2.644   1.064
   91    HH   TYR  16           HH       TYR  16 -16.178   3.768  -2.293
   92    H    LYS  17           H        LYS  17 -12.316   6.495   5.021
   93    HA   LYS  17           HA       LYS  17 -10.408   8.682   5.033
   94    HB3  LYS  17           2HB      LYS  17 -12.604   8.384   7.041
   95    HG3  LYS  17           2HG      LYS  17 -10.866  10.188   8.193
   96    HD3  LYS  17           2HD      LYS  17 -10.485   8.016   9.732
   97    HE3  LYS  17           2HE      LYS  17 -12.450  10.114   9.534
   98    HZ1  LYS  17           3HZ      LYS  17 -13.728   7.777   9.573
   99    HZ2  LYS  17           1HZ      LYS  17 -14.317   9.177  10.320
  100    HZ3  LYS  17           2HZ      LYS  17 -13.499   8.012  11.232
  101    H    CYS  18           H        CYS  18  -8.518   8.183   6.064
  102    HA   CYS  18           HA       CYS  18  -7.920   5.466   6.506
  103    HB3  CYS  18           2HB      CYS  18  -6.421   7.985   7.242
  104    H    GLU  19           H        GLU  19  -7.734   4.248   8.331
  105    HA   GLU  19           HA       GLU  19  -9.129   5.216  10.675
  106    HB3  GLU  19           2HB      GLU  19  -8.311   2.742  11.386
  107    HG3  GLU  19           2HG      GLU  19 -10.400   1.895  10.774
  108    H    LYS  20           H        LYS  20  -6.434   6.261   9.917
  109    HA   LYS  20           HA       LYS  20  -5.126   5.754  12.501
  110    HB3  LYS  20           2HB      LYS  20  -3.182   6.443  10.501
  111    HG3  LYS  20           2HG      LYS  20  -3.630   4.135  12.344
  112    HD3  LYS  20           2HD      LYS  20  -1.308   4.336  10.436
  113    HE3  LYS  20           2HE      LYS  20  -0.741   2.161  11.198
  114    HZ1  LYS  20           3HZ      LYS  20  -1.456   3.050  13.829
  115    HZ2  LYS  20           1HZ      LYS  20  -0.746   4.274  12.902
  116    HZ3  LYS  20           2HZ      LYS  20   0.074   2.815  13.149
  117    H    CYS  21           H        CYS  21  -4.732   7.880   9.661
  118    HA   CYS  21           HA       CYS  21  -4.362  10.143  11.485
  119    HB3  CYS  21           2HB      CYS  21  -2.592   9.981   9.899
  120    H    HIS  22           H        HIS  22  -6.869   8.694  10.055
  121    HA   HIS  22           HA       HIS  22  -8.981   9.308   9.473
  122    HB3  HIS  22           2HB      HIS  22  -9.853  10.702  10.994
  123    HD2  HIS  22           2HD      HIS  22  -7.681   9.002  12.525
  124    HE1  HIS  22           1HE      HIS  22  -6.345  12.649  14.232
  125    HE2  HIS  22           2HE      HIS  22  -6.250  10.135  14.357
  126    H    LEU  23           H        LEU  23  -6.714   9.856   7.662
  127    HA   LEU  23           HA       LEU  23  -7.226  12.308   6.298
  128    HB3  LEU  23           2HB      LEU  23  -5.987  10.689   4.463
  129    HG   LEU  23           HG       LEU  23  -4.814  12.444   6.588
  130   HD11  LEU  23          1HD1      LEU  23  -2.840  11.758   4.664
  131   HD12  LEU  23          2HD1      LEU  23  -3.457  10.270   5.382
  132   HD13  LEU  23          3HD1      LEU  23  -2.801  11.541   6.415
  133   HD21  LEU  23          3HD2      LEU  23  -5.516  12.621   3.739
  134   HD22  LEU  23          1HD2      LEU  23  -3.968  13.342   4.180
  135   HD23  LEU  23          2HD2      LEU  23  -5.447  13.878   4.975
  136    H    VAL  24           H        VAL  24  -8.922  12.744   5.069
  137    HA   VAL  24           HA       VAL  24 -10.781  10.761   4.238
  138    HB   VAL  24           HB       VAL  24 -10.502  13.693   3.628
  139   HG11  VAL  24          1HG1      VAL  24 -11.482  13.085   1.645
  140   HG12  VAL  24          2HG1      VAL  24 -12.277  11.672   2.343
  141   HG13  VAL  24          3HG1      VAL  24 -12.909  13.289   2.660
  142   HG21  VAL  24          3HG2      VAL  24 -11.495  13.696   5.648
  143   HG22  VAL  24          1HG2      VAL  24 -12.950  13.301   4.732
  144   HG23  VAL  24          2HG2      VAL  24 -12.019  12.018   5.507
  145    H    LEU  25           H        LEU  25 -10.459   9.375   2.634
  146    HA   LEU  25           HA       LEU  25  -9.071  10.325   0.215
  147    HB3  LEU  25           2HB      LEU  25  -7.599   8.686   0.415
  148    HG   LEU  25           HG       LEU  25  -9.049   8.141   2.952
  149   HD11  LEU  25          1HD1      LEU  25  -8.431   6.018   3.197
  150   HD12  LEU  25          2HD1      LEU  25  -6.815   6.334   2.566
  151   HD13  LEU  25          3HD1      LEU  25  -8.144   6.001   1.457
  152   HD21  LEU  25          3HD2      LEU  25  -7.325   9.809   2.954
  153   HD22  LEU  25          1HD2      LEU  25  -6.189   8.702   2.181
  154   HD23  LEU  25          2HD2      LEU  25  -6.735   8.395   3.831
  155    H    CYS  26           H        CYS  26  -9.592   8.889  -1.723
  156    HA   CYS  26           HA       CYS  26 -12.498   8.470  -1.775
  157    HB3  CYS  26           2HB      CYS  26 -11.779   8.388  -4.384
  158    H    SER  27           H        SER  27  -9.421   6.924  -2.394
  159    HA   SER  27           HA       SER  27 -10.836   4.364  -2.694
  160    HB3  SER  27           2HB      SER  27  -8.685   5.515  -4.443
  161    HG   SER  27           HG       SER  27  -8.990   2.975  -5.050
  162    HA   PRO  28           HA       PRO  28  -7.725   4.147   0.719
  163    HB3  PRO  28           2HB      PRO  28  -9.365   4.500   2.288
  164    HG3  PRO  28           2HG      PRO  28 -11.594   4.028   1.822
  165    HD3  PRO  28           2HD      PRO  28 -11.058   5.285  -0.034
  166    H    LYS  29           H        LYS  29  -7.659   1.860   2.197
  167    HA   LYS  29           HA       LYS  29  -7.438  -0.295   0.201
  168    HB3  LYS  29           2HB      LYS  29  -5.350  -0.970   1.046
  169    HG3  LYS  29           2HG      LYS  29  -3.886   0.956   1.027
  170    HD3  LYS  29           2HD      LYS  29  -5.954   1.857  -0.888
  171    HE3  LYS  29           2HE      LYS  29  -3.243   0.773  -1.534
  172    HZ1  LYS  29           3HZ      LYS  29  -4.720   1.525  -3.315
  173    HZ2  LYS  29           1HZ      LYS  29  -3.325   2.477  -3.217
  174    HZ3  LYS  29           2HZ      LYS  29  -4.793   3.064  -2.616
  175    H    GLN  30           H        GLN  30  -9.727  -0.334   1.402
  176    HA   GLN  30           HA       GLN  30 -10.213  -1.188   3.907
  177    HB3  GLN  30           2HB      GLN  30 -11.492  -2.808   1.760
  178    HG3  GLN  30           2HG      GLN  30 -12.658  -1.128   3.968
  179   HE21  GLN  30          1HE2      GLN  30 -14.869  -1.595   4.395
  180   HE22  GLN  30          2HE2      GLN  30 -15.911  -2.142   3.131
  181    H    THR  31           H        THR  31  -9.027  -2.532   5.100
  182    HA   THR  31           HA       THR  31  -7.488  -4.667   4.108
  183    HB   THR  31           HB       THR  31  -7.052  -5.270   6.374
  184    HG1  THR  31           1HG      THR  31  -8.983  -3.547   7.440
  185   HG21  THR  31          3HG2      THR  31  -7.535  -2.302   6.501
  186   HG22  THR  31          1HG2      THR  31  -6.247  -3.008   5.527
  187   HG23  THR  31          2HG2      THR  31  -6.257  -3.237   7.276
  188    H    GLU  32           H        GLU  32  -8.010  -6.807   5.803
  189    HA   GLU  32           HA       GLU  32 -10.321  -7.967   4.466
  190    HB3  GLU  32           2HB      GLU  32  -8.803  -9.635   6.358
  191    HG3  GLU  32           2HG      GLU  32  -8.927 -10.194   3.454
  192    H    CYS  33           H        CYS  33 -10.237  -6.061   6.928
  193    HA   CYS  33           HA       CYS  33 -12.018  -7.684   8.625
  194    HB3  CYS  33           2HB      CYS  33  -9.846  -6.866   9.661
  195    H    GLY  34           H        GLY  34 -11.560  -4.671   6.920
  196    HA2  GLY  34           1HA      GLY  34 -13.845  -3.904   6.051
  197    HA3  GLY  34           2HA      GLY  34 -14.246  -3.791   7.759
  198    H    HIS  35           H        HIS  35 -12.039  -2.657   8.854
  199    HA   HIS  35           HA       HIS  35 -12.378   0.043   8.458
  200    HB3  HIS  35           2HB      HIS  35 -10.146   0.315   9.564
  201    HD2  HIS  35           2HD      HIS  35 -12.238   1.090  11.378
  202    HE1  HIS  35           1HE      HIS  35 -12.332  -2.684  13.314
  203    HE2  HIS  35           2HE      HIS  35 -13.136  -0.297  13.368
  204    H    ARG  36           H        ARG  36 -10.626   1.611   7.725
  205    HA   ARG  36           HA       ARG  36  -9.283   0.661   5.291
  206    HB3  ARG  36           2HB      ARG  36  -9.954   2.933   4.280
  207    HG3  ARG  36           2HG      ARG  36 -11.617   0.525   4.542
  208    HD3  ARG  36           2HD      ARG  36 -13.056   2.349   2.905
  209    HE   ARG  36           HE       ARG  36 -13.771   0.323   4.485
  210   HH11  ARG  36          1HH1      ARG  36 -14.666   3.687   4.534
  211   HH12  ARG  36          2HH1      ARG  36 -16.239   3.393   5.200
  212   HH21  ARG  36          1HH2      ARG  36 -15.838  -0.077   5.363
  213   HH22  ARG  36          2HH2      ARG  36 -16.904   1.253   5.671
  214    H    PHE  37           H        PHE  37  -7.536   2.040   4.567
  215    HA   PHE  37           HA       PHE  37  -6.559   4.003   6.493
  216    HB3  PHE  37           2HB      PHE  37  -4.244   2.875   6.280
  217    HD1  PHE  37           1HD      PHE  37  -6.731   0.356   7.292
  218    HD2  PHE  37           2HD      PHE  37  -4.183   3.521   8.560
  219    HE1  PHE  37           1HE      PHE  37  -7.124  -0.272   9.639
  220    HE2  PHE  37           2HE      PHE  37  -4.571   2.898  10.908
  221    HZ   PHE  37           HZ       PHE  37  -6.042   0.999  11.451
  222    H    CYS  38           H        CYS  38  -4.431   4.988   5.623
  223    HA   CYS  38           HA       CYS  38  -4.895   5.625   2.804
  224    HB3  CYS  38           2HB      CYS  38  -4.769   7.464   4.492
  225    H    GLU  39           H        GLU  39  -2.860   6.121   1.514
  226    HA   GLU  39           HA       GLU  39  -1.417   3.853   1.015
  227    HB3  GLU  39           2HB      GLU  39   0.387   5.775   0.292
  228    HG3  GLU  39           2HG      GLU  39  -2.088   5.524  -1.346
  229    H    SER  40           H        SER  40  -0.078   6.682   2.733
  230    HA   SER  40           HA       SER  40   2.302   5.595   3.556
  231    HB3  SER  40           2HB      SER  40   1.738   7.138   5.705
  232    HG   SER  40           HG       SER  40   2.516   7.774   3.084
  233    H    CYS  41           H        CYS  41  -0.142   6.090   6.053
  234    HA   CYS  41           HA       CYS  41   0.645   4.379   7.935
  235    HB3  CYS  41           2HB      CYS  41  -1.753   3.980   8.521
  236    H    MET  42           H        MET  42  -1.329   3.374   5.149
  237    HA   MET  42           HA       MET  42  -1.601   0.691   5.730
  238    HB3  MET  42           2HB      MET  42  -1.286   2.079   3.069
  239    HG3  MET  42           2HG      MET  42  -0.898  -0.554   3.249
  240    HE1  MET  42           3HE      MET  42  -2.576  -1.065   5.568
  241    HE2  MET  42           1HE      MET  42  -3.541   0.373   5.233
  242    HE3  MET  42           2HE      MET  42  -4.327  -1.198   5.392
  243    H    ALA  43           H        ALA  43   0.998   2.217   3.828
  244    HA   ALA  43           HA       ALA  43   2.494  -0.156   3.476
  245    HB1  ALA  43           3HB      ALA  43   3.054   1.460   1.941
  246    HB2  ALA  43           1HB      ALA  43   3.055   2.754   3.141
  247    HB3  ALA  43           2HB      ALA  43   4.389   1.602   3.084
  248    H    ALA  44           H        ALA  44   2.178   2.031   6.115
  249    HA   ALA  44           HA       ALA  44   4.681   1.435   7.373
  250    HB1  ALA  44           3HB      ALA  44   3.179   2.373   9.401
  251    HB2  ALA  44           1HB      ALA  44   3.986   3.405   8.221
  252    HB3  ALA  44           2HB      ALA  44   2.278   3.011   8.025
  253    H    LEU  45           H        LEU  45   1.327   0.372   7.868
  254    HA   LEU  45           HA       LEU  45   1.866  -1.339  10.045
  255    HB3  LEU  45           2HB      LEU  45  -0.318  -2.345   9.534
  256    HG   LEU  45           HG       LEU  45  -0.361   0.662   9.292
  257   HD11  LEU  45          1HD1      LEU  45  -2.418  -0.493   8.433
  258   HD12  LEU  45          2HD1      LEU  45  -2.680   0.591   9.798
  259   HD13  LEU  45          3HD1      LEU  45  -2.638  -1.154  10.054
  260   HD21  LEU  45          3HD2      LEU  45  -0.048  -1.225  11.506
  261   HD22  LEU  45          1HD2      LEU  45  -1.310  -0.019  11.758
  262   HD23  LEU  45          2HD2      LEU  45   0.342   0.492  11.411
  263    H    LEU  46           H        LEU  46   1.694  -1.917   6.554
  264    HA   LEU  46           HA       LEU  46   1.960  -4.690   6.571
  265    HB3  LEU  46           2HB      LEU  46   2.856  -4.438   4.288
  266    HG   LEU  46           HG       LEU  46   0.488  -2.688   4.913
  267   HD11  LEU  46          1HD1      LEU  46   0.177  -3.127   2.317
  268   HD12  LEU  46          2HD1      LEU  46   1.939  -3.113   2.363
  269   HD13  LEU  46          3HD1      LEU  46   1.032  -1.713   2.934
  270   HD21  LEU  46          3HD2      LEU  46  -0.600  -4.619   4.944
  271   HD22  LEU  46          1HD2      LEU  46   0.896  -5.491   4.614
  272   HD23  LEU  46          2HD2      LEU  46  -0.102  -4.919   3.278
  273    H    SER  47           H        SER  47   4.278  -2.215   7.221
  274    HA   SER  47           HA       SER  47   6.515  -4.085   6.988
  275    HB3  SER  47           2HB      SER  47   7.042  -1.345   7.956
  276    HG   SER  47           HG       SER  47   8.614  -2.931   7.183
  277    H    SER  48           H        SER  48   4.470  -4.358   9.066
  278    HA   SER  48           HA       SER  48   6.071  -3.814  11.473
  279    HB3  SER  48           2HB      SER  48   3.127  -4.499  11.347
  280    HG   SER  48           HG       SER  48   3.153  -4.127  13.448
  281    H    SER  49           H        SER  49   6.330  -6.076   9.531
  282    HA   SER  49           HA       SER  49   6.517  -8.356   9.494
  283    HB3  SER  49           2HB      SER  49   7.220  -7.822  12.392
  284    HG   SER  49           HG       SER  49   7.657 -10.041  10.692
  285    H    SER  50           H        SER  50   3.874  -7.169  10.367
  286    HA   SER  50           HA       SER  50   2.345  -9.414  10.575
  287    HB3  SER  50           2HB      SER  50   3.353  -8.519  13.262
  288    HG   SER  50           HG       SER  50   1.603  -9.467  14.228
  289    HA   PRO  51           HA       PRO  51   0.292  -5.210  10.441
  290    HB3  PRO  51           2HB      PRO  51   0.889  -4.836   8.254
  291    HG3  PRO  51           2HG      PRO  51   1.439  -6.601   6.842
  292    HD3  PRO  51           2HD      PRO  51   2.774  -7.109   8.651
  293    H    LYS  52           H        LYS  52  -1.585  -5.217  11.491
  294    HA   LYS  52           HA       LYS  52  -3.557  -7.309  10.847
  295    HB3  LYS  52           2HB      LYS  52  -4.221  -7.404  13.074
  296    HG3  LYS  52           2HG      LYS  52  -1.407  -7.427  12.661
  297    HD3  LYS  52           2HD      LYS  52  -2.303  -6.332  15.327
  298    HE3  LYS  52           2HE      LYS  52   0.553  -6.808  14.766
  299    HZ1  LYS  52           3HZ      LYS  52  -0.851  -7.657  17.193
  300    HZ2  LYS  52           1HZ      LYS  52  -0.685  -5.999  16.907
  301    HZ3  LYS  52           2HZ      LYS  52   0.688  -6.978  17.020
  302    H    CYS  53           H        CYS  53  -3.666  -4.154  12.501
  303    HA   CYS  53           HA       CYS  53  -4.849  -2.537  10.724
  304    HB3  CYS  53           2HB      CYS  53  -6.823  -4.568  11.691
  305    H    THR  54           H        THR  54  -4.053  -0.948  12.017
  306    HA   THR  54           HA       THR  54  -3.945  -0.551  14.638
  307    HB   THR  54           HB       THR  54  -4.097   1.209  12.401
  308    HG1  THR  54           1HG      THR  54  -3.180   2.494  14.497
  309   HG21  THR  54          3HG2      THR  54  -5.625   2.148  14.830
  310   HG22  THR  54          1HG2      THR  54  -6.255   1.956  13.195
  311   HG23  THR  54          2HG2      THR  54  -5.053   3.201  13.535
  312    H    ALA  55           H        ALA  55  -6.912  -0.079  12.750
  313    HA   ALA  55           HA       ALA  55  -8.603   0.899  14.684
  314    HB1  ALA  55           3HB      ALA  55  -8.879  -0.162  12.111
  315    HB2  ALA  55           1HB      ALA  55  -9.990  -1.079  13.129
  316    HB3  ALA  55           2HB      ALA  55 -10.103   0.679  13.062
  317    H    CYS  56           H        CYS  56  -8.911  -2.504  13.744
  318    HA   CYS  56           HA       CYS  56  -9.292  -3.164  16.590
  319    HB3  CYS  56           2HB      CYS  56 -11.302  -3.519  15.245
  320    H    GLN  57           H        GLN  57  -7.594  -3.963  13.657
  321    HA   GLN  57           HA       GLN  57  -5.577  -5.055  13.440
  322    HB3  GLN  57           2HB      GLN  57  -4.400  -5.893  15.274
  323    HG3  GLN  57           2HG      GLN  57  -5.665  -4.379  17.266
  324   HE21  GLN  57          1HE2      GLN  57  -4.046  -2.868  14.559
  325   HE22  GLN  57          2HE2      GLN  57  -2.513  -2.677  15.333
  326    H    GLU  58           H        GLU  58  -6.272  -6.436  11.880
  327    HA   GLU  58           HA       GLU  58  -7.114  -9.099  12.789
  328    HB3  GLU  58           2HB      GLU  58  -8.334  -8.677  10.285
  329    HG3  GLU  58           2HG      GLU  58 -10.377  -8.384  12.079
  330    H    SER  59           H        SER  59  -6.228  -7.322   9.823
  331    HA   SER  59           HA       SER  59  -3.822  -8.577   9.327
  332    HB3  SER  59           2HB      SER  59  -5.470  -9.942   7.366
  333    HG   SER  59           HG       SER  59  -4.247 -11.740   8.518
  334    H    ILE  60           H        ILE  60  -2.840  -7.388   7.826
  335    HA   ILE  60           HA       ILE  60  -4.495  -6.084   5.766
  336    HB   ILE  60           HB       ILE  60  -2.038  -4.689   6.663
  337   HG13  ILE  60          2HG1      ILE  60  -3.208  -5.434   8.770
  338   HG21  ILE  60          1HG2      ILE  60  -4.220  -4.150   5.015
  339   HG22  ILE  60          2HG2      ILE  60  -4.447  -3.126   6.432
  340   HG23  ILE  60          3HG2      ILE  60  -2.951  -3.028   5.503
  341   HD11  ILE  60          3HD1      ILE  60  -2.642  -3.566   9.850
  342   HD12  ILE  60          1HD1      ILE  60  -2.073  -3.021   8.274
  343   HD13  ILE  60          2HD1      ILE  60  -3.674  -2.550   8.845
  344    H    VAL  61           H        VAL  61  -3.926  -6.705   3.799
  345    HA   VAL  61           HA       VAL  61  -1.088  -7.092   3.178
  346    HB   VAL  61           HB       VAL  61  -3.258  -9.090   2.527
  347   HG11  VAL  61          1HG1      VAL  61  -0.887 -10.207   1.738
  348   HG12  VAL  61          2HG1      VAL  61  -2.069  -9.456   0.665
  349   HG13  VAL  61          3HG1      VAL  61  -0.691  -8.524   1.251
  350   HG21  VAL  61          3HG2      VAL  61  -1.308 -10.516   3.687
  351   HG22  VAL  61          1HG2      VAL  61  -1.064  -8.972   4.504
  352   HG23  VAL  61          2HG2      VAL  61  -2.630  -9.779   4.592
  353    H    LYS  62           H        LYS  62  -0.571  -5.941   1.448
  354    HA   LYS  62           HA       LYS  62  -2.213  -4.356  -0.039
  355    HB3  LYS  62           2HB      LYS  62   0.160  -4.090  -0.197
  356    HG3  LYS  62           2HG      LYS  62   0.546  -6.484  -1.908
  357    HD3  LYS  62           2HD      LYS  62   2.432  -5.510   0.180
  358    HE3  LYS  62           2HE      LYS  62   4.090  -6.212  -1.342
  359    HZ1  LYS  62           3HZ      LYS  62   3.200  -8.466  -2.114
  360    HZ2  LYS  62           1HZ      LYS  62   1.773  -8.040  -1.309
  361    HZ3  LYS  62           2HZ      LYS  62   3.226  -8.154  -0.451
  362    H    ASP  63           H        ASP  63  -1.228  -7.673  -0.843
  363    HA   ASP  63           HA       ASP  63  -2.586  -7.859  -3.290
  364    HB3  ASP  63           2HB      ASP  63  -1.802  -9.978  -1.284
  365    H    LYS  64           H        LYS  64  -3.626  -8.584   0.012
  366    HA   LYS  64           HA       LYS  64  -6.264  -9.384  -0.885
  367    HB3  LYS  64           2HB      LYS  64  -6.703  -9.972   1.370
  368    HG3  LYS  64           2HG      LYS  64  -4.535 -11.081   2.171
  369    HD3  LYS  64           2HD      LYS  64  -5.893 -11.628  -0.447
  370    HE3  LYS  64           2HE      LYS  64  -4.252 -13.774   0.717
  371    HZ1  LYS  64           3HZ      LYS  64  -5.453 -14.139  -1.304
  372    HZ2  LYS  64           1HZ      LYS  64  -3.799 -14.147  -1.664
  373    HZ3  LYS  64           2HZ      LYS  64  -4.739 -12.794  -2.042
  374    H    VAL  65           H        VAL  65  -4.743  -6.493  -0.364
  375    HA   VAL  65           HA       VAL  65  -6.953  -5.087   0.863
  376    HB   VAL  65           HB       VAL  65  -4.180  -4.508   0.281
  377   HG11  VAL  65          1HG1      VAL  65  -6.159  -2.326  -0.368
  378   HG12  VAL  65          2HG1      VAL  65  -4.407  -2.146  -0.267
  379   HG13  VAL  65          3HG1      VAL  65  -5.121  -3.149  -1.530
  380   HG21  VAL  65          3HG2      VAL  65  -5.777  -4.388   2.429
  381   HG22  VAL  65          1HG2      VAL  65  -4.281  -3.462   2.288
  382   HG23  VAL  65          2HG2      VAL  65  -5.830  -2.695   1.936
  383    H    PHE  66           H        PHE  66  -8.348  -3.667  -0.127
  384    HA   PHE  66           HA       PHE  66  -8.227  -3.498  -3.060
  385    HB3  PHE  66           2HB      PHE  66 -10.740  -3.677  -3.063
  386    HD1  PHE  66           1HD      PHE  66  -9.679  -6.294  -0.726
  387    HD2  PHE  66           2HD      PHE  66 -10.106  -5.186  -4.814
  388    HE1  PHE  66           1HE      PHE  66  -9.338  -8.639  -1.394
  389    HE2  PHE  66           2HE      PHE  66  -9.766  -7.528  -5.488
  390    HZ   PHE  66           HZ       PHE  66  -9.382  -9.258  -3.777
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -48.264  19.127 -15.103
    2    HA2  GLY   1           1HA      GLY   1 -46.488  19.672 -13.749
    3    HA3  GLY   1           2HA      GLY   1 -47.483  20.959 -13.083
    4    H    SER   2           H        SER   2 -48.561  17.655 -12.982
    5    HA   SER   2           HA       SER   2 -48.553  17.756 -10.080
    6    HB3  SER   2           2HB      SER   2 -50.577  16.899 -10.870
    7    HG   SER   2           HG       SER   2 -50.592  15.203 -12.488
    8    H    SER   3           H        SER   3 -45.997  17.593 -11.375
    9    HA   SER   3           HA       SER   3 -44.980  14.954 -11.359
   10    HB3  SER   3           2HB      SER   3 -43.004  16.997 -10.702
   11    HG   SER   3           HG       SER   3 -43.037  16.008 -13.238
   12    H    GLY   4           H        GLY   4 -43.095  14.355  -9.852
   13    HA2  GLY   4           1HA      GLY   4 -43.966  13.746  -7.353
   14    HA3  GLY   4           2HA      GLY   4 -42.265  13.975  -7.730
   15    H    SER   5           H        SER   5 -43.840  14.586  -5.288
   16    HA   SER   5           HA       SER   5 -43.659  17.502  -5.175
   17    HB3  SER   5           2HB      SER   5 -45.698  16.563  -4.265
   18    HG   SER   5           HG       SER   5 -44.023  14.698  -3.286
   19    H    SER   6           H        SER   6 -41.200  16.517  -5.473
   20    HA   SER   6           HA       SER   6 -40.031  16.521  -2.768
   21    HB3  SER   6           2HB      SER   6 -39.698  14.520  -4.443
   22    HG   SER   6           HG       SER   6 -38.922  15.781  -6.172
   23    H    GLY   7           H        GLY   7 -38.074  17.707  -2.440
   24    HA2  GLY   7           1HA      GLY   7 -38.099  20.278  -3.616
   25    HA3  GLY   7           2HA      GLY   7 -36.846  19.644  -2.560
   26    H    PHE   8           H        PHE   8 -35.455  20.939  -4.007
   27    HA   PHE   8           HA       PHE   8 -35.093  20.371  -6.719
   28    HB3  PHE   8           2HB      PHE   8 -33.647  21.811  -4.631
   29    HD1  PHE   8           1HD      PHE   8 -32.504  20.371  -7.883
   30    HD2  PHE   8           2HD      PHE   8 -31.469  21.657  -3.961
   31    HE1  PHE   8           1HE      PHE   8 -30.159  19.761  -8.306
   32    HE2  PHE   8           2HE      PHE   8 -29.121  21.050  -4.378
   33    HZ   PHE   8           HZ       PHE   8 -28.464  20.102  -6.553
   34    H    VAL   9           H        VAL   9 -34.365  18.625  -7.724
   35    HA   VAL   9           HA       VAL   9 -33.683  16.238  -6.597
   36    HB   VAL   9           HB       VAL   9 -34.100  16.229  -8.913
   37   HG11  VAL   9          1HG1      VAL   9 -32.052  17.429 -10.280
   38   HG12  VAL   9          2HG1      VAL   9 -33.643  18.136  -9.990
   39   HG13  VAL   9          3HG1      VAL   9 -32.295  18.523  -8.919
   40   HG21  VAL   9          3HG2      VAL   9 -31.130  15.768  -8.674
   41   HG22  VAL   9          1HG2      VAL   9 -32.363  14.628  -8.138
   42   HG23  VAL   9          2HG2      VAL   9 -32.228  15.043  -9.847
   43    H    LYS  10           H        LYS  10 -32.234  16.043  -4.992
   44    HA   LYS  10           HA       LYS  10 -29.473  16.904  -5.553
   45    HB3  LYS  10           2HB      LYS  10 -30.909  18.132  -3.693
   46    HG3  LYS  10           2HG      LYS  10 -29.574  16.145  -1.927
   47    HD3  LYS  10           2HD      LYS  10 -31.713  16.877  -0.594
   48    HE3  LYS  10           2HE      LYS  10 -29.340  18.672  -1.083
   49    HZ1  LYS  10           3HZ      LYS  10 -30.173  19.027   1.478
   50    HZ2  LYS  10           1HZ      LYS  10 -31.627  19.010   0.611
   51    HZ3  LYS  10           2HZ      LYS  10 -30.413  20.116   0.205
   52    H    THR  11           H        THR  11 -27.835  15.673  -4.289
   53    HA   THR  11           HA       THR  11 -28.712  12.924  -3.712
   54    HB   THR  11           HB       THR  11 -26.004  13.175  -4.846
   55    HG1  THR  11           1HG      THR  11 -28.111  13.218  -6.710
   56   HG21  THR  11          3HG2      THR  11 -26.383  10.984  -4.977
   57   HG22  THR  11          1HG2      THR  11 -27.592  11.300  -6.221
   58   HG23  THR  11          2HG2      THR  11 -28.072  11.213  -4.526
   59    H    VAL  12           H        VAL  12 -26.509  11.747  -2.847
   60    HA   VAL  12           HA       VAL  12 -25.437  13.496  -0.731
   61    HB   VAL  12           HB       VAL  12 -26.350  10.631  -0.479
   62   HG11  VAL  12          1HG1      VAL  12 -25.571  10.784   1.866
   63   HG12  VAL  12          2HG1      VAL  12 -24.253  10.844   0.693
   64   HG13  VAL  12          3HG1      VAL  12 -24.804  12.324   1.479
   65   HG21  VAL  12          3HG2      VAL  12 -27.271  13.242   0.685
   66   HG22  VAL  12          1HG2      VAL  12 -28.202  12.046  -0.216
   67   HG23  VAL  12          2HG2      VAL  12 -27.673  11.696   1.430
   68    H    GLU  13           H        GLU  13 -23.312  13.706  -0.888
   69    HA   GLU  13           HA       GLU  13 -21.770  11.587  -2.217
   70    HB3  GLU  13           2HB      GLU  13 -20.012  13.324  -2.473
   71    HG3  GLU  13           2HG      GLU  13 -22.611  14.425  -3.492
   72    H    ASP  14           H        ASP  14 -20.277  10.440  -1.148
   73    HA   ASP  14           HA       ASP  14 -19.523  11.322   1.560
   74    HB3  ASP  14           2HB      ASP  14 -21.183   9.401   1.496
   75    H    LYS  15           H        LYS  15 -17.745   9.249   2.114
   76    HA   LYS  15           HA       LYS  15 -15.878   8.671   0.121
   77    HB3  LYS  15           2HB      LYS  15 -15.158  10.830  -0.188
   78    HG3  LYS  15           2HG      LYS  15 -16.544  12.050   1.288
   79    HD3  LYS  15           2HD      LYS  15 -14.957  10.750   3.496
   80    HE3  LYS  15           2HE      LYS  15 -15.535  13.314   3.660
   81    HZ1  LYS  15           3HZ      LYS  15 -17.851  12.950   5.064
   82    HZ2  LYS  15           1HZ      LYS  15 -18.107  12.078   3.637
   83    HZ3  LYS  15           2HZ      LYS  15 -17.703  13.718   3.564
   84    H    TYR  16           H        TYR  16 -13.686   8.068   1.105
   85    HA   TYR  16           HA       TYR  16 -14.215   6.737   3.662
   86    HB3  TYR  16           2HB      TYR  16 -12.433   5.217   3.088
   87    HD1  TYR  16           2HD      TYR  16 -13.301   6.288  -0.319
   88    HD2  TYR  16           1HD      TYR  16 -14.312   3.720   2.920
   89    HE1  TYR  16           2HE      TYR  16 -14.786   5.009  -1.805
   90    HE2  TYR  16           1HE      TYR  16 -15.800   2.433   1.442
   91    HH   TYR  16           HH       TYR  16 -16.733   2.310  -0.578
   92    H    LYS  17           H        LYS  17 -12.247   6.460   5.096
   93    HA   LYS  17           HA       LYS  17 -10.346   8.655   5.008
   94    HB3  LYS  17           2HB      LYS  17 -12.532   8.419   7.036
   95    HG3  LYS  17           2HG      LYS  17 -10.802  10.274   8.115
   96    HD3  LYS  17           2HD      LYS  17 -10.394   8.168   9.731
   97    HE3  LYS  17           2HE      LYS  17 -12.466  10.184   9.421
   98    HZ1  LYS  17           3HZ      LYS  17 -13.135   7.662  10.833
   99    HZ2  LYS  17           1HZ      LYS  17 -13.999   8.389   9.574
  100    HZ3  LYS  17           2HZ      LYS  17 -13.938   9.128  11.094
  101    H    CYS  18           H        CYS  18  -8.447   8.207   6.049
  102    HA   CYS  18           HA       CYS  18  -7.832   5.513   6.594
  103    HB3  CYS  18           2HB      CYS  18  -6.344   8.070   7.201
  104    H    GLU  19           H        GLU  19  -7.622   4.373   8.468
  105    HA   GLU  19           HA       GLU  19  -9.006   5.430  10.780
  106    HB3  GLU  19           2HB      GLU  19  -8.258   3.021  11.630
  107    HG3  GLU  19           2HG      GLU  19 -10.268   2.086  10.869
  108    H    LYS  20           H        LYS  20  -6.335   6.473   9.967
  109    HA   LYS  20           HA       LYS  20  -4.997   6.075  12.556
  110    HB3  LYS  20           2HB      LYS  20  -3.087   6.700  10.493
  111    HG3  LYS  20           2HG      LYS  20  -3.460   4.487  12.465
  112    HD3  LYS  20           2HD      LYS  20  -1.179   4.652  10.502
  113    HE3  LYS  20           2HE      LYS  20  -0.287   2.849  11.548
  114    HZ1  LYS  20           3HZ      LYS  20  -2.015   3.955  13.693
  115    HZ2  LYS  20           1HZ      LYS  20  -0.431   4.421  13.325
  116    HZ3  LYS  20           2HZ      LYS  20  -0.734   2.883  13.961
  117    H    CYS  21           H        CYS  21  -4.654   8.092   9.630
  118    HA   CYS  21           HA       CYS  21  -4.287  10.428  11.362
  119    HB3  CYS  21           2HB      CYS  21  -2.528  10.225   9.774
  120    H    HIS  22           H        HIS  22  -6.788   8.900   9.999
  121    HA   HIS  22           HA       HIS  22  -8.911   9.473   9.418
  122    HB3  HIS  22           2HB      HIS  22  -9.784  10.929  10.879
  123    HD2  HIS  22           2HD      HIS  22  -7.591   9.303  12.463
  124    HE1  HIS  22           1HE      HIS  22  -6.273  13.024  14.016
  125    HE2  HIS  22           2HE      HIS  22  -6.159  10.518  14.241
  126    H    LEU  23           H        LEU  23  -6.622  10.009   7.592
  127    HA   LEU  23           HA       LEU  23  -7.156  12.377   6.123
  128    HB3  LEU  23           2HB      LEU  23  -5.970  10.661   4.334
  129    HG   LEU  23           HG       LEU  23  -4.744  12.509   6.347
  130   HD11  LEU  23          1HD1      LEU  23  -3.426  10.263   5.244
  131   HD12  LEU  23          2HD1      LEU  23  -2.738  11.588   6.183
  132   HD13  LEU  23          3HD1      LEU  23  -2.811  11.700   4.425
  133   HD21  LEU  23          3HD2      LEU  23  -5.570  13.762   4.613
  134   HD22  LEU  23          1HD2      LEU  23  -5.304  12.489   3.421
  135   HD23  LEU  23          2HD2      LEU  23  -3.939  13.431   4.025
  136    H    VAL  24           H        VAL  24  -8.890  12.783   4.937
  137    HA   VAL  24           HA       VAL  24 -10.775  10.790   4.200
  138    HB   VAL  24           HB       VAL  24 -10.487  13.699   3.494
  139   HG11  VAL  24          1HG1      VAL  24 -11.429  12.698   1.528
  140   HG12  VAL  24          2HG1      VAL  24 -12.570  11.761   2.496
  141   HG13  VAL  24          3HG1      VAL  24 -12.719  13.517   2.409
  142   HG21  VAL  24          3HG2      VAL  24 -12.885  13.445   4.660
  143   HG22  VAL  24          1HG2      VAL  24 -12.054  12.079   5.404
  144   HG23  VAL  24          2HG2      VAL  24 -11.397  13.707   5.568
  145    H    LEU  25           H        LEU  25 -10.453   9.336   2.655
  146    HA   LEU  25           HA       LEU  25  -9.117  10.200   0.175
  147    HB3  LEU  25           2HB      LEU  25  -7.673   8.535   0.370
  148    HG   LEU  25           HG       LEU  25  -9.022   8.133   2.993
  149   HD11  LEU  25          1HD1      LEU  25  -8.098   5.939   1.555
  150   HD12  LEU  25          2HD1      LEU  25  -8.408   6.021   3.289
  151   HD13  LEU  25          3HD1      LEU  25  -6.789   6.338   2.667
  152   HD21  LEU  25          3HD2      LEU  25  -6.667   8.445   3.757
  153   HD22  LEU  25          1HD2      LEU  25  -7.330   9.815   2.865
  154   HD23  LEU  25          2HD2      LEU  25  -6.211   8.707   2.073
  155    H    CYS  26           H        CYS  26  -9.714   8.821  -1.736
  156    HA   CYS  26           HA       CYS  26 -12.594   8.212  -1.637
  157    HB3  CYS  26           2HB      CYS  26 -11.024   8.894  -4.121
  158    H    SER  27           H        SER  27  -9.576   6.815  -1.881
  159    HA   SER  27           HA       SER  27 -10.734   4.288  -2.716
  160    HB3  SER  27           2HB      SER  27 -10.015   5.228  -4.851
  161    HG   SER  27           HG       SER  27  -8.405   6.641  -4.203
  162    HA   PRO  28           HA       PRO  28  -7.567   4.069   0.688
  163    HB3  PRO  28           2HB      PRO  28  -9.155   4.413   2.312
  164    HG3  PRO  28           2HG      PRO  28 -11.401   3.969   1.907
  165    HD3  PRO  28           2HD      PRO  28 -10.910   5.250   0.055
  166    H    LYS  29           H        LYS  29  -7.478   1.760   2.128
  167    HA   LYS  29           HA       LYS  29  -7.324  -0.361   0.088
  168    HB3  LYS  29           2HB      LYS  29  -5.220  -1.042   0.828
  169    HG3  LYS  29           2HG      LYS  29  -3.751   0.844   0.885
  170    HD3  LYS  29           2HD      LYS  29  -5.879   2.065  -0.751
  171    HE3  LYS  29           2HE      LYS  29  -3.009   1.421  -0.909
  172    HZ1  LYS  29           3HZ      LYS  29  -4.572   0.438  -2.925
  173    HZ2  LYS  29           1HZ      LYS  29  -2.914   0.767  -3.014
  174    HZ3  LYS  29           2HZ      LYS  29  -4.036   1.927  -3.522
  175    H    GLN  30           H        GLN  30  -9.596  -0.368   1.355
  176    HA   GLN  30           HA       GLN  30 -10.098  -1.250   3.819
  177    HB3  GLN  30           2HB      GLN  30 -11.389  -3.039   1.900
  178    HG3  GLN  30           2HG      GLN  30 -12.412  -0.831   3.667
  179   HE21  GLN  30          1HE2      GLN  30 -14.639  -2.696   4.216
  180   HE22  GLN  30          2HE2      GLN  30 -15.724  -2.516   2.884
  181    H    THR  31           H        THR  31  -9.107  -2.644   5.105
  182    HA   THR  31           HA       THR  31  -7.444  -4.742   4.144
  183    HB   THR  31           HB       THR  31  -6.956  -5.245   6.396
  184    HG1  THR  31           1HG      THR  31  -9.244  -3.776   7.236
  185   HG21  THR  31          3HG2      THR  31  -7.601  -2.443   6.989
  186   HG22  THR  31          1HG2      THR  31  -6.735  -2.690   5.474
  187   HG23  THR  31          2HG2      THR  31  -6.046  -3.272   6.990
  188    H    GLU  32           H        GLU  32  -8.170  -6.694   6.200
  189    HA   GLU  32           HA       GLU  32 -10.388  -7.965   4.759
  190    HB3  GLU  32           2HB      GLU  32  -9.006  -9.640   6.697
  191    HG3  GLU  32           2HG      GLU  32  -8.426 -10.697   4.280
  192    H    CYS  33           H        CYS  33 -10.319  -5.963   7.146
  193    HA   CYS  33           HA       CYS  33 -12.133  -7.509   8.881
  194    HB3  CYS  33           2HB      CYS  33  -9.977  -6.711   9.934
  195    H    GLY  34           H        GLY  34 -11.620  -4.568   7.075
  196    HA2  GLY  34           1HA      GLY  34 -13.876  -3.791   6.158
  197    HA3  GLY  34           2HA      GLY  34 -14.303  -3.627   7.855
  198    H    HIS  35           H        HIS  35 -12.083  -2.497   8.946
  199    HA   HIS  35           HA       HIS  35 -12.385   0.194   8.508
  200    HB3  HIS  35           2HB      HIS  35 -10.132   0.457   9.581
  201    HD2  HIS  35           2HD      HIS  35 -12.295   1.275  11.336
  202    HE1  HIS  35           1HE      HIS  35 -12.254  -2.397  13.460
  203    HE2  HIS  35           2HE      HIS  35 -13.139  -0.041  13.398
  204    H    ARG  36           H        ARG  36 -10.349   1.629   7.870
  205    HA   ARG  36           HA       ARG  36  -9.107   0.664   5.415
  206    HB3  ARG  36           2HB      ARG  36  -9.783   2.832   4.269
  207    HG3  ARG  36           2HG      ARG  36 -11.644   0.594   4.844
  208    HD3  ARG  36           2HD      ARG  36 -12.565   2.677   2.947
  209    HE   ARG  36           HE       ARG  36 -14.159   1.024   3.043
  210   HH11  ARG  36          1HH1      ARG  36 -13.295   2.013   6.266
  211   HH12  ARG  36          2HH1      ARG  36 -14.587   1.139   7.021
  212   HH21  ARG  36          1HH2      ARG  36 -15.864  -0.130   4.025
  213   HH22  ARG  36          2HH2      ARG  36 -16.048  -0.080   5.745
  214    H    PHE  37           H        PHE  37  -7.384   2.076   4.648
  215    HA   PHE  37           HA       PHE  37  -6.436   4.082   6.542
  216    HB3  PHE  37           2HB      PHE  37  -4.107   2.981   6.367
  217    HD1  PHE  37           2HD      PHE  37  -6.443   0.357   7.404
  218    HD2  PHE  37           1HD      PHE  37  -4.193   3.754   8.636
  219    HE1  PHE  37           2HE      PHE  37  -6.842  -0.236   9.759
  220    HE2  PHE  37           1HE      PHE  37  -4.588   3.165  10.992
  221    HZ   PHE  37           HZ       PHE  37  -5.915   1.170  11.556
  222    H    CYS  38           H        CYS  38  -4.361   5.121   5.669
  223    HA   CYS  38           HA       CYS  38  -4.808   5.681   2.835
  224    HB3  CYS  38           2HB      CYS  38  -4.705   7.550   4.496
  225    H    GLU  39           H        GLU  39  -2.816   6.131   1.504
  226    HA   GLU  39           HA       GLU  39  -1.339   3.898   1.044
  227    HB3  GLU  39           2HB      GLU  39   0.465   5.757   0.276
  228    HG3  GLU  39           2HG      GLU  39  -2.098   5.647  -1.247
  229    H    SER  40           H        SER  40  -0.014   6.739   2.754
  230    HA   SER  40           HA       SER  40   2.362   5.657   3.596
  231    HB3  SER  40           2HB      SER  40   1.589   7.224   5.757
  232    HG   SER  40           HG       SER  40   3.340   8.037   4.939
  233    H    CYS  41           H        CYS  41  -0.059   6.194   6.100
  234    HA   CYS  41           HA       CYS  41   0.718   4.477   7.982
  235    HB3  CYS  41           2HB      CYS  41  -1.659   4.152   8.626
  236    H    MET  42           H        MET  42  -1.303   3.498   5.222
  237    HA   MET  42           HA       MET  42  -1.635   0.827   5.812
  238    HB3  MET  42           2HB      MET  42  -1.327   2.246   3.172
  239    HG3  MET  42           2HG      MET  42  -0.688  -0.101   2.833
  240    HE1  MET  42           3HE      MET  42  -4.651  -1.021   4.947
  241    HE2  MET  42           1HE      MET  42  -3.510   0.201   5.512
  242    HE3  MET  42           2HE      MET  42  -4.319   0.402   3.957
  243    H    ALA  43           H        ALA  43   0.955   2.212   3.784
  244    HA   ALA  43           HA       ALA  43   2.403  -0.151   3.435
  245    HB1  ALA  43           3HB      ALA  43   4.303   1.311   2.863
  246    HB2  ALA  43           1HB      ALA  43   2.806   1.804   2.069
  247    HB3  ALA  43           2HB      ALA  43   3.397   2.696   3.472
  248    H    ALA  44           H        ALA  44   2.377   2.159   6.069
  249    HA   ALA  44           HA       ALA  44   4.744   1.339   7.359
  250    HB1  ALA  44           3HB      ALA  44   2.823   2.197   9.283
  251    HB2  ALA  44           1HB      ALA  44   4.227   3.061   8.655
  252    HB3  ALA  44           2HB      ALA  44   2.670   3.194   7.837
  253    H    LEU  45           H        LEU  45   1.348   0.456   8.003
  254    HA   LEU  45           HA       LEU  45   1.864  -1.402  10.028
  255    HB3  LEU  45           2HB      LEU  45  -0.364  -2.257   9.601
  256    HG   LEU  45           HG       LEU  45  -0.300   0.734   9.211
  257   HD11  LEU  45          1HD1      LEU  45  -2.631   0.706   9.914
  258   HD12  LEU  45          2HD1      LEU  45  -2.610  -1.056   9.954
  259   HD13  LEU  45          3HD1      LEU  45  -2.412  -0.208   8.421
  260   HD21  LEU  45          3HD2      LEU  45   0.125   0.859  11.384
  261   HD22  LEU  45          1HD2      LEU  45   0.317  -0.893  11.424
  262   HD23  LEU  45          2HD2      LEU  45  -1.260  -0.172  11.748
  263    H    LEU  46           H        LEU  46   1.512  -1.868   6.525
  264    HA   LEU  46           HA       LEU  46   1.686  -4.626   6.411
  265    HB3  LEU  46           2HB      LEU  46   2.631  -4.293   4.135
  266    HG   LEU  46           HG       LEU  46   0.330  -2.429   4.718
  267   HD11  LEU  46          1HD1      LEU  46   1.582  -3.407   2.187
  268   HD12  LEU  46          2HD1      LEU  46   1.021  -1.790   2.611
  269   HD13  LEU  46          3HD1      LEU  46  -0.147  -3.060   2.248
  270   HD21  LEU  46          3HD2      LEU  46  -0.599  -4.408   5.305
  271   HD22  LEU  46          1HD2      LEU  46   0.572  -5.356   4.387
  272   HD23  LEU  46          2HD2      LEU  46  -0.774  -4.574   3.558
  273    H    SER  47           H        SER  47   4.201  -2.256   6.920
  274    HA   SER  47           HA       SER  47   6.296  -4.273   6.696
  275    HB3  SER  47           2HB      SER  47   7.174  -1.677   7.661
  276    HG   SER  47           HG       SER  47   7.641  -2.827   5.124
  277    H    SER  48           H        SER  48   4.289  -4.409   8.825
  278    HA   SER  48           HA       SER  48   5.968  -3.944  11.195
  279    HB3  SER  48           2HB      SER  48   2.987  -4.468  11.072
  280    HG   SER  48           HG       SER  48   4.003  -3.189  13.250
  281    H    SER  49           H        SER  49   6.291  -6.182   9.352
  282    HA   SER  49           HA       SER  49   6.319  -8.484   9.284
  283    HB3  SER  49           2HB      SER  49   7.281  -9.406  11.492
  284    HG   SER  49           HG       SER  49   8.373  -7.615   9.713
  285    H    SER  50           H        SER  50   3.720  -7.293  10.086
  286    HA   SER  50           HA       SER  50   2.137  -9.448  10.398
  287    HB3  SER  50           2HB      SER  50   2.843 -10.311  12.392
  288    HG   SER  50           HG       SER  50   3.501  -7.675  13.218
  289    HA   PRO  51           HA       PRO  51   0.221  -5.178  10.376
  290    HB3  PRO  51           2HB      PRO  51   0.763  -4.795   8.176
  291    HG3  PRO  51           2HG      PRO  51   1.210  -6.558   6.727
  292    HD3  PRO  51           2HD      PRO  51   2.583  -7.133   8.487
  293    H    LYS  52           H        LYS  52  -1.614  -5.146  11.495
  294    HA   LYS  52           HA       LYS  52  -3.661  -7.185  10.914
  295    HB3  LYS  52           2HB      LYS  52  -4.314  -7.165  13.163
  296    HG3  LYS  52           2HG      LYS  52  -1.356  -6.945  12.906
  297    HD3  LYS  52           2HD      LYS  52  -2.527  -7.651  15.551
  298    HE3  LYS  52           2HE      LYS  52  -0.059  -6.051  15.171
  299    HZ1  LYS  52           3HZ      LYS  52  -0.637  -8.446  16.829
  300    HZ2  LYS  52           1HZ      LYS  52  -0.815  -6.849  17.359
  301    HZ3  LYS  52           2HZ      LYS  52   0.716  -7.439  16.947
  302    H    CYS  53           H        CYS  53  -3.667  -3.991  12.497
  303    HA   CYS  53           HA       CYS  53  -4.842  -2.379  10.719
  304    HB3  CYS  53           2HB      CYS  53  -6.849  -4.357  11.729
  305    H    THR  54           H        THR  54  -3.936  -0.841  12.029
  306    HA   THR  54           HA       THR  54  -3.854  -0.425  14.646
  307    HB   THR  54           HB       THR  54  -3.979   1.353  12.378
  308    HG1  THR  54           1HG      THR  54  -2.227   0.844  13.975
  309   HG21  THR  54          3HG2      THR  54  -5.211   2.364  14.944
  310   HG22  THR  54          1HG2      THR  54  -6.000   2.247  13.372
  311   HG23  THR  54          2HG2      THR  54  -4.675   3.387  13.611
  312    H    ALA  55           H        ALA  55  -6.778  -0.066  12.714
  313    HA   ALA  55           HA       ALA  55  -8.464   1.119  14.568
  314    HB1  ALA  55           3HB      ALA  55 -10.064   0.749  13.048
  315    HB2  ALA  55           1HB      ALA  55  -8.755   0.129  12.042
  316    HB3  ALA  55           2HB      ALA  55  -9.743  -0.983  12.989
  317    H    CYS  56           H        CYS  56  -8.720  -2.344  13.807
  318    HA   CYS  56           HA       CYS  56  -9.208  -2.840  16.671
  319    HB3  CYS  56           2HB      CYS  56 -11.206  -3.250  15.359
  320    H    GLN  57           H        GLN  57  -7.368  -3.696  13.878
  321    HA   GLN  57           HA       GLN  57  -5.357  -4.819  13.795
  322    HB3  GLN  57           2HB      GLN  57  -4.327  -5.690  15.700
  323    HG3  GLN  57           2HG      GLN  57  -5.926  -4.098  17.491
  324   HE21  GLN  57          1HE2      GLN  57  -3.437  -2.816  15.416
  325   HE22  GLN  57          2HE2      GLN  57  -2.168  -2.845  16.588
  326    H    GLU  58           H        GLU  58  -6.187  -6.087  12.143
  327    HA   GLU  58           HA       GLU  58  -7.001  -8.791  12.964
  328    HB3  GLU  58           2HB      GLU  58  -8.338  -6.930  11.062
  329    HG3  GLU  58           2HG      GLU  58  -7.998  -8.547   9.449
  330    H    SER  59           H        SER  59  -6.512  -7.294   9.785
  331    HA   SER  59           HA       SER  59  -3.938  -8.406   9.355
  332    HB3  SER  59           2HB      SER  59  -5.343 -10.483   9.282
  333    HG   SER  59           HG       SER  59  -6.348 -10.311   6.885
  334    H    ILE  60           H        ILE  60  -2.967  -7.408   7.680
  335    HA   ILE  60           HA       ILE  60  -4.647  -6.060   5.684
  336    HB   ILE  60           HB       ILE  60  -2.226  -4.588   6.509
  337   HG13  ILE  60          2HG1      ILE  60  -3.250  -5.383   8.674
  338   HG21  ILE  60          1HG2      ILE  60  -4.934  -4.043   5.444
  339   HG22  ILE  60          2HG2      ILE  60  -4.178  -2.776   6.410
  340   HG23  ILE  60          3HG2      ILE  60  -3.370  -3.382   4.965
  341   HD11  ILE  60          3HD1      ILE  60  -2.150  -3.008   8.210
  342   HD12  ILE  60          1HD1      ILE  60  -3.770  -2.477   8.658
  343   HD13  ILE  60          2HD1      ILE  60  -2.823  -3.461   9.776
  344    H    VAL  61           H        VAL  61  -4.111  -7.240   3.933
  345    HA   VAL  61           HA       VAL  61  -1.247  -7.428   3.258
  346    HB   VAL  61           HB       VAL  61  -3.437  -9.422   2.676
  347   HG11  VAL  61          1HG1      VAL  61  -0.734  -9.053   1.478
  348   HG12  VAL  61          2HG1      VAL  61  -1.345 -10.690   1.725
  349   HG13  VAL  61          3HG1      VAL  61  -2.245  -9.554   0.719
  350   HG21  VAL  61          3HG2      VAL  61  -2.735 -10.410   4.537
  351   HG22  VAL  61          1HG2      VAL  61  -1.140 -10.604   3.809
  352   HG23  VAL  61          2HG2      VAL  61  -1.505  -9.168   4.767
  353    H    LYS  62           H        LYS  62  -0.695  -6.333   1.502
  354    HA   LYS  62           HA       LYS  62  -2.266  -4.742  -0.033
  355    HB3  LYS  62           2HB      LYS  62   0.047  -4.490  -0.313
  356    HG3  LYS  62           2HG      LYS  62   0.558  -7.084  -1.632
  357    HD3  LYS  62           2HD      LYS  62   2.641  -6.752  -0.102
  358    HE3  LYS  62           2HE      LYS  62   1.937  -5.821  -2.694
  359    HZ1  LYS  62           3HZ      LYS  62   2.376  -3.649  -2.513
  360    HZ2  LYS  62           1HZ      LYS  62   4.000  -4.118  -2.452
  361    HZ3  LYS  62           2HZ      LYS  62   3.155  -3.809  -1.020
  362    H    ASP  63           H        ASP  63  -1.577  -8.162  -0.604
  363    HA   ASP  63           HA       ASP  63  -2.917  -8.355  -3.085
  364    HB3  ASP  63           2HB      ASP  63  -1.357 -10.039  -1.581
  365    H    LYS  64           H        LYS  64  -3.972  -8.827   0.252
  366    HA   LYS  64           HA       LYS  64  -6.658  -9.539  -0.586
  367    HB3  LYS  64           2HB      LYS  64  -7.122  -9.892   1.741
  368    HG3  LYS  64           2HG      LYS  64  -4.776 -11.050   2.423
  369    HD3  LYS  64           2HD      LYS  64  -6.661 -12.177   0.357
  370    HE3  LYS  64           2HE      LYS  64  -5.486 -13.726   2.608
  371    HZ1  LYS  64           3HZ      LYS  64  -5.850 -15.512   1.241
  372    HZ2  LYS  64           1HZ      LYS  64  -5.715 -14.611  -0.184
  373    HZ3  LYS  64           2HZ      LYS  64  -7.114 -14.498   0.759
  374    H    VAL  65           H        VAL  65  -4.944  -6.710  -0.108
  375    HA   VAL  65           HA       VAL  65  -7.133  -5.135   0.945
  376    HB   VAL  65           HB       VAL  65  -4.307  -4.771   0.630
  377   HG11  VAL  65          1HG1      VAL  65  -4.927  -3.514  -1.396
  378   HG12  VAL  65          2HG1      VAL  65  -5.972  -2.483  -0.416
  379   HG13  VAL  65          3HG1      VAL  65  -4.228  -2.479  -0.150
  380   HG21  VAL  65          3HG2      VAL  65  -4.969  -4.248   2.725
  381   HG22  VAL  65          1HG2      VAL  65  -5.142  -2.632   2.040
  382   HG23  VAL  65          2HG2      VAL  65  -6.552  -3.679   2.199
  383    H    PHE  66           H        PHE  66  -8.330  -3.613  -0.169
  384    HA   PHE  66           HA       PHE  66  -7.894  -3.190  -2.998
  385    HB3  PHE  66           2HB      PHE  66  -9.235  -4.919  -3.577
  386    HD1  PHE  66           2HD      PHE  66 -10.231  -3.867  -0.170
  387    HD2  PHE  66           1HD      PHE  66 -10.191  -6.990  -3.061
  388    HE1  PHE  66           2HE      PHE  66 -11.016  -5.453   1.538
  389    HE2  PHE  66           1HE      PHE  66 -10.978  -8.582  -1.357
  390    HZ   PHE  66           HZ       PHE  66 -11.390  -7.814   0.946
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -23.169  27.560  -3.004
    2    HA2  GLY   1           1HA      GLY   1 -22.780  29.955  -1.345
    3    HA3  GLY   1           2HA      GLY   1 -21.591  29.571  -2.580
    4    H    SER   2           H        SER   2 -21.861  30.517  -4.482
    5    HA   SER   2           HA       SER   2 -23.945  32.276  -5.046
    6    HB3  SER   2           2HB      SER   2 -22.637  31.076  -7.403
    7    HG   SER   2           HG       SER   2 -22.843  33.686  -6.310
    8    H    SER   3           H        SER   3 -23.361  29.060  -6.475
    9    HA   SER   3           HA       SER   3 -26.114  29.021  -7.456
   10    HB3  SER   3           2HB      SER   3 -24.781  26.615  -8.136
   11    HG   SER   3           HG       SER   3 -24.815  27.679 -10.245
   12    H    GLY   4           H        GLY   4 -23.922  27.122  -5.409
   13    HA2  GLY   4           1HA      GLY   4 -24.476  25.916  -3.496
   14    HA3  GLY   4           2HA      GLY   4 -26.175  26.220  -3.828
   15    H    SER   5           H        SER   5 -23.663  23.959  -3.951
   16    HA   SER   5           HA       SER   5 -24.148  22.279  -6.021
   17    HB3  SER   5           2HB      SER   5 -23.628  21.531  -3.136
   18    HG   SER   5           HG       SER   5 -23.049  19.529  -3.908
   19    H    SER   6           H        SER   6 -25.895  21.337  -6.819
   20    HA   SER   6           HA       SER   6 -28.241  20.992  -5.104
   21    HB3  SER   6           2HB      SER   6 -29.556  20.971  -7.069
   22    HG   SER   6           HG       SER   6 -28.920  22.837  -8.107
   23    H    GLY   7           H        GLY   7 -28.690  19.067  -4.277
   24    HA2  GLY   7           1HA      GLY   7 -28.509  16.660  -5.807
   25    HA3  GLY   7           2HA      GLY   7 -27.226  16.761  -4.611
   26    H    PHE   8           H        PHE   8 -30.123  15.429  -5.131
   27    HA   PHE   8           HA       PHE   8 -31.702  15.944  -2.915
   28    HB3  PHE   8           2HB      PHE   8 -31.958  13.192  -3.380
   29    HD1  PHE   8           2HD      PHE   8 -32.957  15.535  -6.022
   30    HD2  PHE   8           1HD      PHE   8 -34.079  13.644  -2.377
   31    HE1  PHE   8           2HE      PHE   8 -35.282  16.264  -6.364
   32    HE2  PHE   8           1HE      PHE   8 -36.406  14.369  -2.713
   33    HZ   PHE   8           HZ       PHE   8 -37.010  15.681  -4.708
   34    H    VAL   9           H        VAL   9 -32.136  13.905  -1.321
   35    HA   VAL   9           HA       VAL   9 -29.611  13.605   0.151
   36    HB   VAL   9           HB       VAL   9 -31.469  14.733   1.338
   37   HG11  VAL   9          1HG1      VAL   9 -33.548  13.959   1.249
   38   HG12  VAL   9          2HG1      VAL   9 -32.991  12.620   0.243
   39   HG13  VAL   9          3HG1      VAL   9 -33.042  12.446   1.998
   40   HG21  VAL   9          3HG2      VAL   9 -31.248  12.241   2.874
   41   HG22  VAL   9          1HG2      VAL   9 -29.713  12.897   2.304
   42   HG23  VAL   9          2HG2      VAL   9 -30.778  13.886   3.303
   43    H    LYS  10           H        LYS  10 -30.621  11.912  -2.117
   44    HA   LYS  10           HA       LYS  10 -30.898   9.335  -0.733
   45    HB3  LYS  10           2HB      LYS  10 -31.290   9.873  -3.678
   46    HG3  LYS  10           2HG      LYS  10 -31.920   7.586  -1.869
   47    HD3  LYS  10           2HD      LYS  10 -33.361   6.788  -3.859
   48    HE3  LYS  10           2HE      LYS  10 -33.977   7.990  -1.436
   49    HZ1  LYS  10           3HZ      LYS  10 -35.053   9.553  -3.587
   50    HZ2  LYS  10           1HZ      LYS  10 -34.997   9.889  -1.929
   51    HZ3  LYS  10           2HZ      LYS  10 -36.253   8.948  -2.560
   52    H    THR  11           H        THR  11 -28.893  11.140  -2.961
   53    HA   THR  11           HA       THR  11 -27.239   8.998  -3.794
   54    HB   THR  11           HB       THR  11 -27.453  11.689  -4.446
   55    HG1  THR  11           1HG      THR  11 -25.900  11.101  -6.024
   56   HG21  THR  11          3HG2      THR  11 -25.379  12.735  -4.078
   57   HG22  THR  11          1HG2      THR  11 -24.619  11.235  -3.548
   58   HG23  THR  11          2HG2      THR  11 -25.806  12.034  -2.517
   59    H    VAL  12           H        VAL  12 -24.771   9.155  -3.338
   60    HA   VAL  12           HA       VAL  12 -24.413   9.318  -0.416
   61    HB   VAL  12           HB       VAL  12 -24.138   7.058  -0.900
   62   HG11  VAL  12          1HG1      VAL  12 -22.572   7.831  -3.359
   63   HG12  VAL  12          2HG1      VAL  12 -22.914   6.183  -2.828
   64   HG13  VAL  12          3HG1      VAL  12 -24.233   7.241  -3.331
   65   HG21  VAL  12          3HG2      VAL  12 -22.035   8.418   0.054
   66   HG22  VAL  12          1HG2      VAL  12 -22.040   6.665  -0.140
   67   HG23  VAL  12          2HG2      VAL  12 -21.286   7.685  -1.364
   68    H    GLU  13           H        GLU  13 -23.844  11.577  -0.712
   69    HA   GLU  13           HA       GLU  13 -21.404  12.168  -2.163
   70    HB3  GLU  13           2HB      GLU  13 -21.803  14.494  -1.381
   71    HG3  GLU  13           2HG      GLU  13 -24.502  13.921  -2.269
   72    H    ASP  14           H        ASP  14 -19.908  10.901  -0.982
   73    HA   ASP  14           HA       ASP  14 -18.486  12.246   0.996
   74    HB3  ASP  14           2HB      ASP  14 -19.100  10.206   2.723
   75    H    LYS  15           H        LYS  15 -16.515  11.291   1.384
   76    HA   LYS  15           HA       LYS  15 -16.007   8.819  -0.120
   77    HB3  LYS  15           2HB      LYS  15 -13.924   9.605  -0.631
   78    HG3  LYS  15           2HG      LYS  15 -15.740  11.481  -1.054
   79    HD3  LYS  15           2HD      LYS  15 -14.528  12.347   1.355
   80    HE3  LYS  15           2HE      LYS  15 -12.827  13.242  -0.402
   81    HZ1  LYS  15           3HZ      LYS  15 -13.867  15.669  -0.834
   82    HZ2  LYS  15           1HZ      LYS  15 -15.237  14.702  -1.056
   83    HZ3  LYS  15           2HZ      LYS  15 -13.851  14.429  -1.984
   84    H    TYR  16           H        TYR  16 -13.600   8.077   1.008
   85    HA   TYR  16           HA       TYR  16 -14.510   7.051   3.594
   86    HB3  TYR  16           2HB      TYR  16 -12.655   5.410   3.324
   87    HD1  TYR  16           2HD      TYR  16 -15.678   6.420   1.945
   88    HD2  TYR  16           1HD      TYR  16 -12.661   3.457   1.470
   89    HE1  TYR  16           2HE      TYR  16 -17.303   4.954   0.824
   90    HE2  TYR  16           1HE      TYR  16 -14.278   1.982   0.347
   91    HH   TYR  16           HH       TYR  16 -16.350   2.054  -0.796
   92    H    LYS  17           H        LYS  17 -12.291   6.446   4.926
   93    HA   LYS  17           HA       LYS  17 -10.426   8.645   4.989
   94    HB3  LYS  17           2HB      LYS  17 -12.620   8.368   6.999
   95    HG3  LYS  17           2HG      LYS  17 -10.851  10.114   8.184
   96    HD3  LYS  17           2HD      LYS  17 -10.504   7.921   9.691
   97    HE3  LYS  17           2HE      LYS  17 -12.488  10.017   9.491
   98    HZ1  LYS  17           3HZ      LYS  17 -13.475   7.901  11.215
   99    HZ2  LYS  17           1HZ      LYS  17 -13.733   7.668   9.558
  100    HZ3  LYS  17           2HZ      LYS  17 -14.328   9.057  10.320
  101    H    CYS  18           H        CYS  18  -8.530   8.109   5.985
  102    HA   CYS  18           HA       CYS  18  -7.944   5.396   6.400
  103    HB3  CYS  18           2HB      CYS  18  -6.460   7.917   7.140
  104    H    GLU  19           H        GLU  19  -7.753   4.144   8.206
  105    HA   GLU  19           HA       GLU  19  -9.172   5.059  10.558
  106    HB3  GLU  19           2HB      GLU  19  -8.538   2.630  11.303
  107    HG3  GLU  19           2HG      GLU  19 -10.440   1.716  10.297
  108    H    LYS  20           H        LYS  20  -6.533   6.200   9.892
  109    HA   LYS  20           HA       LYS  20  -5.224   5.629  12.459
  110    HB3  LYS  20           2HB      LYS  20  -3.294   6.361  10.432
  111    HG3  LYS  20           2HG      LYS  20  -3.635   4.045  12.305
  112    HD3  LYS  20           2HD      LYS  20  -1.330   4.484  10.406
  113    HE3  LYS  20           2HE      LYS  20  -0.245   2.799  11.448
  114    HZ1  LYS  20           3HZ      LYS  20  -2.135   3.298  13.675
  115    HZ2  LYS  20           1HZ      LYS  20  -0.917   4.390  13.243
  116    HZ3  LYS  20           2HZ      LYS  20  -0.511   2.837  13.776
  117    H    CYS  21           H        CYS  21  -4.715   7.794   9.668
  118    HA   CYS  21           HA       CYS  21  -4.398  10.031  11.525
  119    HB3  CYS  21           2HB      CYS  21  -2.630   9.899   9.938
  120    H    HIS  22           H        HIS  22  -6.886   8.599   9.999
  121    HA   HIS  22           HA       HIS  22  -9.005   9.221   9.455
  122    HB3  HIS  22           2HB      HIS  22  -9.895  10.620  10.966
  123    HD2  HIS  22           2HD      HIS  22  -7.776   8.826  12.484
  124    HE1  HIS  22           1HE      HIS  22  -6.431  12.396  14.339
  125    HE2  HIS  22           2HE      HIS  22  -6.373   9.878  14.384
  126    H    LEU  23           H        LEU  23  -6.701   9.830   7.679
  127    HA   LEU  23           HA       LEU  23  -7.225  12.283   6.337
  128    HB3  LEU  23           2HB      LEU  23  -5.971  10.706   4.481
  129    HG   LEU  23           HG       LEU  23  -4.811  12.402   6.661
  130   HD11  LEU  23          1HD1      LEU  23  -2.825  11.744   4.735
  131   HD12  LEU  23          2HD1      LEU  23  -3.451  10.250   5.430
  132   HD13  LEU  23          3HD1      LEU  23  -2.795  11.504   6.482
  133   HD21  LEU  23          3HD2      LEU  23  -5.930  13.376   4.641
  134   HD22  LEU  23          1HD2      LEU  23  -4.659  12.641   3.663
  135   HD23  LEU  23          2HD2      LEU  23  -4.250  13.863   4.866
  136    H    VAL  24           H        VAL  24  -8.918  12.730   5.107
  137    HA   VAL  24           HA       VAL  24 -10.786  10.775   4.257
  138    HB   VAL  24           HB       VAL  24 -10.453  13.697   3.625
  139   HG11  VAL  24          1HG1      VAL  24 -12.316  11.710   2.386
  140   HG12  VAL  24          2HG1      VAL  24 -12.812  13.390   2.598
  141   HG13  VAL  24          3HG1      VAL  24 -11.393  13.004   1.623
  142   HG21  VAL  24          3HG2      VAL  24 -11.729  13.974   5.421
  143   HG22  VAL  24          1HG2      VAL  24 -12.979  12.943   4.723
  144   HG23  VAL  24          2HG2      VAL  24 -11.691  12.232   5.697
  145    H    LEU  25           H        LEU  25 -10.513   9.386   2.648
  146    HA   LEU  25           HA       LEU  25  -8.973  10.247   0.288
  147    HB3  LEU  25           2HB      LEU  25  -7.820   8.341   0.299
  148    HG   LEU  25           HG       LEU  25  -8.972   8.225   3.054
  149   HD11  LEU  25          1HD1      LEU  25  -8.694   6.028   3.197
  150   HD12  LEU  25          2HD1      LEU  25  -6.968   6.291   2.949
  151   HD13  LEU  25          3HD1      LEU  25  -8.015   5.947   1.570
  152   HD21  LEU  25          3HD2      LEU  25  -6.204   8.539   1.901
  153   HD22  LEU  25          1HD2      LEU  25  -6.562   8.430   3.625
  154   HD23  LEU  25          2HD2      LEU  25  -7.185   9.782   2.678
  155    H    CYS  26           H        CYS  26  -9.576   8.268  -1.466
  156    HA   CYS  26           HA       CYS  26 -12.509   8.336  -1.702
  157    HB3  CYS  26           2HB      CYS  26 -12.463   9.260  -3.773
  158    H    SER  27           H        SER  27  -9.791   6.467  -1.500
  159    HA   SER  27           HA       SER  27 -11.141   4.049  -1.985
  160    HB3  SER  27           2HB      SER  27 -10.945   4.699  -4.347
  161    HG   SER  27           HG       SER  27  -8.839   4.847  -5.249
  162    HA   PRO  28           HA       PRO  28  -7.322   3.826   0.587
  163    HB3  PRO  28           2HB      PRO  28  -8.568   4.127   2.494
  164    HG3  PRO  28           2HG      PRO  28 -10.834   3.612   2.541
  165    HD3  PRO  28           2HD      PRO  28 -10.759   4.900   0.631
  166    H    LYS  29           H        LYS  29  -6.880   1.525   1.976
  167    HA   LYS  29           HA       LYS  29  -6.920  -0.538  -0.129
  168    HB3  LYS  29           2HB      LYS  29  -4.776  -1.202   0.448
  169    HG3  LYS  29           2HG      LYS  29  -3.348   0.642   0.484
  170    HD3  LYS  29           2HD      LYS  29  -5.515   2.313  -0.503
  171    HE3  LYS  29           2HE      LYS  29  -2.940   2.043  -1.102
  172    HZ1  LYS  29           3HZ      LYS  29  -3.454   0.927  -3.550
  173    HZ2  LYS  29           1HZ      LYS  29  -4.185  -0.135  -2.453
  174    HZ3  LYS  29           2HZ      LYS  29  -2.541   0.237  -2.303
  175    H    GLN  30           H        GLN  30  -9.132  -0.754   1.101
  176    HA   GLN  30           HA       GLN  30  -9.621  -1.690   3.545
  177    HB3  GLN  30           2HB      GLN  30 -10.797  -3.589   1.714
  178    HG3  GLN  30           2HG      GLN  30 -11.793  -1.317   3.380
  179   HE21  GLN  30          1HE2      GLN  30 -14.006  -3.726   2.889
  180   HE22  GLN  30          2HE2      GLN  30 -15.037  -2.931   1.753
  181    H    THR  31           H        THR  31  -9.154  -3.376   4.839
  182    HA   THR  31           HA       THR  31  -7.179  -5.297   3.863
  183    HB   THR  31           HB       THR  31  -6.602  -5.731   6.108
  184    HG1  THR  31           1HG      THR  31  -8.969  -4.348   6.898
  185   HG21  THR  31          3HG2      THR  31  -7.312  -2.894   6.557
  186   HG22  THR  31          1HG2      THR  31  -6.362  -3.248   5.115
  187   HG23  THR  31          2HG2      THR  31  -5.756  -3.710   6.705
  188    H    GLU  32           H        GLU  32  -7.800  -7.202   5.998
  189    HA   GLU  32           HA       GLU  32  -9.999  -8.581   4.645
  190    HB3  GLU  32           2HB      GLU  32  -8.252  -9.835   6.734
  191    HG3  GLU  32           2HG      GLU  32  -8.470 -11.635   4.752
  192    H    CYS  33           H        CYS  33 -10.008  -6.431   6.900
  193    HA   CYS  33           HA       CYS  33 -11.840  -7.894   8.686
  194    HB3  CYS  33           2HB      CYS  33  -9.688  -7.023   9.719
  195    H    GLY  34           H        GLY  34 -11.299  -5.063   6.728
  196    HA2  GLY  34           1HA      GLY  34 -13.467  -4.276   5.704
  197    HA3  GLY  34           2HA      GLY  34 -14.033  -4.141   7.362
  198    H    HIS  35           H        HIS  35 -11.934  -2.973   8.640
  199    HA   HIS  35           HA       HIS  35 -12.266  -0.294   8.266
  200    HB3  HIS  35           2HB      HIS  35  -9.996  -0.028   9.365
  201    HD2  HIS  35           2HD      HIS  35 -12.113   0.867  11.107
  202    HE1  HIS  35           1HE      HIS  35 -12.329  -2.834  13.170
  203    HE2  HIS  35           2HE      HIS  35 -13.075  -0.429  13.128
  204    H    ARG  36           H        ARG  36 -10.475   1.306   7.623
  205    HA   ARG  36           HA       ARG  36  -9.123   0.444   5.164
  206    HB3  ARG  36           2HB      ARG  36  -9.806   2.591   4.090
  207    HG3  ARG  36           2HG      ARG  36 -11.767   0.488   4.796
  208    HD3  ARG  36           2HD      ARG  36 -13.044   2.157   2.941
  209    HE   ARG  36           HE       ARG  36 -13.784   0.853   5.244
  210   HH11  ARG  36          1HH1      ARG  36 -14.448   3.940   3.778
  211   HH12  ARG  36          2HH1      ARG  36 -16.034   4.070   4.461
  212   HH21  ARG  36          1HH2      ARG  36 -15.871   1.013   6.150
  213   HH22  ARG  36          2HH2      ARG  36 -16.843   2.405   5.812
  214    H    PHE  37           H        PHE  37  -7.507   2.089   4.414
  215    HA   PHE  37           HA       PHE  37  -6.517   3.931   6.411
  216    HB3  PHE  37           2HB      PHE  37  -4.196   2.824   6.272
  217    HD1  PHE  37           1HD      PHE  37  -6.725   0.290   7.159
  218    HD2  PHE  37           2HD      PHE  37  -4.183   3.402   8.561
  219    HE1  PHE  37           1HE      PHE  37  -7.193  -0.378   9.480
  220    HE2  PHE  37           2HE      PHE  37  -4.646   2.739  10.884
  221    HZ   PHE  37           HZ       PHE  37  -6.151   0.846  11.347
  222    H    CYS  38           H        CYS  38  -4.458   5.012   5.605
  223    HA   CYS  38           HA       CYS  38  -4.831   5.615   2.773
  224    HB3  CYS  38           2HB      CYS  38  -4.765   7.449   4.475
  225    H    GLU  39           H        GLU  39  -2.870   6.013   1.442
  226    HA   GLU  39           HA       GLU  39  -1.358   3.802   1.022
  227    HB3  GLU  39           2HB      GLU  39   0.430   5.714   0.276
  228    HG3  GLU  39           2HG      GLU  39  -2.041   5.497  -1.365
  229    H    SER  40           H        SER  40  -0.085   6.672   2.722
  230    HA   SER  40           HA       SER  40   2.306   5.649   3.581
  231    HB3  SER  40           2HB      SER  40   1.457   7.180   5.748
  232    HG   SER  40           HG       SER  40   2.528   8.884   4.489
  233    H    CYS  41           H        CYS  41  -0.158   6.095   6.063
  234    HA   CYS  41           HA       CYS  41   0.651   4.398   7.948
  235    HB3  CYS  41           2HB      CYS  41  -1.742   3.957   8.524
  236    H    MET  42           H        MET  42  -1.349   3.347   5.193
  237    HA   MET  42           HA       MET  42  -1.555   0.665   5.767
  238    HB3  MET  42           2HB      MET  42  -1.278   2.060   3.106
  239    HG3  MET  42           2HG      MET  42  -0.677  -0.304   2.826
  240    HE1  MET  42           3HE      MET  42  -3.463   0.115   5.524
  241    HE2  MET  42           1HE      MET  42  -4.290   0.285   3.974
  242    HE3  MET  42           2HE      MET  42  -4.628  -1.103   5.008
  243    H    ALA  43           H        ALA  43   0.988   2.196   3.789
  244    HA   ALA  43           HA       ALA  43   2.527  -0.115   3.409
  245    HB1  ALA  43           3HB      ALA  43   2.840   2.744   2.959
  246    HB2  ALA  43           1HB      ALA  43   4.358   1.936   3.351
  247    HB3  ALA  43           2HB      ALA  43   3.386   1.377   1.989
  248    H    ALA  44           H        ALA  44   2.323   2.116   6.077
  249    HA   ALA  44           HA       ALA  44   4.761   1.402   7.347
  250    HB1  ALA  44           3HB      ALA  44   4.199   3.188   8.535
  251    HB2  ALA  44           1HB      ALA  44   2.573   3.170   7.851
  252    HB3  ALA  44           2HB      ALA  44   2.927   2.246   9.312
  253    H    LEU  45           H        LEU  45   1.383   0.492   8.054
  254    HA   LEU  45           HA       LEU  45   1.904  -1.322  10.092
  255    HB3  LEU  45           2HB      LEU  45  -0.281  -2.262   9.630
  256    HG   LEU  45           HG       LEU  45  -0.300   0.719   9.169
  257   HD11  LEU  45          1HD1      LEU  45  -2.551  -1.197   9.742
  258   HD12  LEU  45          2HD1      LEU  45  -2.364  -0.147   8.339
  259   HD13  LEU  45          3HD1      LEU  45  -2.669   0.554   9.928
  260   HD21  LEU  45          3HD2      LEU  45   0.167   0.845  11.333
  261   HD22  LEU  45          1HD2      LEU  45   0.184  -0.913  11.465
  262   HD23  LEU  45          2HD2      LEU  45  -1.326  -0.027  11.685
  263    H    LEU  46           H        LEU  46   1.471  -1.985   6.618
  264    HA   LEU  46           HA       LEU  46   1.884  -4.725   6.674
  265    HB3  LEU  46           2HB      LEU  46   2.496  -4.541   4.325
  266    HG   LEU  46           HG       LEU  46   0.253  -2.729   5.160
  267   HD11  LEU  46          1HD1      LEU  46   1.088  -3.395   2.341
  268   HD12  LEU  46          2HD1      LEU  46   1.152  -1.804   3.097
  269   HD13  LEU  46          3HD1      LEU  46  -0.405  -2.582   2.810
  270   HD21  LEU  46          3HD2      LEU  46   0.492  -5.468   4.959
  271   HD22  LEU  46          1HD2      LEU  46  -0.290  -5.012   3.445
  272   HD23  LEU  46          2HD2      LEU  46  -1.017  -4.554   4.986
  273    H    SER  47           H        SER  47   4.223  -2.099   6.643
  274    HA   SER  47           HA       SER  47   6.525  -3.650   6.150
  275    HB3  SER  47           2HB      SER  47   6.488  -1.132   7.813
  276    HG   SER  47           HG       SER  47   8.544  -1.309   7.485
  277    H    SER  48           H        SER  48   4.459  -3.646   8.776
  278    HA   SER  48           HA       SER  48   6.380  -4.105  10.857
  279    HB3  SER  48           2HB      SER  48   3.410  -4.701  10.822
  280    HG   SER  48           HG       SER  48   4.898  -4.081  13.114
  281    H    SER  49           H        SER  49   6.407  -6.134  12.130
  282    HA   SER  49           HA       SER  49   6.900  -8.360  10.400
  283    HB3  SER  49           2HB      SER  49   7.269  -9.528  12.699
  284    HG   SER  49           HG       SER  49   9.265  -8.269  12.938
  285    H    SER  50           H        SER  50   4.095  -7.150  11.550
  286    HA   SER  50           HA       SER  50   2.569  -9.423  10.871
  287    HB3  SER  50           2HB      SER  50   1.668  -9.276  13.496
  288    HG   SER  50           HG       SER  50   2.741 -11.371  13.620
  289    HA   PRO  51           HA       PRO  51   0.442  -5.313  10.808
  290    HB3  PRO  51           2HB      PRO  51   1.111  -4.946   8.640
  291    HG3  PRO  51           2HG      PRO  51   1.690  -6.716   7.248
  292    HD3  PRO  51           2HD      PRO  51   2.963  -7.235   9.098
  293    H    LYS  52           H        LYS  52  -1.468  -5.300  11.795
  294    HA   LYS  52           HA       LYS  52  -3.423  -7.399  11.121
  295    HB3  LYS  52           2HB      LYS  52  -4.234  -7.345  13.326
  296    HG3  LYS  52           2HG      LYS  52  -1.277  -7.196  13.193
  297    HD3  LYS  52           2HD      LYS  52  -2.463  -7.722  15.856
  298    HE3  LYS  52           2HE      LYS  52   0.075  -6.474  14.820
  299    HZ1  LYS  52           3HZ      LYS  52   0.558  -5.712  16.836
  300    HZ2  LYS  52           1HZ      LYS  52   0.023  -7.123  17.602
  301    HZ3  LYS  52           2HZ      LYS  52  -1.079  -5.898  17.223
  302    H    CYS  53           H        CYS  53  -3.611  -4.193  12.664
  303    HA   CYS  53           HA       CYS  53  -4.704  -2.626  10.792
  304    HB3  CYS  53           2HB      CYS  53  -6.725  -4.641  11.694
  305    H    THR  54           H        THR  54  -3.971  -1.018  12.103
  306    HA   THR  54           HA       THR  54  -4.034  -0.567  14.720
  307    HB   THR  54           HB       THR  54  -4.114   1.171  12.421
  308    HG1  THR  54           1HG      THR  54  -2.505   0.730  14.279
  309   HG21  THR  54          3HG2      THR  54  -5.606   2.094  14.873
  310   HG22  THR  54          1HG2      THR  54  -6.190   2.048  13.211
  311   HG23  THR  54          2HG2      THR  54  -4.932   3.195  13.672
  312    H    ALA  55           H        ALA  55  -6.867  -0.350  12.634
  313    HA   ALA  55           HA       ALA  55  -8.691   0.773  14.399
  314    HB1  ALA  55           3HB      ALA  55  -9.816  -1.366  12.759
  315    HB2  ALA  55           1HB      ALA  55 -10.189   0.357  12.790
  316    HB3  ALA  55           2HB      ALA  55  -8.812  -0.230  11.859
  317    H    CYS  56           H        CYS  56  -8.786  -2.693  13.620
  318    HA   CYS  56           HA       CYS  56  -9.411  -3.216  16.451
  319    HB3  CYS  56           2HB      CYS  56 -11.307  -3.715  15.030
  320    H    GLN  57           H        GLN  57  -7.401  -4.031  13.750
  321    HA   GLN  57           HA       GLN  57  -5.344  -5.066  13.775
  322    HB3  GLN  57           2HB      GLN  57  -4.356  -5.842  15.741
  323    HG3  GLN  57           2HG      GLN  57  -6.093  -4.294  17.437
  324   HE21  GLN  57          1HE2      GLN  57  -3.206  -4.275  15.389
  325   HE22  GLN  57          2HE2      GLN  57  -2.131  -3.690  16.608
  326    H    GLU  58           H        GLU  58  -6.113  -6.387  12.117
  327    HA   GLU  58           HA       GLU  58  -6.829  -9.110  12.975
  328    HB3  GLU  58           2HB      GLU  58  -8.092  -7.398  10.862
  329    HG3  GLU  58           2HG      GLU  58  -7.378  -9.551   9.793
  330    H    SER  59           H        SER  59  -6.155  -7.565   9.841
  331    HA   SER  59           HA       SER  59  -3.564  -8.659   9.551
  332    HB3  SER  59           2HB      SER  59  -4.947 -10.752   9.381
  333    HG   SER  59           HG       SER  59  -6.652 -10.617   8.174
  334    H    ILE  60           H        ILE  60  -2.506  -7.666   7.919
  335    HA   ILE  60           HA       ILE  60  -4.084  -6.314   5.844
  336    HB   ILE  60           HB       ILE  60  -1.720  -4.840   6.836
  337   HG13  ILE  60          2HG1      ILE  60  -2.916  -5.625   8.912
  338   HG21  ILE  60          1HG2      ILE  60  -4.197  -4.353   5.385
  339   HG22  ILE  60          2HG2      ILE  60  -3.849  -3.120   6.596
  340   HG23  ILE  60          3HG2      ILE  60  -2.666  -3.480   5.339
  341   HD11  ILE  60          3HD1      ILE  60  -3.239  -2.663   8.567
  342   HD12  ILE  60          1HD1      ILE  60  -2.910  -3.565  10.046
  343   HD13  ILE  60          2HD1      ILE  60  -1.670  -3.435   8.798
  344    H    VAL  61           H        VAL  61  -3.395  -6.963   3.925
  345    HA   VAL  61           HA       VAL  61  -0.516  -7.279   3.469
  346    HB   VAL  61           HB       VAL  61  -2.600  -9.323   2.691
  347   HG11  VAL  61          1HG1      VAL  61  -1.256  -9.570   0.897
  348   HG12  VAL  61          2HG1      VAL  61   0.110  -8.769   1.674
  349   HG13  VAL  61          3HG1      VAL  61  -0.246 -10.458   2.037
  350   HG21  VAL  61          3HG2      VAL  61  -0.240  -9.454   4.563
  351   HG22  VAL  61          1HG2      VAL  61  -1.947  -9.549   4.997
  352   HG23  VAL  61          2HG2      VAL  61  -1.200 -10.845   4.062
  353    H    LYS  62           H        LYS  62   0.163  -6.462   1.577
  354    HA   LYS  62           HA       LYS  62  -1.433  -4.793   0.034
  355    HB3  LYS  62           2HB      LYS  62   0.880  -4.424  -0.096
  356    HG3  LYS  62           2HG      LYS  62   1.201  -7.294  -0.945
  357    HD3  LYS  62           2HD      LYS  62   2.963  -4.930  -1.201
  358    HE3  LYS  62           2HE      LYS  62   3.808  -6.709   0.621
  359    HZ1  LYS  62           3HZ      LYS  62   3.898  -8.169  -1.740
  360    HZ2  LYS  62           1HZ      LYS  62   4.544  -8.596  -0.236
  361    HZ3  LYS  62           2HZ      LYS  62   5.498  -7.774  -1.364
  362    H    ASP  63           H        ASP  63  -0.634  -8.194  -0.402
  363    HA   ASP  63           HA       ASP  63  -1.740  -8.461  -2.997
  364    HB3  ASP  63           2HB      ASP  63  -1.608 -10.711  -1.006
  365    H    LYS  64           H        LYS  64  -3.045  -8.982   0.251
  366    HA   LYS  64           HA       LYS  64  -5.637  -9.747  -0.796
  367    HB3  LYS  64           2HB      LYS  64  -6.262 -10.179   1.450
  368    HG3  LYS  64           2HG      LYS  64  -4.483 -11.519   2.403
  369    HD3  LYS  64           2HD      LYS  64  -4.322 -11.731  -0.599
  370    HE3  LYS  64           2HE      LYS  64  -3.915 -13.588   1.707
  371    HZ1  LYS  64           3HZ      LYS  64  -4.223 -14.736  -0.961
  372    HZ2  LYS  64           1HZ      LYS  64  -5.638 -14.377  -0.107
  373    HZ3  LYS  64           2HZ      LYS  64  -4.497 -15.435   0.555
  374    H    VAL  65           H        VAL  65  -4.093  -6.882  -0.477
  375    HA   VAL  65           HA       VAL  65  -6.376  -5.349   0.489
  376    HB   VAL  65           HB       VAL  65  -3.547  -4.903   0.358
  377   HG11  VAL  65          1HG1      VAL  65  -5.242  -2.768  -0.933
  378   HG12  VAL  65          2HG1      VAL  65  -3.573  -2.555  -0.402
  379   HG13  VAL  65          3HG1      VAL  65  -3.948  -3.692  -1.697
  380   HG21  VAL  65          3HG2      VAL  65  -4.452  -2.800   1.706
  381   HG22  VAL  65          1HG2      VAL  65  -5.929  -3.764   1.712
  382   HG23  VAL  65          2HG2      VAL  65  -4.444  -4.422   2.397
  383    H    PHE  66           H        PHE  66  -7.518  -3.863  -0.740
  384    HA   PHE  66           HA       PHE  66  -6.899  -3.435  -3.518
  385    HB3  PHE  66           2HB      PHE  66  -8.025  -5.283  -4.198
  386    HD1  PHE  66           2HD      PHE  66 -10.806  -4.536  -1.918
  387    HD2  PHE  66           1HD      PHE  66  -7.556  -7.143  -2.785
  388    HE1  PHE  66           2HE      PHE  66 -11.674  -6.155  -0.282
  389    HE2  PHE  66           1HE      PHE  66  -8.418  -8.767  -1.150
  390    HZ   PHE  66           HZ       PHE  66 -10.479  -8.274   0.105
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1 -26.200  23.921  -4.250
    2    HA2  GLY   1           1HA      GLY   1 -28.836  24.266  -5.024
    3    HA3  GLY   1           2HA      GLY   1 -28.039  25.208  -3.772
    4    H    SER   2           H        SER   2 -28.779  27.219  -4.164
    5    HA   SER   2           HA       SER   2 -29.063  29.233  -5.182
    6    HB3  SER   2           2HB      SER   2 -27.285  29.086  -7.398
    7    HG   SER   2           HG       SER   2 -27.635  30.847  -5.894
    8    H    SER   3           H        SER   3 -29.717  30.311  -7.250
    9    HA   SER   3           HA       SER   3 -31.796  28.882  -8.476
   10    HB3  SER   3           2HB      SER   3 -30.472  31.517  -8.965
   11    HG   SER   3           HG       SER   3 -31.780  31.845 -10.773
   12    H    GLY   4           H        GLY   4 -31.387  27.098  -9.642
   13    HA2  GLY   4           1HA      GLY   4 -29.482  27.369 -11.883
   14    HA3  GLY   4           2HA      GLY   4 -29.569  25.904 -10.916
   15    H    SER   5           H        SER   5 -29.864  25.089 -13.219
   16    HA   SER   5           HA       SER   5 -32.444  25.509 -14.418
   17    HB3  SER   5           2HB      SER   5 -30.206  23.571 -15.039
   18    HG   SER   5           HG       SER   5 -31.367  23.133 -16.933
   19    H    SER   6           H        SER   6 -30.901  22.440 -13.483
   20    HA   SER   6           HA       SER   6 -33.141  21.663 -11.853
   21    HB3  SER   6           2HB      SER   6 -33.870  21.246 -14.261
   22    HG   SER   6           HG       SER   6 -32.506  20.170 -15.428
   23    H    GLY   7           H        GLY   7 -32.762  19.738 -10.664
   24    HA2  GLY   7           1HA      GLY   7 -31.330  17.754 -10.351
   25    HA3  GLY   7           2HA      GLY   7 -29.975  18.765 -10.830
   26    H    PHE   8           H        PHE   8 -28.709  19.137  -9.144
   27    HA   PHE   8           HA       PHE   8 -28.045  19.316  -6.948
   28    HB3  PHE   8           2HB      PHE   8 -28.281  21.488  -6.397
   29    HD1  PHE   8           2HD      PHE   8 -27.280  21.448  -8.838
   30    HD2  PHE   8           1HD      PHE   8 -31.276  22.540  -7.859
   31    HE1  PHE   8           2HE      PHE   8 -27.450  22.704 -10.946
   32    HE2  PHE   8           1HE      PHE   8 -31.453  23.796  -9.967
   33    HZ   PHE   8           HZ       PHE   8 -29.538  23.880 -11.513
   34    H    VAL   9           H        VAL   9 -30.111  17.332  -7.328
   35    HA   VAL   9           HA       VAL   9 -31.076  17.219  -4.579
   36    HB   VAL   9           HB       VAL   9 -32.898  18.232  -6.014
   37   HG11  VAL   9          1HG1      VAL   9 -33.612  17.239  -7.873
   38   HG12  VAL   9          2HG1      VAL   9 -32.238  16.141  -7.725
   39   HG13  VAL   9          3HG1      VAL   9 -33.805  15.691  -7.049
   40   HG21  VAL   9          3HG2      VAL   9 -33.574  15.580  -4.746
   41   HG22  VAL   9          1HG2      VAL   9 -33.282  17.071  -3.850
   42   HG23  VAL   9          2HG2      VAL   9 -34.648  16.962  -4.960
   43    H    LYS  10           H        LYS  10 -31.885  15.059  -3.998
   44    HA   LYS  10           HA       LYS  10 -31.619  12.805  -3.853
   45    HB3  LYS  10           2HB      LYS  10 -31.136  12.254  -6.671
   46    HG3  LYS  10           2HG      LYS  10 -32.168  10.687  -5.021
   47    HD3  LYS  10           2HD      LYS  10 -34.584  12.453  -5.417
   48    HE3  LYS  10           2HE      LYS  10 -35.321  10.209  -5.279
   49    HZ1  LYS  10           3HZ      LYS  10 -33.545   8.937  -4.583
   50    HZ2  LYS  10           1HZ      LYS  10 -34.557   8.883  -3.228
   51    HZ3  LYS  10           2HZ      LYS  10 -33.215   9.912  -3.241
   52    H    THR  11           H        THR  11 -30.106  10.933  -4.991
   53    HA   THR  11           HA       THR  11 -27.997  10.092  -5.185
   54    HB   THR  11           HB       THR  11 -26.544  12.591  -5.594
   55    HG1  THR  11           1HG      THR  11 -27.674  12.741  -7.773
   56   HG21  THR  11          3HG2      THR  11 -26.886   9.946  -6.920
   57   HG22  THR  11          1HG2      THR  11 -25.413  10.762  -6.397
   58   HG23  THR  11          2HG2      THR  11 -26.233  11.280  -7.870
   59    H    VAL  12           H        VAL  12 -26.150   9.770  -3.916
   60    HA   VAL  12           HA       VAL  12 -25.903  11.533  -1.567
   61    HB   VAL  12           HB       VAL  12 -27.037   9.264  -1.153
   62   HG11  VAL  12          1HG1      VAL  12 -25.181   8.132  -2.576
   63   HG12  VAL  12          2HG1      VAL  12 -24.252   8.178  -1.076
   64   HG13  VAL  12          3HG1      VAL  12 -25.791   7.318  -1.136
   65   HG21  VAL  12          3HG2      VAL  12 -24.572   9.768   0.494
   66   HG22  VAL  12          1HG2      VAL  12 -25.979  10.829   0.545
   67   HG23  VAL  12          2HG2      VAL  12 -26.132   9.138   1.023
   68    H    GLU  13           H        GLU  13 -23.917  12.285  -1.219
   69    HA   GLU  13           HA       GLU  13 -21.680  10.997  -2.634
   70    HB3  GLU  13           2HB      GLU  13 -20.552  13.235  -2.374
   71    HG3  GLU  13           2HG      GLU  13 -22.249  14.462  -3.942
   72    H    ASP  14           H        ASP  14 -20.263   9.940  -1.430
   73    HA   ASP  14           HA       ASP  14 -19.795  10.842   1.331
   74    HB3  ASP  14           2HB      ASP  14 -19.345   8.041   1.211
   75    H    LYS  15           H        LYS  15 -17.838   9.013   2.013
   76    HA   LYS  15           HA       LYS  15 -15.813   8.674   0.087
   77    HB3  LYS  15           2HB      LYS  15 -15.448  10.987  -0.001
   78    HG3  LYS  15           2HG      LYS  15 -15.263  11.332   2.955
   79    HD3  LYS  15           2HD      LYS  15 -16.222  13.227   0.821
   80    HE3  LYS  15           2HE      LYS  15 -14.997  14.709   2.710
   81    HZ1  LYS  15           3HZ      LYS  15 -17.064  15.469   2.331
   82    HZ2  LYS  15           1HZ      LYS  15 -17.446  14.622   3.746
   83    HZ3  LYS  15           2HZ      LYS  15 -17.750  13.925   2.235
   84    H    TYR  16           H        TYR  16 -13.650   8.190   1.170
   85    HA   TYR  16           HA       TYR  16 -14.194   6.775   3.690
   86    HB3  TYR  16           2HB      TYR  16 -12.451   5.240   3.102
   87    HD1  TYR  16           2HD      TYR  16 -13.183   6.383  -0.310
   88    HD2  TYR  16           1HD      TYR  16 -14.361   3.789   2.850
   89    HE1  TYR  16           2HE      TYR  16 -14.642   5.160  -1.866
   90    HE2  TYR  16           1HE      TYR  16 -15.824   2.558   1.301
   91    HH   TYR  16           HH       TYR  16 -16.543   3.715  -1.859
   92    H    LYS  17           H        LYS  17 -12.234   6.517   5.124
   93    HA   LYS  17           HA       LYS  17 -10.328   8.706   5.019
   94    HB3  LYS  17           2HB      LYS  17 -12.516   8.495   7.047
   95    HG3  LYS  17           2HG      LYS  17 -10.782  10.353   8.112
   96    HD3  LYS  17           2HD      LYS  17 -10.382   8.259   9.746
   97    HE3  LYS  17           2HE      LYS  17 -12.393  10.312   9.442
   98    HZ1  LYS  17           3HZ      LYS  17 -13.220   7.750  10.678
   99    HZ2  LYS  17           1HZ      LYS  17 -14.033   8.641   9.492
  100    HZ3  LYS  17           2HZ      LYS  17 -13.938   9.229  11.074
  101    H    CYS  18           H        CYS  18  -8.431   8.262   6.066
  102    HA   CYS  18           HA       CYS  18  -7.825   5.571   6.636
  103    HB3  CYS  18           2HB      CYS  18  -6.327   8.128   7.224
  104    H    GLU  19           H        GLU  19  -7.619   4.449   8.521
  105    HA   GLU  19           HA       GLU  19  -8.999   5.532  10.823
  106    HB3  GLU  19           2HB      GLU  19  -8.171   3.099  11.652
  107    HG3  GLU  19           2HG      GLU  19 -10.257   2.188  11.019
  108    H    LYS  20           H        LYS  20  -6.322   6.552   9.998
  109    HA   LYS  20           HA       LYS  20  -4.994   6.184  12.595
  110    HB3  LYS  20           2HB      LYS  20  -3.064   6.756  10.540
  111    HG3  LYS  20           2HG      LYS  20  -3.488   4.558  12.521
  112    HD3  LYS  20           2HD      LYS  20  -1.181   4.685  10.586
  113    HE3  LYS  20           2HE      LYS  20  -0.282   2.976  11.727
  114    HZ1  LYS  20           3HZ      LYS  20  -2.304   3.735  13.765
  115    HZ2  LYS  20           1HZ      LYS  20  -0.801   4.481  13.541
  116    HZ3  LYS  20           2HZ      LYS  20  -0.878   2.875  14.064
  117    H    CYS  21           H        CYS  21  -4.660   8.148   9.631
  118    HA   CYS  21           HA       CYS  21  -4.261  10.510  11.323
  119    HB3  CYS  21           2HB      CYS  21  -2.505  10.254   9.734
  120    H    HIS  22           H        HIS  22  -6.779   8.981  10.011
  121    HA   HIS  22           HA       HIS  22  -8.900   9.560   9.427
  122    HB3  HIS  22           2HB      HIS  22  -9.757  11.083  10.830
  123    HD2  HIS  22           2HD      HIS  22  -7.585   9.431  12.443
  124    HE1  HIS  22           1HE      HIS  22  -6.244  13.154  13.972
  125    HE2  HIS  22           2HE      HIS  22  -6.154  10.650  14.221
  126    H    LEU  23           H        LEU  23  -6.607  10.025   7.578
  127    HA   LEU  23           HA       LEU  23  -7.150  12.349   6.036
  128    HB3  LEU  23           2HB      LEU  23  -5.916  10.707   4.279
  129    HG   LEU  23           HG       LEU  23  -3.694  11.363   5.603
  130   HD11  LEU  23          1HD1      LEU  23  -5.484  13.222   4.049
  131   HD12  LEU  23          2HD1      LEU  23  -4.231  12.162   3.405
  132   HD13  LEU  23          3HD1      LEU  23  -3.788  13.538   4.415
  133   HD21  LEU  23          3HD2      LEU  23  -3.888  13.073   7.112
  134   HD22  LEU  23          1HD2      LEU  23  -5.352  12.163   7.485
  135   HD23  LEU  23          2HD2      LEU  23  -5.444  13.607   6.476
  136    H    VAL  24           H        VAL  24  -8.948  12.682   4.921
  137    HA   VAL  24           HA       VAL  24 -10.749  10.613   4.184
  138    HB   VAL  24           HB       VAL  24 -10.628  13.510   3.341
  139   HG11  VAL  24          1HG1      VAL  24 -12.711  11.403   2.805
  140   HG12  VAL  24          2HG1      VAL  24 -13.017  13.135   2.662
  141   HG13  VAL  24          3HG1      VAL  24 -11.815  12.362   1.628
  142   HG21  VAL  24          3HG2      VAL  24 -11.290  12.383   5.775
  143   HG22  VAL  24          1HG2      VAL  24 -11.737  13.994   5.215
  144   HG23  VAL  24          2HG2      VAL  24 -12.852  12.645   4.999
  145    H    LEU  25           H        LEU  25 -10.437   9.213   2.591
  146    HA   LEU  25           HA       LEU  25  -9.140  10.162   0.121
  147    HB3  LEU  25           2HB      LEU  25  -7.646   8.538   0.271
  148    HG   LEU  25           HG       LEU  25  -8.960   8.041   2.896
  149   HD11  LEU  25          1HD1      LEU  25  -8.263   5.948   3.155
  150   HD12  LEU  25          2HD1      LEU  25  -6.673   6.321   2.493
  151   HD13  LEU  25          3HD1      LEU  25  -8.000   5.902   1.411
  152   HD21  LEU  25          3HD2      LEU  25  -6.617   8.417   3.653
  153   HD22  LEU  25          1HD2      LEU  25  -7.318   9.778   2.778
  154   HD23  LEU  25          2HD2      LEU  25  -6.169   8.709   1.973
  155    H    CYS  26           H        CYS  26  -9.711   8.794  -1.809
  156    HA   CYS  26           HA       CYS  26 -12.600   8.301  -1.779
  157    HB3  CYS  26           2HB      CYS  26 -10.690   8.722  -4.087
  158    H    SER  27           H        SER  27  -9.533   6.798  -2.670
  159    HA   SER  27           HA       SER  27 -10.931   4.208  -2.793
  160    HB3  SER  27           2HB      SER  27  -8.647   5.156  -4.540
  161    HG   SER  27           HG       SER  27  -8.601   3.124  -5.362
  162    HA   PRO  28           HA       PRO  28  -7.670   4.074   0.486
  163    HB3  PRO  28           2HB      PRO  28  -9.236   4.464   2.122
  164    HG3  PRO  28           2HG      PRO  28 -11.484   3.984   1.769
  165    HD3  PRO  28           2HD      PRO  28 -11.034   5.199  -0.138
  166    H    LYS  29           H        LYS  29  -7.536   1.821   2.010
  167    HA   LYS  29           HA       LYS  29  -7.376  -0.367   0.043
  168    HB3  LYS  29           2HB      LYS  29  -5.254  -0.956   0.730
  169    HG3  LYS  29           2HG      LYS  29  -3.828   0.969   0.946
  170    HD3  LYS  29           2HD      LYS  29  -5.839   2.270  -0.722
  171    HE3  LYS  29           2HE      LYS  29  -3.037   1.358  -0.862
  172    HZ1  LYS  29           3HZ      LYS  29  -4.847   1.272  -3.169
  173    HZ2  LYS  29           1HZ      LYS  29  -3.507   0.300  -2.814
  174    HZ3  LYS  29           2HZ      LYS  29  -3.282   1.873  -3.395
  175    H    GLN  30           H        GLN  30  -9.637  -0.491   1.191
  176    HA   GLN  30           HA       GLN  30 -10.155  -1.252   3.719
  177    HB3  GLN  30           2HB      GLN  30 -11.368  -3.106   1.787
  178    HG3  GLN  30           2HG      GLN  30 -12.475  -0.997   3.624
  179   HE21  GLN  30          1HE2      GLN  30 -14.434  -3.490   3.763
  180   HE22  GLN  30          2HE2      GLN  30 -15.604  -3.077   2.560
  181    H    THR  31           H        THR  31  -8.949  -2.490   5.002
  182    HA   THR  31           HA       THR  31  -7.288  -4.592   4.157
  183    HB   THR  31           HB       THR  31  -6.850  -5.039   6.431
  184    HG1  THR  31           1HG      THR  31  -9.426  -3.934   6.889
  185   HG21  THR  31          3HG2      THR  31  -6.516  -2.584   5.494
  186   HG22  THR  31          1HG2      THR  31  -6.147  -2.987   7.171
  187   HG23  THR  31          2HG2      THR  31  -7.672  -2.197   6.770
  188    H    GLU  32           H        GLU  32  -7.991  -6.541   6.214
  189    HA   GLU  32           HA       GLU  32 -10.127  -7.912   4.743
  190    HB3  GLU  32           2HB      GLU  32  -8.348  -9.226   6.772
  191    HG3  GLU  32           2HG      GLU  32  -8.564 -10.946   4.714
  192    H    CYS  33           H        CYS  33 -10.181  -5.881   7.109
  193    HA   CYS  33           HA       CYS  33 -11.994  -7.468   8.807
  194    HB3  CYS  33           2HB      CYS  33  -9.866  -6.610   9.894
  195    H    GLY  34           H        GLY  34 -11.502  -4.531   6.997
  196    HA2  GLY  34           1HA      GLY  34 -13.751  -3.795   6.035
  197    HA3  GLY  34           2HA      GLY  34 -14.214  -3.630   7.722
  198    H    HIS  35           H        HIS  35 -12.015  -2.464   8.842
  199    HA   HIS  35           HA       HIS  35 -12.363   0.222   8.396
  200    HB3  HIS  35           2HB      HIS  35 -10.091   0.506   9.467
  201    HD2  HIS  35           2HD      HIS  35 -12.165   1.443  11.227
  202    HE1  HIS  35           1HE      HIS  35 -12.381  -2.218  13.360
  203    HE2  HIS  35           2HE      HIS  35 -13.109   0.192  13.285
  204    H    ARG  36           H        ARG  36 -10.396   1.713   7.753
  205    HA   ARG  36           HA       ARG  36  -9.083   0.761   5.328
  206    HB3  ARG  36           2HB      ARG  36  -9.809   2.897   4.155
  207    HG3  ARG  36           2HG      ARG  36 -11.549   0.571   4.690
  208    HD3  ARG  36           2HD      ARG  36 -12.728   2.504   2.835
  209    HE   ARG  36           HE       ARG  36 -14.245   0.840   3.286
  210   HH11  ARG  36          1HH1      ARG  36 -13.033   2.155   6.274
  211   HH12  ARG  36          2HH1      ARG  36 -14.188   1.321   7.260
  212   HH21  ARG  36          1HH2      ARG  36 -15.771  -0.262   4.574
  213   HH22  ARG  36          2HH2      ARG  36 -15.744  -0.054   6.292
  214    H    PHE  37           H        PHE  37  -7.272   2.001   4.701
  215    HA   PHE  37           HA       PHE  37  -6.447   4.125   6.547
  216    HB3  PHE  37           2HB      PHE  37  -4.094   3.069   6.415
  217    HD1  PHE  37           2HD      PHE  37  -6.599   0.552   7.432
  218    HD2  PHE  37           1HD      PHE  37  -4.029   3.709   8.678
  219    HE1  PHE  37           2HE      PHE  37  -7.025  -0.034   9.783
  220    HE2  PHE  37           1HE      PHE  37  -4.451   3.126  11.031
  221    HZ   PHE  37           HZ       PHE  37  -5.952   1.254  11.587
  222    H    CYS  38           H        CYS  38  -4.351   5.176   5.702
  223    HA   CYS  38           HA       CYS  38  -4.782   5.754   2.872
  224    HB3  CYS  38           2HB      CYS  38  -4.653   7.593   4.586
  225    H    GLU  39           H        GLU  39  -2.799   6.183   1.534
  226    HA   GLU  39           HA       GLU  39  -1.332   3.942   1.070
  227    HB3  GLU  39           2HB      GLU  39   0.466   5.681   0.206
  228    HG3  GLU  39           2HG      GLU  39  -2.294   5.666  -0.989
  229    H    SER  40           H        SER  40  -0.045   6.768   2.831
  230    HA   SER  40           HA       SER  40   2.351   5.683   3.648
  231    HB3  SER  40           2HB      SER  40   1.631   7.242   5.811
  232    HG   SER  40           HG       SER  40   2.774   8.848   4.709
  233    H    CYS  41           H        CYS  41  -0.057   6.221   6.162
  234    HA   CYS  41           HA       CYS  41   0.717   4.490   8.032
  235    HB3  CYS  41           2HB      CYS  41  -1.644   4.192   8.704
  236    H    MET  42           H        MET  42  -1.217   3.551   5.207
  237    HA   MET  42           HA       MET  42  -1.590   0.868   5.810
  238    HB3  MET  42           2HB      MET  42  -1.268   2.267   3.157
  239    HG3  MET  42           2HG      MET  42  -0.752  -0.075   2.789
  240    HE1  MET  42           3HE      MET  42  -3.485   0.247   5.660
  241    HE2  MET  42           1HE      MET  42  -4.268   0.512   4.101
  242    HE3  MET  42           2HE      MET  42  -4.650  -0.927   5.045
  243    H    ALA  43           H        ALA  43   0.968   2.252   3.739
  244    HA   ALA  43           HA       ALA  43   2.419  -0.092   3.357
  245    HB1  ALA  43           3HB      ALA  43   2.865   2.757   2.971
  246    HB2  ALA  43           1HB      ALA  43   4.344   1.874   3.348
  247    HB3  ALA  43           2HB      ALA  43   3.352   1.388   1.972
  248    H    ALA  44           H        ALA  44   2.391   2.146   6.047
  249    HA   ALA  44           HA       ALA  44   4.768   1.308   7.309
  250    HB1  ALA  44           3HB      ALA  44   3.547   2.211   9.399
  251    HB2  ALA  44           1HB      ALA  44   3.938   3.327   8.090
  252    HB3  ALA  44           2HB      ALA  44   2.296   2.703   8.258
  253    H    LEU  45           H        LEU  45   1.396   0.506   8.172
  254    HA   LEU  45           HA       LEU  45   1.933  -1.433  10.064
  255    HB3  LEU  45           2HB      LEU  45  -0.301  -2.278   9.658
  256    HG   LEU  45           HG       LEU  45  -0.258   0.717   9.298
  257   HD11  LEU  45          1HD1      LEU  45  -2.566   0.662  10.081
  258   HD12  LEU  45          2HD1      LEU  45  -2.526  -1.101  10.099
  259   HD13  LEU  45          3HD1      LEU  45  -2.386  -0.232   8.570
  260   HD21  LEU  45          3HD2      LEU  45   0.647  -0.705  11.418
  261   HD22  LEU  45          1HD2      LEU  45  -1.050  -0.502  11.851
  262   HD23  LEU  45          2HD2      LEU  45  -0.048   0.912  11.527
  263    H    LEU  46           H        LEU  46   1.261  -1.967   6.602
  264    HA   LEU  46           HA       LEU  46   1.564  -4.692   6.484
  265    HB3  LEU  46           2HB      LEU  46   2.230  -4.396   4.144
  266    HG   LEU  46           HG       LEU  46   0.110  -2.392   4.917
  267   HD11  LEU  46          1HD1      LEU  46   0.715  -3.662   2.250
  268   HD12  LEU  46          2HD1      LEU  46   0.993  -1.975   2.680
  269   HD13  LEU  46          3HD1      LEU  46  -0.652  -2.608   2.613
  270   HD21  LEU  46          3HD2      LEU  46   0.170  -5.314   4.705
  271   HD22  LEU  46          1HD2      LEU  46  -1.146  -4.543   3.820
  272   HD23  LEU  46          2HD2      LEU  46  -0.961  -4.257   5.550
  273    H    SER  47           H        SER  47   4.073  -2.227   6.587
  274    HA   SER  47           HA       SER  47   6.186  -4.192   6.276
  275    HB3  SER  47           2HB      SER  47   7.171  -1.631   7.120
  276    HG   SER  47           HG       SER  47   7.978  -1.704   4.916
  277    H    SER  48           H        SER  48   4.356  -4.303   8.589
  278    HA   SER  48           HA       SER  48   6.260  -3.822  10.780
  279    HB3  SER  48           2HB      SER  48   3.282  -4.316  10.997
  280    HG   SER  48           HG       SER  48   3.571  -3.987  13.077
  281    H    SER  49           H        SER  49   5.787  -6.176   8.792
  282    HA   SER  49           HA       SER  49   6.280  -8.408   8.891
  283    HB3  SER  49           2HB      SER  49   6.201  -8.642  11.836
  284    HG   SER  49           HG       SER  49   8.528  -9.275  10.950
  285    H    SER  50           H        SER  50   4.180  -7.571  11.653
  286    HA   SER  50           HA       SER  50   2.208  -9.493  10.604
  287    HB3  SER  50           2HB      SER  50   2.549  -8.907  13.542
  288    HG   SER  50           HG       SER  50   1.743 -11.357  13.039
  289    HA   PRO  51           HA       PRO  51   0.324  -5.258  10.914
  290    HB3  PRO  51           2HB      PRO  51   0.799  -4.803   8.712
  291    HG3  PRO  51           2HG      PRO  51   1.154  -6.517   7.182
  292    HD3  PRO  51           2HD      PRO  51   2.572  -7.191   8.869
  293    H    LYS  52           H        LYS  52  -1.625  -4.989  11.811
  294    HA   LYS  52           HA       LYS  52  -3.645  -7.099  11.406
  295    HB3  LYS  52           2HB      LYS  52  -4.404  -6.768  13.656
  296    HG3  LYS  52           2HG      LYS  52  -1.703  -7.522  13.147
  297    HD3  LYS  52           2HD      LYS  52  -1.924  -6.686  15.977
  298    HE3  LYS  52           2HE      LYS  52   0.497  -6.187  14.383
  299    HZ1  LYS  52           3HZ      LYS  52  -0.211  -7.280  17.008
  300    HZ2  LYS  52           1HZ      LYS  52   0.922  -6.090  16.604
  301    HZ3  LYS  52           2HZ      LYS  52   1.278  -7.722  16.335
  302    H    CYS  53           H        CYS  53  -3.717  -3.838  12.829
  303    HA   CYS  53           HA       CYS  53  -4.826  -2.298  10.950
  304    HB3  CYS  53           2HB      CYS  53  -6.863  -4.264  11.926
  305    H    THR  54           H        THR  54  -3.949  -0.753  12.298
  306    HA   THR  54           HA       THR  54  -4.058  -0.269  14.905
  307    HB   THR  54           HB       THR  54  -3.926   1.437  12.594
  308    HG1  THR  54           1HG      THR  54  -3.087   1.852  15.289
  309   HG21  THR  54          3HG2      THR  54  -5.470   2.507  14.954
  310   HG22  THR  54          1HG2      THR  54  -5.985   2.450  13.268
  311   HG23  THR  54          2HG2      THR  54  -4.680   3.532  13.755
  312    H    ALA  55           H        ALA  55  -6.815   0.024  12.748
  313    HA   ALA  55           HA       ALA  55  -8.620   1.344  14.389
  314    HB1  ALA  55           3HB      ALA  55  -9.771  -0.861  12.831
  315    HB2  ALA  55           1HB      ALA  55 -10.133   0.865  12.801
  316    HB3  ALA  55           2HB      ALA  55  -8.742   0.240  11.914
  317    H    CYS  56           H        CYS  56  -8.837  -2.164  13.837
  318    HA   CYS  56           HA       CYS  56  -9.564  -2.469  16.677
  319    HB3  CYS  56           2HB      CYS  56 -11.453  -2.959  15.235
  320    H    GLN  57           H        GLN  57  -7.466  -3.455  14.137
  321    HA   GLN  57           HA       GLN  57  -5.479  -4.602  14.281
  322    HB3  GLN  57           2HB      GLN  57  -5.918  -5.914  16.858
  323    HG3  GLN  57           2HG      GLN  57  -3.790  -4.344  15.528
  324   HE21  GLN  57          1HE2      GLN  57  -4.308  -2.454  16.987
  325   HE22  GLN  57          2HE2      GLN  57  -3.494  -2.407  18.509
  326    H    GLU  58           H        GLU  58  -6.309  -5.928  12.633
  327    HA   GLU  58           HA       GLU  58  -7.143  -8.595  13.563
  328    HB3  GLU  58           2HB      GLU  58  -8.312  -8.596  11.183
  329    HG3  GLU  58           2HG      GLU  58  -9.982  -8.932  12.608
  330    H    SER  59           H        SER  59  -6.643  -7.555  10.247
  331    HA   SER  59           HA       SER  59  -3.963  -8.522  10.051
  332    HB3  SER  59           2HB      SER  59  -5.228 -10.246   8.217
  333    HG   SER  59           HG       SER  59  -4.498 -11.580  10.392
  334    H    ILE  60           H        ILE  60  -3.092  -7.225   8.591
  335    HA   ILE  60           HA       ILE  60  -4.776  -6.245   6.385
  336    HB   ILE  60           HB       ILE  60  -2.171  -4.950   7.019
  337   HG13  ILE  60          2HG1      ILE  60  -3.369  -5.334   9.210
  338   HG21  ILE  60          1HG2      ILE  60  -2.986  -3.574   5.477
  339   HG22  ILE  60          2HG2      ILE  60  -4.545  -4.395   5.498
  340   HG23  ILE  60          3HG2      ILE  60  -4.222  -3.088   6.636
  341   HD11  ILE  60          3HD1      ILE  60  -2.112  -3.036   8.334
  342   HD12  ILE  60          1HD1      ILE  60  -3.613  -2.460   9.057
  343   HD13  ILE  60          2HD1      ILE  60  -2.505  -3.454  10.002
  344    H    VAL  61           H        VAL  61  -4.251  -6.691   4.331
  345    HA   VAL  61           HA       VAL  61  -1.549  -7.469   3.615
  346    HB   VAL  61           HB       VAL  61  -3.876  -9.367   3.304
  347   HG11  VAL  61          1HG1      VAL  61  -2.485 -10.776   1.977
  348   HG12  VAL  61          2HG1      VAL  61  -2.451  -9.168   1.251
  349   HG13  VAL  61          3HG1      VAL  61  -1.089  -9.727   2.222
  350   HG21  VAL  61          3HG2      VAL  61  -3.035  -9.851   5.378
  351   HG22  VAL  61          1HG2      VAL  61  -1.991 -10.865   4.381
  352   HG23  VAL  61          2HG2      VAL  61  -1.408  -9.308   4.966
  353    H    LYS  62           H        LYS  62  -1.071  -6.542   1.743
  354    HA   LYS  62           HA       LYS  62  -2.778  -4.987   0.239
  355    HB3  LYS  62           2HB      LYS  62  -0.461  -4.667  -0.073
  356    HG3  LYS  62           2HG      LYS  62   0.103  -7.212  -1.445
  357    HD3  LYS  62           2HD      LYS  62   2.260  -6.930  -0.383
  358    HE3  LYS  62           2HE      LYS  62   2.725  -4.490  -1.102
  359    HZ1  LYS  62           3HZ      LYS  62   3.361  -5.751  -2.811
  360    HZ2  LYS  62           1HZ      LYS  62   1.882  -5.338  -3.523
  361    HZ3  LYS  62           2HZ      LYS  62   2.037  -6.795  -2.679
  362    H    ASP  63           H        ASP  63  -1.694  -8.296  -0.521
  363    HA   ASP  63           HA       ASP  63  -3.063  -8.722  -2.860
  364    HB3  ASP  63           2HB      ASP  63  -2.457 -10.617  -0.592
  365    H    LYS  64           H        LYS  64  -4.307  -8.762   0.421
  366    HA   LYS  64           HA       LYS  64  -6.967  -9.509  -0.547
  367    HB3  LYS  64           2HB      LYS  64  -7.518 -10.082   1.639
  368    HG3  LYS  64           2HG      LYS  64  -5.662 -11.286   2.668
  369    HD3  LYS  64           2HD      LYS  64  -4.949 -11.921  -0.058
  370    HE3  LYS  64           2HE      LYS  64  -5.101 -13.427   1.980
  371    HZ1  LYS  64           3HZ      LYS  64  -7.425 -14.491   2.049
  372    HZ2  LYS  64           1HZ      LYS  64  -7.964 -13.018   1.417
  373    HZ3  LYS  64           2HZ      LYS  64  -7.167 -13.057   2.908
  374    H    VAL  65           H        VAL  65  -5.146  -6.766   0.187
  375    HA   VAL  65           HA       VAL  65  -7.367  -5.125   1.059
  376    HB   VAL  65           HB       VAL  65  -4.547  -4.915   1.183
  377   HG11  VAL  65          1HG1      VAL  65  -4.192  -2.619   0.388
  378   HG12  VAL  65          2HG1      VAL  65  -4.605  -3.716  -0.932
  379   HG13  VAL  65          3HG1      VAL  65  -5.821  -2.610  -0.290
  380   HG21  VAL  65          3HG2      VAL  65  -6.930  -3.603   2.301
  381   HG22  VAL  65          1HG2      VAL  65  -5.487  -4.219   3.106
  382   HG23  VAL  65          2HG2      VAL  65  -5.456  -2.635   2.331
  383    H    PHE  66           H        PHE  66  -8.552  -3.763  -0.160
  384    HA   PHE  66           HA       PHE  66  -8.379  -4.021  -3.028
  385    HB3  PHE  66           2HB      PHE  66 -10.379  -2.432  -2.937
  386    HD1  PHE  66           1HD      PHE  66 -10.317  -4.973  -0.219
  387    HD2  PHE  66           2HD      PHE  66 -11.642  -3.951  -4.133
  388    HE1  PHE  66           1HE      PHE  66 -11.662  -7.032  -0.298
  389    HE2  PHE  66           2HE      PHE  66 -12.989  -6.008  -4.218
  390    HZ   PHE  66           HZ       PHE  66 -13.001  -7.551  -2.298
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -26.342  28.860   3.443
    2    HA2  GLY   1           1HA      GLY   1 -26.937  26.199   4.433
    3    HA3  GLY   1           2HA      GLY   1 -25.889  27.388   5.194
    4    H    SER   2           H        SER   2 -27.366  26.125   6.921
    5    HA   SER   2           HA       SER   2 -28.713  26.599   8.716
    6    HB3  SER   2           2HB      SER   2 -29.595  28.730   9.056
    7    HG   SER   2           HG       SER   2 -27.237  28.607   8.006
    8    H    SER   3           H        SER   3 -30.487  27.761   5.844
    9    HA   SER   3           HA       SER   3 -32.834  26.274   6.640
   10    HB3  SER   3           2HB      SER   3 -32.560  27.649   3.986
   11    HG   SER   3           HG       SER   3 -34.718  27.999   4.302
   12    H    GLY   4           H        GLY   4 -30.085  25.736   4.693
   13    HA2  GLY   4           1HA      GLY   4 -31.407  23.676   3.089
   14    HA3  GLY   4           2HA      GLY   4 -29.766  24.262   2.871
   15    H    SER   5           H        SER   5 -30.768  21.512   3.062
   16    HA   SER   5           HA       SER   5 -29.377  20.640   5.507
   17    HB3  SER   5           2HB      SER   5 -30.893  18.561   4.147
   18    HG   SER   5           HG       SER   5 -31.815  18.456   6.281
   19    H    SER   6           H        SER   6 -29.600  20.272   2.032
   20    HA   SER   6           HA       SER   6 -27.637  18.164   1.916
   21    HB3  SER   6           2HB      SER   6 -29.599  18.782   0.238
   22    HG   SER   6           HG       SER   6 -28.570  20.838  -0.263
   23    H    GLY   7           H        GLY   7 -25.535  18.321   1.065
   24    HA2  GLY   7           1HA      GLY   7 -24.321  20.958   1.486
   25    HA3  GLY   7           2HA      GLY   7 -23.470  19.421   1.479
   26    H    PHE   8           H        PHE   8 -22.895  18.467  -0.497
   27    HA   PHE   8           HA       PHE   8 -22.660  20.394  -2.675
   28    HB3  PHE   8           2HB      PHE   8 -21.410  17.652  -2.550
   29    HD1  PHE   8           2HD      PHE   8 -20.361  21.145  -3.320
   30    HD2  PHE   8           1HD      PHE   8 -20.783  17.141  -4.702
   31    HE1  PHE   8           2HE      PHE   8 -19.256  21.759  -5.431
   32    HE2  PHE   8           1HE      PHE   8 -19.679  17.750  -6.814
   33    HZ   PHE   8           HZ       PHE   8 -18.916  20.062  -7.182
   34    H    VAL   9           H        VAL   9 -24.921  20.237  -3.267
   35    HA   VAL   9           HA       VAL   9 -26.407  19.615  -4.911
   36    HB   VAL   9           HB       VAL   9 -24.154  18.257  -5.740
   37   HG11  VAL   9          1HG1      VAL   9 -25.163  16.276  -4.474
   38   HG12  VAL   9          2HG1      VAL   9 -26.366  16.229  -5.764
   39   HG13  VAL   9          3HG1      VAL   9 -24.657  16.008  -6.142
   40   HG21  VAL   9          3HG2      VAL   9 -25.508  19.467  -7.255
   41   HG22  VAL   9          1HG2      VAL   9 -25.552  17.790  -7.799
   42   HG23  VAL   9          2HG2      VAL   9 -26.918  18.465  -6.912
   43    H    LYS  10           H        LYS  10 -27.900  17.618  -5.377
   44    HA   LYS  10           HA       LYS  10 -29.220  16.976  -3.004
   45    HB3  LYS  10           2HB      LYS  10 -30.083  15.019  -4.680
   46    HG3  LYS  10           2HG      LYS  10 -31.398  16.942  -3.714
   47    HD3  LYS  10           2HD      LYS  10 -31.796  18.663  -5.693
   48    HE3  LYS  10           2HE      LYS  10 -29.424  19.588  -4.394
   49    HZ1  LYS  10           3HZ      LYS  10 -31.788  20.612  -4.947
   50    HZ2  LYS  10           1HZ      LYS  10 -30.786  21.251  -3.743
   51    HZ3  LYS  10           2HZ      LYS  10 -32.060  20.220  -3.325
   52    H    THR  11           H        THR  11 -29.462  14.997  -1.881
   53    HA   THR  11           HA       THR  11 -28.731  13.111  -0.837
   54    HB   THR  11           HB       THR  11 -26.936  12.133  -2.923
   55    HG1  THR  11           1HG      THR  11 -28.179  12.445  -4.606
   56   HG21  THR  11          3HG2      THR  11 -29.250  11.189  -1.318
   57   HG22  THR  11          1HG2      THR  11 -27.673  10.444  -1.571
   58   HG23  THR  11          2HG2      THR  11 -28.905  10.348  -2.829
   59    H    VAL  12           H        VAL  12 -26.987  12.344   0.385
   60    HA   VAL  12           HA       VAL  12 -24.813  14.211   0.659
   61    HB   VAL  12           HB       VAL  12 -25.687  11.777   2.171
   62   HG11  VAL  12          1HG1      VAL  12 -23.579  12.651   3.638
   63   HG12  VAL  12          2HG1      VAL  12 -23.526  11.273   2.537
   64   HG13  VAL  12          3HG1      VAL  12 -22.962  12.856   1.999
   65   HG21  VAL  12          3HG2      VAL  12 -25.650  13.421   4.050
   66   HG22  VAL  12          1HG2      VAL  12 -25.233  14.671   2.877
   67   HG23  VAL  12          2HG2      VAL  12 -26.777  13.828   2.757
   68    H    GLU  13           H        GLU  13 -23.064  14.114  -0.579
   69    HA   GLU  13           HA       GLU  13 -22.085  11.466  -1.424
   70    HB3  GLU  13           2HB      GLU  13 -21.012  12.695  -3.332
   71    HG3  GLU  13           2HG      GLU  13 -23.542  13.503  -4.126
   72    H    ASP  14           H        ASP  14 -20.503  10.942  -0.042
   73    HA   ASP  14           HA       ASP  14 -18.342  12.903   0.356
   74    HB3  ASP  14           2HB      ASP  14 -18.481  11.012   2.530
   75    H    LYS  15           H        LYS  15 -16.536  11.337   1.671
   76    HA   LYS  15           HA       LYS  15 -16.076   9.063  -0.140
   77    HB3  LYS  15           2HB      LYS  15 -13.912   9.698  -0.613
   78    HG3  LYS  15           2HG      LYS  15 -15.754  11.767  -0.866
   79    HD3  LYS  15           2HD      LYS  15 -13.900  13.651  -0.701
   80    HE3  LYS  15           2HE      LYS  15 -14.946  13.240   1.974
   81    HZ1  LYS  15           3HZ      LYS  15 -14.645  15.300   0.161
   82    HZ2  LYS  15           1HZ      LYS  15 -15.281  15.401   1.725
   83    HZ3  LYS  15           2HZ      LYS  15 -16.312  15.159   0.406
   84    H    TYR  16           H        TYR  16 -13.646   8.247   0.978
   85    HA   TYR  16           HA       TYR  16 -14.603   7.176   3.529
   86    HB3  TYR  16           2HB      TYR  16 -12.800   5.498   3.245
   87    HD1  TYR  16           1HD      TYR  16 -15.761   6.605   1.853
   88    HD2  TYR  16           2HD      TYR  16 -12.762   3.644   1.260
   89    HE1  TYR  16           1HE      TYR  16 -17.378   5.222   0.618
   90    HE2  TYR  16           2HE      TYR  16 -14.370   2.255   0.022
   91    HH   TYR  16           HH       TYR  16 -17.757   3.036  -0.105
   92    H    LYS  17           H        LYS  17 -12.354   6.482   4.822
   93    HA   LYS  17           HA       LYS  17 -10.490   8.673   4.977
   94    HB3  LYS  17           2HB      LYS  17 -12.678   8.322   6.983
   95    HG3  LYS  17           2HG      LYS  17 -10.896  10.029   8.215
   96    HD3  LYS  17           2HD      LYS  17 -10.563   7.789   9.654
   97    HE3  LYS  17           2HE      LYS  17 -12.483   9.928   9.550
   98    HZ1  LYS  17           3HZ      LYS  17 -13.947   8.448  11.195
   99    HZ2  LYS  17           1HZ      LYS  17 -13.530   7.265  10.058
  100    HZ3  LYS  17           2HZ      LYS  17 -14.333   8.669   9.562
  101    H    CYS  18           H        CYS  18  -8.597   8.097   5.961
  102    HA   CYS  18           HA       CYS  18  -8.020   5.365   6.264
  103    HB3  CYS  18           2HB      CYS  18  -6.528   7.856   7.084
  104    H    GLU  19           H        GLU  19  -7.816   4.047   8.024
  105    HA   GLU  19           HA       GLU  19  -9.237   4.869  10.408
  106    HB3  GLU  19           2HB      GLU  19  -8.599   2.417  11.064
  107    HG3  GLU  19           2HG      GLU  19 -10.513   1.557  10.080
  108    H    LYS  20           H        LYS  20  -6.612   6.054   9.794
  109    HA   LYS  20           HA       LYS  20  -5.308   5.408  12.343
  110    HB3  LYS  20           2HB      LYS  20  -3.334   6.162  10.392
  111    HG3  LYS  20           2HG      LYS  20  -3.799   3.734  12.090
  112    HD3  LYS  20           2HD      LYS  20  -1.434   4.249  10.286
  113    HE3  LYS  20           2HE      LYS  20  -0.389   2.503  11.261
  114    HZ1  LYS  20           3HZ      LYS  20  -0.987   2.221  13.627
  115    HZ2  LYS  20           1HZ      LYS  20  -2.368   3.167  13.371
  116    HZ3  LYS  20           2HZ      LYS  20  -0.831   3.843  13.170
  117    H    CYS  21           H        CYS  21  -4.757   7.620   9.598
  118    HA   CYS  21           HA       CYS  21  -4.422   9.818  11.493
  119    HB3  CYS  21           2HB      CYS  21  -2.671   9.696   9.879
  120    H    HIS  22           H        HIS  22  -6.938   8.436   9.974
  121    HA   HIS  22           HA       HIS  22  -9.054   9.085   9.449
  122    HB3  HIS  22           2HB      HIS  22  -9.931  10.441  11.005
  123    HD2  HIS  22           2HD      HIS  22  -7.823   8.572  12.448
  124    HE1  HIS  22           1HE      HIS  22  -6.452  12.059  14.439
  125    HE2  HIS  22           2HE      HIS  22  -6.409   9.541  14.387
  126    H    LEU  23           H        LEU  23  -6.787   9.713   7.658
  127    HA   LEU  23           HA       LEU  23  -7.293  12.224   6.409
  128    HB3  LEU  23           2HB      LEU  23  -6.069  10.700   4.491
  129    HG   LEU  23           HG       LEU  23  -4.873  12.309   6.718
  130   HD11  LEU  23          1HD1      LEU  23  -2.864  11.409   6.479
  131   HD12  LEU  23          2HD1      LEU  23  -2.916  11.704   4.742
  132   HD13  LEU  23          3HD1      LEU  23  -3.544  10.193   5.398
  133   HD21  LEU  23          3HD2      LEU  23  -4.017  13.396   4.429
  134   HD22  LEU  23          1HD2      LEU  23  -5.561  13.812   5.172
  135   HD23  LEU  23          2HD2      LEU  23  -5.505  12.646   3.849
  136    H    VAL  24           H        VAL  24  -9.010  12.719   5.231
  137    HA   VAL  24           HA       VAL  24 -10.887  10.800   4.322
  138    HB   VAL  24           HB       VAL  24 -10.562  13.748   3.842
  139   HG11  VAL  24          1HG1      VAL  24 -12.985  13.363   2.824
  140   HG12  VAL  24          2HG1      VAL  24 -11.531  13.330   1.824
  141   HG13  VAL  24          3HG1      VAL  24 -12.265  11.820   2.364
  142   HG21  VAL  24          3HG2      VAL  24 -13.083  12.741   4.884
  143   HG22  VAL  24          1HG2      VAL  24 -11.701  12.276   5.877
  144   HG23  VAL  24          2HG2      VAL  24 -12.006  13.978   5.531
  145    H    LEU  25           H        LEU  25 -10.488   9.423   2.719
  146    HA   LEU  25           HA       LEU  25  -9.064  10.418   0.339
  147    HB3  LEU  25           2HB      LEU  25  -7.795   8.596   0.335
  148    HG   LEU  25           HG       LEU  25  -9.033   8.240   3.031
  149   HD11  LEU  25          1HD1      LEU  25  -6.836   6.424   2.559
  150   HD12  LEU  25          2HD1      LEU  25  -8.217   6.055   1.526
  151   HD13  LEU  25          3HD1      LEU  25  -8.418   6.120   3.276
  152   HD21  LEU  25          3HD2      LEU  25  -6.560   8.435   3.619
  153   HD22  LEU  25          1HD2      LEU  25  -7.350   9.876   2.979
  154   HD23  LEU  25          2HD2      LEU  25  -6.315   8.902   1.935
  155    H    CYS  26           H        CYS  26  -9.608   8.663  -1.545
  156    HA   CYS  26           HA       CYS  26 -12.550   8.616  -1.723
  157    HB3  CYS  26           2HB      CYS  26 -10.830   8.693  -4.169
  158    H    SER  27           H        SER  27  -9.737   6.766  -1.675
  159    HA   SER  27           HA       SER  27 -11.156   4.329  -2.035
  160    HB3  SER  27           2HB      SER  27  -9.665   5.455  -4.339
  161    HG   SER  27           HG       SER  27  -8.758   3.599  -4.931
  162    HA   PRO  28           HA       PRO  28  -7.383   4.069   0.576
  163    HB3  PRO  28           2HB      PRO  28  -8.678   4.286   2.462
  164    HG3  PRO  28           2HG      PRO  28 -10.934   3.723   2.439
  165    HD3  PRO  28           2HD      PRO  28 -10.843   5.069   0.571
  166    H    LYS  29           H        LYS  29  -6.926   1.735   1.908
  167    HA   LYS  29           HA       LYS  29  -6.873  -0.263  -0.258
  168    HB3  LYS  29           2HB      LYS  29  -4.774  -1.071   0.641
  169    HG3  LYS  29           2HG      LYS  29  -3.298   0.835   0.355
  170    HD3  LYS  29           2HD      LYS  29  -5.681   0.849  -1.496
  171    HE3  LYS  29           2HE      LYS  29  -2.925   2.027  -1.827
  172    HZ1  LYS  29           3HZ      LYS  29  -4.539   2.607  -4.003
  173    HZ2  LYS  29           1HZ      LYS  29  -4.655   0.934  -3.772
  174    HZ3  LYS  29           2HZ      LYS  29  -3.140   1.656  -3.985
  175    H    GLN  30           H        GLN  30  -9.119  -0.443   1.042
  176    HA   GLN  30           HA       GLN  30  -9.564  -1.523   3.429
  177    HB3  GLN  30           2HB      GLN  30 -10.787  -3.222   1.379
  178    HG3  GLN  30           2HG      GLN  30 -11.897  -1.230   3.340
  179   HE21  GLN  30          1HE2      GLN  30 -14.146  -2.742   3.889
  180   HE22  GLN  30          2HE2      GLN  30 -15.206  -2.693   2.527
  181    H    THR  31           H        THR  31  -8.882  -3.170   4.632
  182    HA   THR  31           HA       THR  31  -7.042  -5.094   3.487
  183    HB   THR  31           HB       THR  31  -6.415  -5.659   5.668
  184    HG1  THR  31           1HG      THR  31  -8.909  -4.563   6.512
  185   HG21  THR  31          3HG2      THR  31  -5.584  -3.678   6.325
  186   HG22  THR  31          1HG2      THR  31  -7.186  -2.970   6.528
  187   HG23  THR  31          2HG2      THR  31  -6.440  -3.020   4.931
  188    H    GLU  32           H        GLU  32  -7.670  -7.145   5.483
  189    HA   GLU  32           HA       GLU  32  -9.893  -8.401   4.049
  190    HB3  GLU  32           2HB      GLU  32  -8.522 -10.112   5.945
  191    HG3  GLU  32           2HG      GLU  32  -8.294 -10.368   2.985
  192    H    CYS  33           H        CYS  33  -9.847  -6.441   6.472
  193    HA   CYS  33           HA       CYS  33 -11.580  -8.052   8.226
  194    HB3  CYS  33           2HB      CYS  33  -9.469  -7.039   9.212
  195    H    GLY  34           H        GLY  34 -11.284  -5.095   6.380
  196    HA2  GLY  34           1HA      GLY  34 -13.543  -4.470   5.407
  197    HA3  GLY  34           2HA      GLY  34 -14.071  -4.418   7.082
  198    H    HIS  35           H        HIS  35 -11.866  -3.169   8.247
  199    HA   HIS  35           HA       HIS  35 -12.455  -0.492   7.971
  200    HB3  HIS  35           2HB      HIS  35 -10.171  -0.103   9.019
  201    HD2  HIS  35           2HD      HIS  35 -12.183   0.702  10.875
  202    HE1  HIS  35           1HE      HIS  35 -12.363  -3.075  12.799
  203    HE2  HIS  35           2HE      HIS  35 -13.098  -0.667  12.870
  204    H    ARG  36           H        ARG  36 -10.388   1.086   7.495
  205    HA   ARG  36           HA       ARG  36  -9.205   0.399   4.920
  206    HB3  ARG  36           2HB      ARG  36  -9.969   2.495   3.884
  207    HG3  ARG  36           2HG      ARG  36 -11.976   0.508   4.804
  208    HD3  ARG  36           2HD      ARG  36 -12.722   2.877   3.106
  209    HE   ARG  36           HE       ARG  36 -14.821   1.433   4.360
  210   HH11  ARG  36          1HH1      ARG  36 -12.586   1.317   1.693
  211   HH12  ARG  36          2HH1      ARG  36 -13.609   0.322   0.710
  212   HH21  ARG  36          1HH2      ARG  36 -16.176   0.124   3.075
  213   HH22  ARG  36          2HH2      ARG  36 -15.651  -0.356   1.496
  214    H    PHE  37           H        PHE  37  -7.491   1.856   4.279
  215    HA   PHE  37           HA       PHE  37  -6.549   3.758   6.265
  216    HB3  PHE  37           2HB      PHE  37  -4.232   2.637   6.147
  217    HD1  PHE  37           1HD      PHE  37  -6.746   0.091   7.018
  218    HD2  PHE  37           2HD      PHE  37  -4.276   3.255   8.434
  219    HE1  PHE  37           1HE      PHE  37  -7.238  -0.569   9.337
  220    HE2  PHE  37           2HE      PHE  37  -4.762   2.600  10.755
  221    HZ   PHE  37           HZ       PHE  37  -6.244   0.686  11.209
  222    H    CYS  38           H        CYS  38  -4.586   4.932   5.490
  223    HA   CYS  38           HA       CYS  38  -4.901   5.522   2.662
  224    HB3  CYS  38           2HB      CYS  38  -4.794   7.328   4.400
  225    H    GLU  39           H        GLU  39  -2.842   6.030   1.417
  226    HA   GLU  39           HA       GLU  39  -1.388   3.747   0.949
  227    HB3  GLU  39           2HB      GLU  39   0.397   5.669   0.193
  228    HG3  GLU  39           2HG      GLU  39  -2.088   5.351  -1.427
  229    H    SER  40           H        SER  40  -0.123   6.618   2.653
  230    HA   SER  40           HA       SER  40   2.283   5.601   3.490
  231    HB3  SER  40           2HB      SER  40   0.440   7.685   4.534
  232    HG   SER  40           HG       SER  40   2.039   8.030   6.257
  233    H    CYS  41           H        CYS  41  -0.216   6.016   5.953
  234    HA   CYS  41           HA       CYS  41   0.604   4.351   7.860
  235    HB3  CYS  41           2HB      CYS  41  -1.802   3.828   8.371
  236    H    MET  42           H        MET  42  -1.315   3.232   5.076
  237    HA   MET  42           HA       MET  42  -1.463   0.548   5.660
  238    HB3  MET  42           2HB      MET  42  -1.169   1.941   3.000
  239    HG3  MET  42           2HG      MET  42  -0.632  -0.663   3.184
  240    HE1  MET  42           3HE      MET  42  -4.054  -1.508   5.272
  241    HE2  MET  42           1HE      MET  42  -2.322  -1.247   5.481
  242    HE3  MET  42           2HE      MET  42  -3.378   0.115   5.113
  243    H    ALA  43           H        ALA  43   1.124   2.200   3.855
  244    HA   ALA  43           HA       ALA  43   2.721  -0.104   3.493
  245    HB1  ALA  43           3HB      ALA  43   3.738   1.317   2.127
  246    HB2  ALA  43           1HB      ALA  43   2.868   2.675   2.843
  247    HB3  ALA  43           2HB      ALA  43   4.407   2.154   3.529
  248    H    ALA  44           H        ALA  44   2.271   2.043   6.163
  249    HA   ALA  44           HA       ALA  44   4.737   1.478   7.493
  250    HB1  ALA  44           3HB      ALA  44   2.241   2.435   8.855
  251    HB2  ALA  44           1HB      ALA  44   3.924   2.767   9.267
  252    HB3  ALA  44           2HB      ALA  44   3.207   3.498   7.831
  253    H    LEU  45           H        LEU  45   1.377   0.420   8.048
  254    HA   LEU  45           HA       LEU  45   1.913  -1.354  10.137
  255    HB3  LEU  45           2HB      LEU  45  -0.233  -2.396   9.573
  256    HG   LEU  45           HG       LEU  45  -0.347   0.608   9.317
  257   HD11  LEU  45          1HD1      LEU  45  -2.628   0.546   9.494
  258   HD12  LEU  45          2HD1      LEU  45  -2.640  -1.051  10.244
  259   HD13  LEU  45          3HD1      LEU  45  -2.347  -0.892   8.512
  260   HD21  LEU  45          3HD2      LEU  45   0.159  -1.174  11.511
  261   HD22  LEU  45          1HD2      LEU  45  -1.346  -0.292  11.777
  262   HD23  LEU  45          2HD2      LEU  45   0.153   0.590  11.480
  263    H    LEU  46           H        LEU  46   1.528  -2.052   6.662
  264    HA   LEU  46           HA       LEU  46   1.989  -4.763   6.688
  265    HB3  LEU  46           2HB      LEU  46   2.764  -4.530   4.383
  266    HG   LEU  46           HG       LEU  46   0.455  -2.725   5.065
  267   HD11  LEU  46          1HD1      LEU  46   1.524  -1.949   2.988
  268   HD12  LEU  46          2HD1      LEU  46  -0.076  -2.633   2.710
  269   HD13  LEU  46          3HD1      LEU  46   1.363  -3.573   2.318
  270   HD21  LEU  46          3HD2      LEU  46  -0.069  -5.057   3.448
  271   HD22  LEU  46          1HD2      LEU  46  -0.770  -4.578   4.995
  272   HD23  LEU  46          2HD2      LEU  46   0.737  -5.494   4.955
  273    H    SER  47           H        SER  47   4.274  -2.161   7.075
  274    HA   SER  47           HA       SER  47   6.548  -3.978   6.884
  275    HB3  SER  47           2HB      SER  47   7.257  -1.320   7.751
  276    HG   SER  47           HG       SER  47   7.607  -2.474   5.191
  277    H    SER  48           H        SER  48   4.596  -4.250   9.040
  278    HA   SER  48           HA       SER  48   6.291  -3.605  11.361
  279    HB3  SER  48           2HB      SER  48   3.323  -4.202  11.349
  280    HG   SER  48           HG       SER  48   4.021  -2.828  13.448
  281    H    SER  49           H        SER  49   6.132  -5.994   9.401
  282    HA   SER  49           HA       SER  49   6.718  -8.197   9.584
  283    HB3  SER  49           2HB      SER  49   6.358  -8.101  12.568
  284    HG   SER  49           HG       SER  49   6.972 -10.074  11.662
  285    H    SER  50           H        SER  50   4.322  -7.470  12.128
  286    HA   SER  50           HA       SER  50   2.579  -9.521  10.927
  287    HB3  SER  50           2HB      SER  50   1.645  -9.782  13.280
  288    HG   SER  50           HG       SER  50   3.983 -10.713  13.868
  289    HA   PRO  51           HA       PRO  51   0.455  -5.382  10.807
  290    HB3  PRO  51           2HB      PRO  51   1.219  -4.948   8.685
  291    HG3  PRO  51           2HG      PRO  51   1.891  -6.672   7.276
  292    HD3  PRO  51           2HD      PRO  51   3.084  -7.220   9.170
  293    H    LYS  52           H        LYS  52  -1.512  -5.401  11.677
  294    HA   LYS  52           HA       LYS  52  -3.400  -7.510  10.855
  295    HB3  LYS  52           2HB      LYS  52  -4.306  -7.551  13.021
  296    HG3  LYS  52           2HG      LYS  52  -1.341  -7.295  13.083
  297    HD3  LYS  52           2HD      LYS  52  -2.841  -8.042  15.560
  298    HE3  LYS  52           2HE      LYS  52  -0.200  -6.655  15.401
  299    HZ1  LYS  52           3HZ      LYS  52  -1.233  -7.110  17.559
  300    HZ2  LYS  52           1HZ      LYS  52   0.224  -7.950  17.373
  301    HZ3  LYS  52           2HZ      LYS  52  -1.248  -8.765  17.209
  302    H    CYS  53           H        CYS  53  -3.691  -4.364  12.502
  303    HA   CYS  53           HA       CYS  53  -4.733  -2.756  10.625
  304    HB3  CYS  53           2HB      CYS  53  -6.767  -4.797  11.440
  305    H    THR  54           H        THR  54  -4.078  -1.147  11.966
  306    HA   THR  54           HA       THR  54  -4.188  -0.752  14.593
  307    HB   THR  54           HB       THR  54  -4.199   1.013  12.337
  308    HG1  THR  54           1HG      THR  54  -2.603   0.692  14.087
  309   HG21  THR  54          3HG2      THR  54  -5.209   2.996  13.421
  310   HG22  THR  54          1HG2      THR  54  -5.827   1.953  14.701
  311   HG23  THR  54          2HG2      THR  54  -6.398   1.749  13.045
  312    H    ALA  55           H        ALA  55  -6.989  -0.523  12.460
  313    HA   ALA  55           HA       ALA  55  -8.857   0.520  14.232
  314    HB1  ALA  55           3HB      ALA  55 -10.299   0.173  12.564
  315    HB2  ALA  55           1HB      ALA  55  -8.910  -0.422  11.653
  316    HB3  ALA  55           2HB      ALA  55  -9.955  -1.556  12.510
  317    H    CYS  56           H        CYS  56  -8.921  -2.910  13.316
  318    HA   CYS  56           HA       CYS  56  -9.592  -3.550  16.113
  319    HB3  CYS  56           2HB      CYS  56 -11.439  -4.021  14.608
  320    H    GLN  57           H        GLN  57  -7.534  -4.279  13.410
  321    HA   GLN  57           HA       GLN  57  -5.463  -5.288  13.432
  322    HB3  GLN  57           2HB      GLN  57  -4.471  -6.063  15.397
  323    HG3  GLN  57           2HG      GLN  57  -6.070  -4.618  17.207
  324   HE21  GLN  57          1HE2      GLN  57  -4.124  -3.041  14.768
  325   HE22  GLN  57          2HE2      GLN  57  -2.729  -2.801  15.760
  326    H    GLU  58           H        GLU  58  -6.169  -6.618  11.765
  327    HA   GLU  58           HA       GLU  58  -6.876  -9.351  12.598
  328    HB3  GLU  58           2HB      GLU  58  -7.909  -8.925  10.000
  329    HG3  GLU  58           2HG      GLU  58 -10.113  -8.855  11.580
  330    H    SER  59           H        SER  59  -6.041  -7.661   9.570
  331    HA   SER  59           HA       SER  59  -3.477  -8.757   9.295
  332    HB3  SER  59           2HB      SER  59  -4.854 -10.162   7.194
  333    HG   SER  59           HG       SER  59  -2.740 -10.572   8.197
  334    H    ILE  60           H        ILE  60  -2.484  -7.376   7.996
  335    HA   ILE  60           HA       ILE  60  -4.041  -6.103   5.842
  336    HB   ILE  60           HB       ILE  60  -1.590  -4.779   6.884
  337   HG13  ILE  60          2HG1      ILE  60  -2.935  -5.518   8.892
  338   HG21  ILE  60          1HG2      ILE  60  -3.861  -4.144   5.243
  339   HG22  ILE  60          2HG2      ILE  60  -3.720  -2.992   6.569
  340   HG23  ILE  60          3HG2      ILE  60  -2.361  -3.247   5.474
  341   HD11  ILE  60          3HD1      ILE  60  -2.255  -3.724   9.998
  342   HD12  ILE  60          1HD1      ILE  60  -1.752  -3.064   8.442
  343   HD13  ILE  60          2HD1      ILE  60  -3.341  -2.666   9.097
  344    H    VAL  61           H        VAL  61  -3.448  -6.771   3.897
  345    HA   VAL  61           HA       VAL  61  -0.601  -7.077   3.294
  346    HB   VAL  61           HB       VAL  61  -2.689  -9.190   2.765
  347   HG11  VAL  61          1HG1      VAL  61  -0.084  -8.645   1.442
  348   HG12  VAL  61          2HG1      VAL  61  -0.530 -10.324   1.750
  349   HG13  VAL  61          3HG1      VAL  61  -1.578  -9.297   0.771
  350   HG21  VAL  61          3HG2      VAL  61  -0.334 -10.289   3.804
  351   HG22  VAL  61          1HG2      VAL  61  -0.638  -8.831   4.749
  352   HG23  VAL  61          2HG2      VAL  61  -1.877 -10.080   4.634
  353    H    LYS  62           H        LYS  62  -0.055  -6.242   1.373
  354    HA   LYS  62           HA       LYS  62  -1.787  -4.666  -0.117
  355    HB3  LYS  62           2HB      LYS  62   0.540  -4.260  -0.319
  356    HG3  LYS  62           2HG      LYS  62   0.834  -7.067  -1.371
  357    HD3  LYS  62           2HD      LYS  62   2.585  -4.672  -1.475
  358    HE3  LYS  62           2HE      LYS  62   3.448  -7.365  -0.557
  359    HZ1  LYS  62           3HZ      LYS  62   5.647  -7.007  -1.489
  360    HZ2  LYS  62           1HZ      LYS  62   5.100  -5.642  -2.325
  361    HZ3  LYS  62           2HZ      LYS  62   4.501  -7.173  -2.723
  362    H    ASP  63           H        ASP  63  -0.876  -8.040  -0.548
  363    HA   ASP  63           HA       ASP  63  -2.026  -8.436  -3.082
  364    HB3  ASP  63           2HB      ASP  63  -2.022 -10.633  -1.054
  365    H    LYS  64           H        LYS  64  -3.349  -8.917   0.178
  366    HA   LYS  64           HA       LYS  64  -5.952  -9.618  -0.868
  367    HB3  LYS  64           2HB      LYS  64  -6.555 -10.137   1.321
  368    HG3  LYS  64           2HG      LYS  64  -4.668 -11.215   2.450
  369    HD3  LYS  64           2HD      LYS  64  -4.084 -11.775  -0.398
  370    HE3  LYS  64           2HE      LYS  64  -4.375 -13.195   2.138
  371    HZ1  LYS  64           3HZ      LYS  64  -5.283 -14.610  -0.301
  372    HZ2  LYS  64           1HZ      LYS  64  -6.362 -13.972   0.836
  373    HZ3  LYS  64           2HZ      LYS  64  -5.270 -15.182   1.290
  374    H    VAL  65           H        VAL  65  -4.319  -6.767  -0.388
  375    HA   VAL  65           HA       VAL  65  -6.596  -5.192   0.483
  376    HB   VAL  65           HB       VAL  65  -3.740  -4.784   0.303
  377   HG11  VAL  65          1HG1      VAL  65  -4.317  -3.474  -1.687
  378   HG12  VAL  65          2HG1      VAL  65  -5.464  -2.534  -0.729
  379   HG13  VAL  65          3HG1      VAL  65  -3.738  -2.448  -0.375
  380   HG21  VAL  65          3HG2      VAL  65  -4.689  -2.726   1.765
  381   HG22  VAL  65          1HG2      VAL  65  -6.060  -3.832   1.848
  382   HG23  VAL  65          2HG2      VAL  65  -4.468  -4.358   2.397
  383    H    PHE  66           H        PHE  66  -7.652  -3.633  -0.757
  384    HA   PHE  66           HA       PHE  66  -7.048  -3.464  -3.602
  385    HB3  PHE  66           2HB      PHE  66  -9.679  -3.754  -3.893
  386    HD1  PHE  66           2HD      PHE  66  -8.447  -4.348  -5.971
  387    HD2  PHE  66           1HD      PHE  66  -8.518  -6.898  -2.563
  388    HE1  PHE  66           2HE      PHE  66  -7.717  -6.233  -7.371
  389    HE2  PHE  66           1HE      PHE  66  -7.786  -8.787  -3.958
  390    HZ   PHE  66           HZ       PHE  66  -7.385  -8.458  -6.366
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -50.790  27.091  -5.128
    2    HA2  GLY   1           1HA      GLY   1 -51.388  28.536  -3.258
    3    HA3  GLY   1           2HA      GLY   1 -52.727  27.441  -3.570
    4    H    SER   2           H        SER   2 -52.436  25.237  -2.404
    5    HA   SER   2           HA       SER   2 -51.096  25.425   0.158
    6    HB3  SER   2           2HB      SER   2 -53.345  24.803   1.304
    7    HG   SER   2           HG       SER   2 -52.089  27.014   1.069
    8    H    SER   3           H        SER   3 -50.650  23.715  -1.979
    9    HA   SER   3           HA       SER   3 -51.068  21.160  -0.696
   10    HB3  SER   3           2HB      SER   3 -52.324  21.824  -3.357
   11    HG   SER   3           HG       SER   3 -52.754  19.419  -3.230
   12    H    GLY   4           H        GLY   4 -49.410  19.794  -1.077
   13    HA2  GLY   4           1HA      GLY   4 -47.443  20.643  -3.109
   14    HA3  GLY   4           2HA      GLY   4 -47.024  19.850  -1.597
   15    H    SER   5           H        SER   5 -46.933  19.299  -4.709
   16    HA   SER   5           HA       SER   5 -46.857  16.484  -4.476
   17    HB3  SER   5           2HB      SER   5 -49.018  17.178  -6.389
   18    HG   SER   5           HG       SER   5 -49.688  15.165  -5.837
   19    H    SER   6           H        SER   6 -45.103  16.186  -5.678
   20    HA   SER   6           HA       SER   6 -45.142  16.642  -8.486
   21    HB3  SER   6           2HB      SER   6 -42.816  18.103  -7.527
   22    HG   SER   6           HG       SER   6 -43.225  18.723  -9.492
   23    H    GLY   7           H        GLY   7 -42.411  16.654  -9.013
   24    HA2  GLY   7           1HA      GLY   7 -41.538  14.146  -7.714
   25    HA3  GLY   7           2HA      GLY   7 -41.317  14.461  -9.429
   26    H    PHE   8           H        PHE   8 -39.403  13.903  -7.180
   27    HA   PHE   8           HA       PHE   8 -37.249  15.406  -8.041
   28    HB3  PHE   8           2HB      PHE   8 -38.896  16.763  -6.009
   29    HD1  PHE   8           1HD      PHE   8 -38.107  15.858  -3.855
   30    HD2  PHE   8           2HD      PHE   8 -35.491  17.860  -6.549
   31    HE1  PHE   8           1HE      PHE   8 -36.474  16.158  -2.040
   32    HE2  PHE   8           2HE      PHE   8 -33.853  18.163  -4.739
   33    HZ   PHE   8           HZ       PHE   8 -34.342  17.311  -2.481
   34    H    VAL   9           H        VAL   9 -35.433  14.442  -7.350
   35    HA   VAL   9           HA       VAL   9 -35.549  12.864  -4.868
   36    HB   VAL   9           HB       VAL   9 -35.734  11.242  -6.599
   37   HG11  VAL   9          1HG1      VAL   9 -35.062  11.712  -8.662
   38   HG12  VAL   9          2HG1      VAL   9 -34.142  13.101  -8.082
   39   HG13  VAL   9          3HG1      VAL   9 -33.391  11.505  -8.138
   40   HG21  VAL   9          3HG2      VAL   9 -34.126  10.758  -4.776
   41   HG22  VAL   9          1HG2      VAL   9 -33.741   9.921  -6.280
   42   HG23  VAL   9          2HG2      VAL   9 -32.825  11.352  -5.806
   43    H    LYS  10           H        LYS  10 -33.575  12.602  -3.757
   44    HA   LYS  10           HA       LYS  10 -31.377  14.340  -4.657
   45    HB3  LYS  10           2HB      LYS  10 -31.432  14.273  -1.806
   46    HG3  LYS  10           2HG      LYS  10 -31.979  16.755  -2.137
   47    HD3  LYS  10           2HD      LYS  10 -29.555  15.840  -3.655
   48    HE3  LYS  10           2HE      LYS  10 -30.104  18.289  -3.254
   49    HZ1  LYS  10           3HZ      LYS  10 -29.266  18.970  -0.948
   50    HZ2  LYS  10           1HZ      LYS  10 -29.650  17.389  -0.481
   51    HZ3  LYS  10           2HZ      LYS  10 -30.857  18.411  -1.082
   52    H    THR  11           H        THR  11 -29.281  13.746  -3.927
   53    HA   THR  11           HA       THR  11 -29.076  11.015  -2.845
   54    HB   THR  11           HB       THR  11 -26.866  11.674  -4.608
   55    HG1  THR  11           1HG      THR  11 -27.959  11.847  -6.503
   56   HG21  THR  11          3HG2      THR  11 -27.448   9.473  -5.565
   57   HG22  THR  11          1HG2      THR  11 -28.909   9.449  -4.578
   58   HG23  THR  11          2HG2      THR  11 -27.324   9.427  -3.807
   59    H    VAL  12           H        VAL  12 -27.081  10.537  -1.747
   60    HA   VAL  12           HA       VAL  12 -25.493  12.875  -0.953
   61    HB   VAL  12           HB       VAL  12 -26.688  10.887   0.984
   62   HG11  VAL  12          1HG1      VAL  12 -24.467  12.808   1.196
   63   HG12  VAL  12          2HG1      VAL  12 -25.632  12.838   2.521
   64   HG13  VAL  12          3HG1      VAL  12 -24.793  11.340   2.117
   65   HG21  VAL  12          3HG2      VAL  12 -27.165  13.776   1.297
   66   HG22  VAL  12          1HG2      VAL  12 -27.944  13.021  -0.093
   67   HG23  VAL  12          2HG2      VAL  12 -28.258  12.412   1.531
   68    H    GLU  13           H        GLU  13 -23.452  12.430  -1.432
   69    HA   GLU  13           HA       GLU  13 -22.504   9.658  -1.117
   70    HB3  GLU  13           2HB      GLU  13 -20.676  10.474  -2.760
   71    HG3  GLU  13           2HG      GLU  13 -23.487  10.220  -3.805
   72    H    ASP  14           H        ASP  14 -20.860   9.276   0.236
   73    HA   ASP  14           HA       ASP  14 -19.293  11.566   1.218
   74    HB3  ASP  14           2HB      ASP  14 -19.274  10.337   3.462
   75    H    LYS  15           H        LYS  15 -17.193  11.295   0.915
   76    HA   LYS  15           HA       LYS  15 -16.077   8.926  -0.124
   77    HB3  LYS  15           2HB      LYS  15 -15.010  10.993  -0.637
   78    HG3  LYS  15           2HG      LYS  15 -13.912  11.555   2.021
   79    HD3  LYS  15           2HD      LYS  15 -14.346  13.858   1.325
   80    HE3  LYS  15           2HE      LYS  15 -12.571  12.101   0.135
   81    HZ1  LYS  15           3HZ      LYS  15 -14.340  13.092  -1.860
   82    HZ2  LYS  15           1HZ      LYS  15 -13.073  11.981  -2.008
   83    HZ3  LYS  15           2HZ      LYS  15 -12.762  13.639  -2.130
   84    H    TYR  16           H        TYR  16 -13.780   8.335   1.113
   85    HA   TYR  16           HA       TYR  16 -14.685   7.211   3.672
   86    HB3  TYR  16           2HB      TYR  16 -12.988   5.496   3.361
   87    HD1  TYR  16           2HD      TYR  16 -15.922   6.496   2.142
   88    HD2  TYR  16           1HD      TYR  16 -12.725   3.949   0.962
   89    HE1  TYR  16           2HE      TYR  16 -17.477   5.205   0.740
   90    HE2  TYR  16           1HE      TYR  16 -14.270   2.652  -0.444
   91    HH   TYR  16           HH       TYR  16 -16.804   3.459  -1.623
   92    H    LYS  17           H        LYS  17 -12.325   6.544   4.840
   93    HA   LYS  17           HA       LYS  17 -10.482   8.735   4.909
   94    HB3  LYS  17           2HB      LYS  17 -12.660   8.529   6.933
   95    HG3  LYS  17           2HG      LYS  17 -10.846  10.161   8.177
   96    HD3  LYS  17           2HD      LYS  17 -10.540   7.898   9.593
   97    HE3  LYS  17           2HE      LYS  17 -12.430  10.068   9.513
   98    HZ1  LYS  17           3HZ      LYS  17 -14.357   9.119  10.013
   99    HZ2  LYS  17           1HZ      LYS  17 -13.651   8.084  11.151
  100    HZ3  LYS  17           2HZ      LYS  17 -13.703   7.639   9.520
  101    H    CYS  18           H        CYS  18  -8.567   8.145   5.809
  102    HA   CYS  18           HA       CYS  18  -7.980   5.454   6.205
  103    HB3  CYS  18           2HB      CYS  18  -6.523   7.960   7.042
  104    H    GLU  19           H        GLU  19  -7.837   4.134   7.960
  105    HA   GLU  19           HA       GLU  19  -9.269   4.972  10.331
  106    HB3  GLU  19           2HB      GLU  19  -8.562   2.481  10.952
  107    HG3  GLU  19           2HG      GLU  19 -10.572   1.663  10.098
  108    H    LYS  20           H        LYS  20  -6.628   6.129   9.749
  109    HA   LYS  20           HA       LYS  20  -5.354   5.454  12.306
  110    HB3  LYS  20           2HB      LYS  20  -3.352   6.204  10.385
  111    HG3  LYS  20           2HG      LYS  20  -3.865   3.754  12.038
  112    HD3  LYS  20           2HD      LYS  20  -1.471   4.281  10.277
  113    HE3  LYS  20           2HE      LYS  20  -0.744   2.076  10.967
  114    HZ1  LYS  20           3HZ      LYS  20   0.031   2.643  13.027
  115    HZ2  LYS  20           1HZ      LYS  20  -1.431   3.328  13.532
  116    HZ3  LYS  20           2HZ      LYS  20  -0.428   4.169  12.460
  117    H    CYS  21           H        CYS  21  -4.738   7.678   9.586
  118    HA   CYS  21           HA       CYS  21  -4.388   9.858  11.494
  119    HB3  CYS  21           2HB      CYS  21  -2.653   9.732   9.864
  120    H    HIS  22           H        HIS  22  -6.904   8.517   9.873
  121    HA   HIS  22           HA       HIS  22  -9.029   9.190   9.417
  122    HB3  HIS  22           2HB      HIS  22  -9.885  10.569  10.968
  123    HD2  HIS  22           2HD      HIS  22  -7.811   8.642  12.397
  124    HE1  HIS  22           1HE      HIS  22  -6.384  12.087  14.422
  125    HE2  HIS  22           2HE      HIS  22  -6.386   9.569  14.346
  126    H    LEU  23           H        LEU  23  -6.767   9.787   7.610
  127    HA   LEU  23           HA       LEU  23  -7.306  12.301   6.353
  128    HB3  LEU  23           2HB      LEU  23  -5.988  10.854   4.464
  129    HG   LEU  23           HG       LEU  23  -4.883  12.406   6.774
  130   HD11  LEU  23          1HD1      LEU  23  -2.853  11.891   4.850
  131   HD12  LEU  23          2HD1      LEU  23  -3.482  10.350   5.431
  132   HD13  LEU  23          3HD1      LEU  23  -2.858  11.535   6.577
  133   HD21  LEU  23          3HD2      LEU  23  -5.821  13.742   5.054
  134   HD22  LEU  23          1HD2      LEU  23  -5.047  12.784   3.792
  135   HD23  LEU  23          2HD2      LEU  23  -4.071  13.810   4.844
  136    H    VAL  24           H        VAL  24  -9.005  12.735   5.130
  137    HA   VAL  24           HA       VAL  24 -10.864  10.815   4.253
  138    HB   VAL  24           HB       VAL  24 -10.430  13.709   3.600
  139   HG11  VAL  24          1HG1      VAL  24 -12.843  13.185   2.459
  140   HG12  VAL  24          2HG1      VAL  24 -11.326  13.353   1.571
  141   HG13  VAL  24          3HG1      VAL  24 -11.922  11.750   2.007
  142   HG21  VAL  24          3HG2      VAL  24 -12.011  14.067   5.140
  143   HG22  VAL  24          1HG2      VAL  24 -13.049  12.798   4.492
  144   HG23  VAL  24          2HG2      VAL  24 -11.755  12.389   5.619
  145    H    LEU  25           H        LEU  25 -10.686   9.396   2.660
  146    HA   LEU  25           HA       LEU  25  -9.106  10.128   0.285
  147    HB3  LEU  25           2HB      LEU  25  -7.887   8.263   0.393
  148    HG   LEU  25           HG       LEU  25  -8.991   8.287   3.169
  149   HD11  LEU  25          1HD1      LEU  25  -8.761   6.041   3.199
  150   HD12  LEU  25          2HD1      LEU  25  -7.059   6.450   3.412
  151   HD13  LEU  25          3HD1      LEU  25  -7.670   6.021   1.813
  152   HD21  LEU  25          3HD2      LEU  25  -7.242   9.879   2.511
  153   HD22  LEU  25          1HD2      LEU  25  -6.201   8.532   2.047
  154   HD23  LEU  25          2HD2      LEU  25  -6.672   8.741   3.734
  155    H    CYS  26           H        CYS  26  -9.662   8.622  -1.611
  156    HA   CYS  26           HA       CYS  26 -12.594   8.391  -1.741
  157    HB3  CYS  26           2HB      CYS  26 -11.034   8.355  -4.253
  158    H    SER  27           H        SER  27  -9.578   6.715  -2.222
  159    HA   SER  27           HA       SER  27 -11.017   4.191  -2.382
  160    HB3  SER  27           2HB      SER  27 -10.636   4.990  -4.750
  161    HG   SER  27           HG       SER  27  -8.031   4.213  -4.768
  162    HA   PRO  28           HA       PRO  28  -7.311   4.027   0.351
  163    HB3  PRO  28           2HB      PRO  28  -8.644   4.311   2.201
  164    HG3  PRO  28           2HG      PRO  28 -10.902   3.760   2.148
  165    HD3  PRO  28           2HD      PRO  28 -10.762   5.048   0.242
  166    H    LYS  29           H        LYS  29  -6.897   1.734   1.764
  167    HA   LYS  29           HA       LYS  29  -6.755  -0.309  -0.353
  168    HB3  LYS  29           2HB      LYS  29  -4.732  -1.115   0.655
  169    HG3  LYS  29           2HG      LYS  29  -3.231   0.793   0.593
  170    HD3  LYS  29           2HD      LYS  29  -5.371   1.272  -1.465
  171    HE3  LYS  29           2HE      LYS  29  -2.474   1.074  -2.069
  172    HZ1  LYS  29           3HZ      LYS  29  -3.741   1.604  -3.909
  173    HZ2  LYS  29           1HZ      LYS  29  -3.217   3.129  -3.395
  174    HZ3  LYS  29           2HZ      LYS  29  -4.789   2.613  -3.046
  175    H    GLN  30           H        GLN  30  -9.095  -0.456   0.749
  176    HA   GLN  30           HA       GLN  30  -9.754  -1.492   3.108
  177    HB3  GLN  30           2HB      GLN  30 -10.847  -3.239   1.053
  178    HG3  GLN  30           2HG      GLN  30 -11.954  -1.136   2.877
  179   HE21  GLN  30          1HE2      GLN  30 -14.455  -2.376   3.041
  180   HE22  GLN  30          2HE2      GLN  30 -15.328  -2.041   1.589
  181    H    THR  31           H        THR  31  -8.816  -2.919   4.397
  182    HA   THR  31           HA       THR  31  -7.034  -4.934   3.434
  183    HB   THR  31           HB       THR  31  -6.617  -5.491   5.687
  184    HG1  THR  31           1HG      THR  31  -8.648  -4.050   6.868
  185   HG21  THR  31          3HG2      THR  31  -7.433  -2.603   5.910
  186   HG22  THR  31          1HG2      THR  31  -6.041  -3.117   4.957
  187   HG23  THR  31          2HG2      THR  31  -6.082  -3.424   6.693
  188    H    GLU  32           H        GLU  32  -7.797  -6.956   5.411
  189    HA   GLU  32           HA       GLU  32  -9.937  -8.229   3.856
  190    HB3  GLU  32           2HB      GLU  32  -8.271  -9.716   5.842
  191    HG3  GLU  32           2HG      GLU  32  -8.761 -10.731   3.121
  192    H    CYS  33           H        CYS  33  -9.981  -6.307   6.309
  193    HA   CYS  33           HA       CYS  33 -11.787  -7.954   7.956
  194    HB3  CYS  33           2HB      CYS  33  -9.684  -7.047   9.057
  195    H    GLY  34           H        GLY  34 -11.356  -4.947   6.229
  196    HA2  GLY  34           1HA      GLY  34 -13.602  -4.248   5.240
  197    HA3  GLY  34           2HA      GLY  34 -14.116  -4.172   6.919
  198    H    HIS  35           H        HIS  35 -12.008  -2.971   8.154
  199    HA   HIS  35           HA       HIS  35 -12.438  -0.287   7.811
  200    HB3  HIS  35           2HB      HIS  35 -10.214   0.040   8.954
  201    HD2  HIS  35           2HD      HIS  35 -12.262   0.814  10.775
  202    HE1  HIS  35           1HE      HIS  35 -12.528  -3.005  12.602
  203    HE2  HIS  35           2HE      HIS  35 -13.245  -0.593  12.709
  204    H    ARG  36           H        ARG  36 -10.499   1.299   7.290
  205    HA   ARG  36           HA       ARG  36  -9.165   0.504   4.809
  206    HB3  ARG  36           2HB      ARG  36  -9.857   2.676   3.764
  207    HG3  ARG  36           2HG      ARG  36 -11.763   0.486   4.337
  208    HD3  ARG  36           2HD      ARG  36 -12.779   2.611   2.566
  209    HE   ARG  36           HE       ARG  36 -13.883   0.385   3.719
  210   HH11  ARG  36          1HH1      ARG  36 -14.632   3.785   3.646
  211   HH12  ARG  36          2HH1      ARG  36 -16.340   3.544   3.801
  212   HH21  ARG  36          1HH2      ARG  36 -16.131   0.056   3.922
  213   HH22  ARG  36          2HH2      ARG  36 -17.192   1.424   3.958
  214    H    PHE  37           H        PHE  37  -7.399   1.894   4.208
  215    HA   PHE  37           HA       PHE  37  -6.519   3.841   6.190
  216    HB3  PHE  37           2HB      PHE  37  -4.206   2.726   6.144
  217    HD1  PHE  37           1HD      PHE  37  -6.749   0.170   6.905
  218    HD2  PHE  37           2HD      PHE  37  -4.306   3.300   8.435
  219    HE1  PHE  37           1HE      PHE  37  -7.312  -0.518   9.199
  220    HE2  PHE  37           2HE      PHE  37  -4.864   2.618  10.732
  221    HZ   PHE  37           HZ       PHE  37  -6.368   0.706  11.116
  222    H    CYS  38           H        CYS  38  -4.588   5.051   5.454
  223    HA   CYS  38           HA       CYS  38  -4.835   5.631   2.624
  224    HB3  CYS  38           2HB      CYS  38  -4.722   7.419   4.393
  225    H    GLU  39           H        GLU  39  -2.713   6.176   1.450
  226    HA   GLU  39           HA       GLU  39  -1.288   3.864   0.968
  227    HB3  GLU  39           2HB      GLU  39   0.522   5.792   0.266
  228    HG3  GLU  39           2HG      GLU  39  -1.780   5.691  -1.544
  229    H    SER  40           H        SER  40   0.001   6.714   2.689
  230    HA   SER  40           HA       SER  40   2.375   5.663   3.562
  231    HB3  SER  40           2HB      SER  40   0.511   7.662   4.826
  232    HG   SER  40           HG       SER  40   3.145   7.155   5.723
  233    H    CYS  41           H        CYS  41  -0.175   6.090   5.974
  234    HA   CYS  41           HA       CYS  41   0.596   4.423   7.901
  235    HB3  CYS  41           2HB      CYS  41  -1.826   3.903   8.350
  236    H    MET  42           H        MET  42  -1.248   3.312   5.063
  237    HA   MET  42           HA       MET  42  -1.412   0.626   5.648
  238    HB3  MET  42           2HB      MET  42  -1.079   2.023   2.996
  239    HG3  MET  42           2HG      MET  42  -0.535  -0.579   3.182
  240    HE1  MET  42           3HE      MET  42  -3.319   0.183   5.067
  241    HE2  MET  42           1HE      MET  42  -3.985  -1.443   5.213
  242    HE3  MET  42           2HE      MET  42  -2.258  -1.174   5.449
  243    H    ALA  43           H        ALA  43   1.159   2.216   3.756
  244    HA   ALA  43           HA       ALA  43   2.776  -0.047   3.435
  245    HB1  ALA  43           3HB      ALA  43   3.164   2.877   3.192
  246    HB2  ALA  43           1HB      ALA  43   4.613   1.882   3.335
  247    HB3  ALA  43           2HB      ALA  43   3.469   1.589   2.027
  248    H    ALA  44           H        ALA  44   2.246   1.974   6.170
  249    HA   ALA  44           HA       ALA  44   4.700   1.362   7.524
  250    HB1  ALA  44           3HB      ALA  44   2.551   2.160   9.282
  251    HB2  ALA  44           1HB      ALA  44   4.064   2.984   8.904
  252    HB3  ALA  44           2HB      ALA  44   2.653   3.210   7.869
  253    H    LEU  45           H        LEU  45   1.307   0.391   8.058
  254    HA   LEU  45           HA       LEU  45   1.750  -1.440  10.095
  255    HB3  LEU  45           2HB      LEU  45  -0.383  -2.442   9.461
  256    HG   LEU  45           HG       LEU  45  -0.457   0.558   9.152
  257   HD11  LEU  45          1HD1      LEU  45  -2.456  -1.170   8.446
  258   HD12  LEU  45          2HD1      LEU  45  -2.681   0.502   8.956
  259   HD13  LEU  45          3HD1      LEU  45  -2.846  -0.806  10.127
  260   HD21  LEU  45          3HD2      LEU  45  -0.375  -1.306  11.443
  261   HD22  LEU  45          1HD2      LEU  45  -1.506   0.042  11.562
  262   HD23  LEU  45          2HD2      LEU  45   0.210   0.352  11.303
  263    H    LEU  46           H        LEU  46   1.493  -2.092   6.599
  264    HA   LEU  46           HA       LEU  46   1.935  -4.807   6.611
  265    HB3  LEU  46           2HB      LEU  46   2.771  -4.564   4.337
  266    HG   LEU  46           HG       LEU  46   0.551  -2.590   4.868
  267   HD11  LEU  46          1HD1      LEU  46   0.039  -3.111   2.422
  268   HD12  LEU  46          2HD1      LEU  46   1.705  -3.680   2.323
  269   HD13  LEU  46          3HD1      LEU  46   1.371  -2.004   2.757
  270   HD21  LEU  46          3HD2      LEU  46   0.648  -5.405   5.029
  271   HD22  LEU  46          1HD2      LEU  46  -0.240  -4.999   3.560
  272   HD23  LEU  46          2HD2      LEU  46  -0.767  -4.355   5.115
  273    H    SER  47           H        SER  47   4.272  -2.204   6.919
  274    HA   SER  47           HA       SER  47   6.533  -4.006   6.807
  275    HB3  SER  47           2HB      SER  47   6.880  -1.236   7.819
  276    HG   SER  47           HG       SER  47   8.136  -2.527   5.642
  277    H    SER  48           H        SER  48   4.399  -4.170   8.938
  278    HA   SER  48           HA       SER  48   6.078  -3.765  11.317
  279    HB3  SER  48           2HB      SER  48   3.113  -4.356  11.269
  280    HG   SER  48           HG       SER  48   3.225  -3.974  13.356
  281    H    SER  49           H        SER  49   5.826  -6.065   9.214
  282    HA   SER  49           HA       SER  49   6.320  -8.294   9.277
  283    HB3  SER  49           2HB      SER  49   6.116  -8.862  12.099
  284    HG   SER  49           HG       SER  49   7.540  -9.713  10.297
  285    H    SER  50           H        SER  50   4.132  -7.705  12.035
  286    HA   SER  50           HA       SER  50   2.270  -9.653  10.843
  287    HB3  SER  50           2HB      SER  50   1.568 -10.282  13.018
  288    HG   SER  50           HG       SER  50   3.422 -11.295  13.035
  289    HA   PRO  51           HA       PRO  51   0.246  -5.449  10.776
  290    HB3  PRO  51           2HB      PRO  51   1.025  -4.986   8.664
  291    HG3  PRO  51           2HG      PRO  51   1.670  -6.692   7.223
  292    HD3  PRO  51           2HD      PRO  51   2.847  -7.301   9.109
  293    H    LYS  52           H        LYS  52  -1.719  -5.462  11.650
  294    HA   LYS  52           HA       LYS  52  -3.638  -7.526  10.790
  295    HB3  LYS  52           2HB      LYS  52  -4.563  -7.559  12.950
  296    HG3  LYS  52           2HG      LYS  52  -1.594  -7.347  13.041
  297    HD3  LYS  52           2HD      LYS  52  -3.131  -8.101  15.492
  298    HE3  LYS  52           2HE      LYS  52  -0.710  -6.726  15.996
  299    HZ1  LYS  52           3HZ      LYS  52  -1.050  -9.662  16.068
  300    HZ2  LYS  52           1HZ      LYS  52  -1.815  -8.655  17.192
  301    HZ3  LYS  52           2HZ      LYS  52  -0.127  -8.683  17.094
  302    H    CYS  53           H        CYS  53  -3.895  -4.380  12.444
  303    HA   CYS  53           HA       CYS  53  -4.902  -2.755  10.561
  304    HB3  CYS  53           2HB      CYS  53  -6.971  -4.765  11.367
  305    H    THR  54           H        THR  54  -4.220  -1.161  11.908
  306    HA   THR  54           HA       THR  54  -4.336  -0.763  14.532
  307    HB   THR  54           HB       THR  54  -4.219   0.980  12.301
  308    HG1  THR  54           1HG      THR  54  -2.659   0.922  13.923
  309   HG21  THR  54          3HG2      THR  54  -5.979   2.063  14.503
  310   HG22  THR  54          1HG2      THR  54  -6.531   1.637  12.883
  311   HG23  THR  54          2HG2      THR  54  -5.378   2.954  13.105
  312    H    ALA  55           H        ALA  55  -7.125  -0.477  12.388
  313    HA   ALA  55           HA       ALA  55  -8.983   0.591  14.154
  314    HB1  ALA  55           3HB      ALA  55 -10.116  -1.462  12.431
  315    HB2  ALA  55           1HB      ALA  55 -10.420   0.275  12.477
  316    HB3  ALA  55           2HB      ALA  55  -9.042  -0.356  11.574
  317    H    CYS  56           H        CYS  56  -9.104  -2.837  13.234
  318    HA   CYS  56           HA       CYS  56  -9.797  -3.467  16.028
  319    HB3  CYS  56           2HB      CYS  56 -11.641  -3.904  14.506
  320    H    GLN  57           H        GLN  57  -7.738  -4.228  13.335
  321    HA   GLN  57           HA       GLN  57  -5.681  -5.268  13.369
  322    HB3  GLN  57           2HB      GLN  57  -4.711  -6.050  15.336
  323    HG3  GLN  57           2HG      GLN  57  -6.341  -4.609  17.136
  324   HE21  GLN  57          1HE2      GLN  57  -4.359  -2.919  14.834
  325   HE22  GLN  57          2HE2      GLN  57  -2.966  -2.760  15.844
  326    H    GLU  58           H        GLU  58  -6.412  -6.578  11.692
  327    HA   GLU  58           HA       GLU  58  -7.164  -9.303  12.513
  328    HB3  GLU  58           2HB      GLU  58  -8.524  -7.473  10.658
  329    HG3  GLU  58           2HG      GLU  58  -7.734 -10.201   9.786
  330    H    SER  59           H        SER  59  -6.293  -7.627   9.487
  331    HA   SER  59           HA       SER  59  -3.743  -8.766   9.227
  332    HB3  SER  59           2HB      SER  59  -5.044 -10.144   7.098
  333    HG   SER  59           HG       SER  59  -3.057 -10.589   8.462
  334    H    ILE  60           H        ILE  60  -2.679  -7.513   7.845
  335    HA   ILE  60           HA       ILE  60  -4.204  -6.176   5.706
  336    HB   ILE  60           HB       ILE  60  -1.769  -4.856   6.781
  337   HG13  ILE  60          2HG1      ILE  60  -3.125  -5.593   8.778
  338   HG21  ILE  60          1HG2      ILE  60  -4.117  -3.229   6.379
  339   HG22  ILE  60          2HG2      ILE  60  -2.544  -3.148   5.588
  340   HG23  ILE  60          3HG2      ILE  60  -3.788  -4.235   4.968
  341   HD11  ILE  60          3HD1      ILE  60  -3.555  -2.752   8.998
  342   HD12  ILE  60          1HD1      ILE  60  -2.440  -3.798   9.877
  343   HD13  ILE  60          2HD1      ILE  60  -1.968  -3.118   8.320
  344    H    VAL  61           H        VAL  61  -3.620  -7.159   3.874
  345    HA   VAL  61           HA       VAL  61  -0.743  -7.401   3.305
  346    HB   VAL  61           HB       VAL  61  -2.874  -9.469   2.785
  347   HG11  VAL  61          1HG1      VAL  61  -1.849  -9.799   0.815
  348   HG12  VAL  61          2HG1      VAL  61  -0.418  -8.882   1.290
  349   HG13  VAL  61          3HG1      VAL  61  -0.596 -10.564   1.790
  350   HG21  VAL  61          3HG2      VAL  61  -2.030 -10.059   4.810
  351   HG22  VAL  61          1HG2      VAL  61  -0.803 -10.817   3.794
  352   HG23  VAL  61          2HG2      VAL  61  -0.491  -9.245   4.529
  353    H    LYS  62           H        LYS  62  -0.153  -6.452   1.469
  354    HA   LYS  62           HA       LYS  62  -1.773  -4.878  -0.092
  355    HB3  LYS  62           2HB      LYS  62   0.562  -4.567  -0.272
  356    HG3  LYS  62           2HG      LYS  62   1.176  -7.064  -1.708
  357    HD3  LYS  62           2HD      LYS  62   3.218  -6.841  -0.214
  358    HE3  LYS  62           2HE      LYS  62   2.841  -4.313  -1.754
  359    HZ1  LYS  62           3HZ      LYS  62   5.032  -4.563  -1.197
  360    HZ2  LYS  62           1HZ      LYS  62   5.019  -5.336  -2.700
  361    HZ3  LYS  62           2HZ      LYS  62   4.994  -6.252  -1.279
  362    H    ASP  63           H        ASP  63  -0.985  -8.288  -0.527
  363    HA   ASP  63           HA       ASP  63  -2.127  -8.633  -3.069
  364    HB3  ASP  63           2HB      ASP  63  -2.434 -10.961  -1.349
  365    H    LYS  64           H        LYS  64  -3.507  -9.119   0.171
  366    HA   LYS  64           HA       LYS  64  -6.107  -9.767  -0.855
  367    HB3  LYS  64           2HB      LYS  64  -6.782  -9.994   1.395
  368    HG3  LYS  64           2HG      LYS  64  -4.430 -10.782   2.516
  369    HD3  LYS  64           2HD      LYS  64  -5.963 -12.356   0.449
  370    HE3  LYS  64           2HE      LYS  64  -5.367 -13.978   2.590
  371    HZ1  LYS  64           3HZ      LYS  64  -3.524 -14.778   1.027
  372    HZ2  LYS  64           1HZ      LYS  64  -4.094 -13.598  -0.044
  373    HZ3  LYS  64           2HZ      LYS  64  -5.120 -14.841   0.469
  374    H    VAL  65           H        VAL  65  -4.420  -6.878  -0.109
  375    HA   VAL  65           HA       VAL  65  -6.602  -5.193   0.520
  376    HB   VAL  65           HB       VAL  65  -3.771  -4.823  -0.193
  377   HG11  VAL  65          1HG1      VAL  65  -4.755  -3.443  -1.927
  378   HG12  VAL  65          2HG1      VAL  65  -5.780  -2.639  -0.736
  379   HG13  VAL  65          3HG1      VAL  65  -4.029  -2.426  -0.682
  380   HG21  VAL  65          3HG2      VAL  65  -5.371  -4.537   2.043
  381   HG22  VAL  65          1HG2      VAL  65  -3.702  -3.989   1.876
  382   HG23  VAL  65          2HG2      VAL  65  -5.032  -2.875   1.556
  383    H    PHE  66           H        PHE  66  -8.115  -4.294  -0.721
  384    HA   PHE  66           HA       PHE  66  -8.896  -5.016  -3.163
  385    HB3  PHE  66           2HB      PHE  66  -9.620  -2.987  -1.485
  386    HD1  PHE  66           1HD      PHE  66  -7.003  -1.873  -2.248
  387    HD2  PHE  66           2HD      PHE  66 -10.882  -1.170  -3.853
  388    HE1  PHE  66           1HE      PHE  66  -6.286   0.360  -2.992
  389    HE2  PHE  66           2HE      PHE  66 -10.172   1.064  -4.600
  390    HZ   PHE  66           HZ       PHE  66  -7.871   1.832  -4.170
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1 -46.550  -0.461   2.427
    2    HA2  GLY   1           1HA      GLY   1 -45.075   1.101   0.679
    3    HA3  GLY   1           2HA      GLY   1 -46.759   0.663   0.436
    4    H    SER   2           H        SER   2 -44.553   3.135   1.436
    5    HA   SER   2           HA       SER   2 -46.281   4.977   2.600
    6    HB3  SER   2           2HB      SER   2 -44.584   6.549   2.338
    7    HG   SER   2           HG       SER   2 -43.839   4.152   2.896
    8    H    SER   3           H        SER   3 -48.189   5.512   1.741
    9    HA   SER   3           HA       SER   3 -48.479   5.868  -1.127
   10    HB3  SER   3           2HB      SER   3 -50.858   6.064  -0.683
   11    HG   SER   3           HG       SER   3 -49.933   4.075   1.096
   12    H    GLY   4           H        GLY   4 -47.957   7.777   1.672
   13    HA2  GLY   4           1HA      GLY   4 -49.067  10.214   0.608
   14    HA3  GLY   4           2HA      GLY   4 -48.096  10.057   2.064
   15    H    SER   5           H        SER   5 -46.411  11.374   1.901
   16    HA   SER   5           HA       SER   5 -44.524  11.030  -0.246
   17    HB3  SER   5           2HB      SER   5 -44.649  13.731  -0.436
   18    HG   SER   5           HG       SER   5 -45.856  13.317  -2.381
   19    H    SER   6           H        SER   6 -44.626  10.762   2.658
   20    HA   SER   6           HA       SER   6 -42.905  12.912   3.618
   21    HB3  SER   6           2HB      SER   6 -43.171  11.882   5.822
   22    HG   SER   6           HG       SER   6 -45.086  12.725   5.958
   23    H    GLY   7           H        GLY   7 -42.005  10.950   1.594
   24    HA2  GLY   7           1HA      GLY   7 -39.644   9.976   3.069
   25    HA3  GLY   7           2HA      GLY   7 -40.477   8.930   1.927
   26    H    PHE   8           H        PHE   8 -39.181  12.255   1.994
   27    HA   PHE   8           HA       PHE   8 -38.296  11.905  -0.772
   28    HB3  PHE   8           2HB      PHE   8 -37.817  14.503   0.521
   29    HD1  PHE   8           2HD      PHE   8 -36.827  13.346  -2.009
   30    HD2  PHE   8           1HD      PHE   8 -40.434  15.430  -1.136
   31    HE1  PHE   8           2HE      PHE   8 -36.958  14.093  -4.350
   32    HE2  PHE   8           1HE      PHE   8 -40.572  16.179  -3.476
   33    HZ   PHE   8           HZ       PHE   8 -38.832  15.511  -5.085
   34    H    VAL   9           H        VAL   9 -36.300  11.213  -1.112
   35    HA   VAL   9           HA       VAL   9 -34.275  11.499   0.961
   36    HB   VAL   9           HB       VAL   9 -34.649   9.339  -0.306
   37   HG11  VAL   9          1HG1      VAL   9 -34.440  10.974  -2.524
   38   HG12  VAL   9          2HG1      VAL   9 -32.900  10.112  -2.491
   39   HG13  VAL   9          3HG1      VAL   9 -34.416   9.211  -2.520
   40   HG21  VAL   9          3HG2      VAL   9 -31.823  10.079  -0.763
   41   HG22  VAL   9          1HG2      VAL   9 -32.449  10.314   0.869
   42   HG23  VAL   9          2HG2      VAL   9 -32.512   8.718   0.122
   43    H    LYS  10           H        LYS  10 -32.140  12.299   0.485
   44    HA   LYS  10           HA       LYS  10 -32.077  14.254  -1.719
   45    HB3  LYS  10           2HB      LYS  10 -30.377  15.259   0.237
   46    HG3  LYS  10           2HG      LYS  10 -32.707  16.102  -1.124
   47    HD3  LYS  10           2HD      LYS  10 -32.804  17.333   1.557
   48    HE3  LYS  10           2HE      LYS  10 -35.343  16.851   0.843
   49    HZ1  LYS  10           3HZ      LYS  10 -35.133  19.030  -0.473
   50    HZ2  LYS  10           1HZ      LYS  10 -33.516  19.012   0.022
   51    HZ3  LYS  10           2HZ      LYS  10 -34.753  19.045   1.174
   52    H    THR  11           H        THR  11 -30.620  11.617  -0.204
   53    HA   THR  11           HA       THR  11 -28.773  10.392  -0.754
   54    HB   THR  11           HB       THR  11 -27.740  12.339  -2.744
   55    HG1  THR  11           1HG      THR  11 -29.544  12.408  -3.834
   56   HG21  THR  11          3HG2      THR  11 -27.792  10.052  -4.040
   57   HG22  THR  11          1HG2      THR  11 -27.970   9.380  -2.420
   58   HG23  THR  11          2HG2      THR  11 -26.560  10.363  -2.817
   59    H    VAL  12           H        VAL  12 -26.382  10.480  -0.610
   60    HA   VAL  12           HA       VAL  12 -25.312  12.944   0.541
   61    HB   VAL  12           HB       VAL  12 -25.092  10.293   1.972
   62   HG11  VAL  12          1HG1      VAL  12 -23.210  11.321   2.691
   63   HG12  VAL  12          2HG1      VAL  12 -23.806  12.933   2.292
   64   HG13  VAL  12          3HG1      VAL  12 -24.341  12.134   3.772
   65   HG21  VAL  12          3HG2      VAL  12 -26.808  12.707   2.513
   66   HG22  VAL  12          1HG2      VAL  12 -27.321  11.035   2.276
   67   HG23  VAL  12          2HG2      VAL  12 -26.446  11.491   3.738
   68    H    GLU  13           H        GLU  13 -23.720  13.293  -0.893
   69    HA   GLU  13           HA       GLU  13 -22.066  11.063  -1.797
   70    HB3  GLU  13           2HB      GLU  13 -22.790  12.515  -3.552
   71    HG3  GLU  13           2HG      GLU  13 -22.504  14.592  -1.658
   72    H    ASP  14           H        ASP  14 -20.217  10.587  -0.833
   73    HA   ASP  14           HA       ASP  14 -18.470  12.670   0.155
   74    HB3  ASP  14           2HB      ASP  14 -20.037  12.185   2.055
   75    H    LYS  15           H        LYS  15 -16.660  11.228   1.558
   76    HA   LYS  15           HA       LYS  15 -15.897   9.017  -0.228
   77    HB3  LYS  15           2HB      LYS  15 -13.847   9.883  -0.671
   78    HG3  LYS  15           2HG      LYS  15 -15.611  11.774  -1.045
   79    HD3  LYS  15           2HD      LYS  15 -14.502  12.466   1.516
   80    HE3  LYS  15           2HE      LYS  15 -12.874  13.712   0.080
   81    HZ1  LYS  15           3HZ      LYS  15 -13.705  15.671  -1.071
   82    HZ2  LYS  15           1HZ      LYS  15 -15.301  15.216  -0.740
   83    HZ3  LYS  15           2HZ      LYS  15 -14.342  14.260  -1.753
   84    H    TYR  16           H        TYR  16 -13.596   8.204   0.967
   85    HA   TYR  16           HA       TYR  16 -14.592   7.196   3.529
   86    HB3  TYR  16           2HB      TYR  16 -12.825   5.482   3.296
   87    HD1  TYR  16           2HD      TYR  16 -15.741   6.606   1.852
   88    HD2  TYR  16           1HD      TYR  16 -12.760   3.622   1.297
   89    HE1  TYR  16           2HE      TYR  16 -17.352   5.240   0.594
   90    HE2  TYR  16           1HE      TYR  16 -14.363   2.246   0.037
   91    HH   TYR  16           HH       TYR  16 -17.149   3.378  -1.240
   92    H    LYS  17           H        LYS  17 -12.370   6.500   4.860
   93    HA   LYS  17           HA       LYS  17 -10.493   8.687   4.997
   94    HB3  LYS  17           2HB      LYS  17 -12.676   8.330   7.009
   95    HG3  LYS  17           2HG      LYS  17 -10.897  10.056   8.222
   96    HD3  LYS  17           2HD      LYS  17 -10.553   7.825   9.676
   97    HE3  LYS  17           2HE      LYS  17 -12.460   9.969   9.575
   98    HZ1  LYS  17           3HZ      LYS  17 -14.317   8.710   9.555
   99    HZ2  LYS  17           1HZ      LYS  17 -13.959   8.521  11.198
  100    HZ3  LYS  17           2HZ      LYS  17 -13.532   7.313  10.096
  101    H    CYS  18           H        CYS  18  -8.598   8.119   5.982
  102    HA   CYS  18           HA       CYS  18  -8.018   5.386   6.290
  103    HB3  CYS  18           2HB      CYS  18  -6.525   7.881   7.095
  104    H    GLU  19           H        GLU  19  -7.800   4.077   8.056
  105    HA   GLU  19           HA       GLU  19  -9.218   4.907  10.441
  106    HB3  GLU  19           2HB      GLU  19  -8.548   2.453  11.099
  107    HG3  GLU  19           2HG      GLU  19 -10.484   1.587  10.155
  108    H    LYS  20           H        LYS  20  -6.595   6.093   9.812
  109    HA   LYS  20           HA       LYS  20  -5.284   5.464  12.361
  110    HB3  LYS  20           2HB      LYS  20  -3.317   6.211  10.398
  111    HG3  LYS  20           2HG      LYS  20  -3.769   3.793  12.113
  112    HD3  LYS  20           2HD      LYS  20  -1.412   4.302  10.298
  113    HE3  LYS  20           2HE      LYS  20  -0.641   2.134  11.025
  114    HZ1  LYS  20           3HZ      LYS  20  -0.553   4.313  12.571
  115    HZ2  LYS  20           1HZ      LYS  20   0.237   2.862  12.939
  116    HZ3  LYS  20           2HZ      LYS  20  -1.263   3.210  13.640
  117    H    CYS  21           H        CYS  21  -4.746   7.662   9.601
  118    HA   CYS  21           HA       CYS  21  -4.410   9.871  11.484
  119    HB3  CYS  21           2HB      CYS  21  -2.662   9.743   9.868
  120    H    HIS  22           H        HIS  22  -6.927   8.476   9.983
  121    HA   HIS  22           HA       HIS  22  -9.045   9.118   9.455
  122    HB3  HIS  22           2HB      HIS  22  -9.922  10.479  11.007
  123    HD2  HIS  22           2HD      HIS  22  -7.806   8.624  12.457
  124    HE1  HIS  22           1HE      HIS  22  -6.436  12.125  14.424
  125    HE2  HIS  22           2HE      HIS  22  -6.390   9.607  14.385
  126    H    LEU  23           H        LEU  23  -6.792   9.732   7.652
  127    HA   LEU  23           HA       LEU  23  -7.308  12.238   6.391
  128    HB3  LEU  23           2HB      LEU  23  -6.073  10.713   4.483
  129    HG   LEU  23           HG       LEU  23  -4.888  12.338   6.703
  130   HD11  LEU  23          1HD1      LEU  23  -2.875  11.448   6.469
  131   HD12  LEU  23          2HD1      LEU  23  -2.926  11.739   4.731
  132   HD13  LEU  23          3HD1      LEU  23  -3.546  10.225   5.390
  133   HD21  LEU  23          3HD2      LEU  23  -4.498  13.925   5.055
  134   HD22  LEU  23          1HD2      LEU  23  -6.057  13.246   4.586
  135   HD23  LEU  23          2HD2      LEU  23  -4.589  12.740   3.751
  136    H    VAL  24           H        VAL  24  -9.030  12.715   5.213
  137    HA   VAL  24           HA       VAL  24 -10.892  10.775   4.311
  138    HB   VAL  24           HB       VAL  24 -10.593  13.721   3.788
  139   HG11  VAL  24          1HG1      VAL  24 -12.510  11.781   2.538
  140   HG12  VAL  24          2HG1      VAL  24 -12.927  13.483   2.752
  141   HG13  VAL  24          3HG1      VAL  24 -11.537  13.031   1.765
  142   HG21  VAL  24          3HG2      VAL  24 -11.912  12.085   5.746
  143   HG22  VAL  24          1HG2      VAL  24 -11.731  13.839   5.693
  144   HG23  VAL  24          2HG2      VAL  24 -13.092  13.067   4.879
  145    H    LEU  25           H        LEU  25 -10.498   9.403   2.705
  146    HA   LEU  25           HA       LEU  25  -9.077  10.401   0.324
  147    HB3  LEU  25           2HB      LEU  25  -7.801   8.582   0.317
  148    HG   LEU  25           HG       LEU  25  -9.014   8.244   3.025
  149   HD11  LEU  25          1HD1      LEU  25  -6.826   6.426   2.585
  150   HD12  LEU  25          2HD1      LEU  25  -8.178   6.052   1.518
  151   HD13  LEU  25          3HD1      LEU  25  -8.424   6.119   3.263
  152   HD21  LEU  25          3HD2      LEU  25  -6.516   8.425   3.566
  153   HD22  LEU  25          1HD2      LEU  25  -7.339   9.870   2.980
  154   HD23  LEU  25          2HD2      LEU  25  -6.324   8.929   1.886
  155    H    CYS  26           H        CYS  26  -9.610   8.650  -1.560
  156    HA   CYS  26           HA       CYS  26 -12.552   8.600  -1.744
  157    HB3  CYS  26           2HB      CYS  26 -10.440   9.215  -3.790
  158    H    SER  27           H        SER  27  -9.727   6.743  -1.709
  159    HA   SER  27           HA       SER  27 -11.166   4.304  -2.010
  160    HB3  SER  27           2HB      SER  27  -9.685   5.393  -4.337
  161    HG   SER  27           HG       SER  27  -9.736   2.613  -4.123
  162    HA   PRO  28           HA       PRO  28  -7.390   4.057   0.594
  163    HB3  PRO  28           2HB      PRO  28  -8.683   4.292   2.479
  164    HG3  PRO  28           2HG      PRO  28 -10.939   3.730   2.464
  165    HD3  PRO  28           2HD      PRO  28 -10.849   5.060   0.585
  166    H    LYS  29           H        LYS  29  -6.934   1.735   1.945
  167    HA   LYS  29           HA       LYS  29  -6.873  -0.277  -0.206
  168    HB3  LYS  29           2HB      LYS  29  -4.787  -1.090   0.727
  169    HG3  LYS  29           2HG      LYS  29  -3.303   0.822   0.449
  170    HD3  LYS  29           2HD      LYS  29  -5.630   0.670  -1.459
  171    HE3  LYS  29           2HE      LYS  29  -2.952   1.825  -2.147
  172    HZ1  LYS  29           3HZ      LYS  29  -4.343   1.239  -3.983
  173    HZ2  LYS  29           1HZ      LYS  29  -4.322   2.927  -3.861
  174    HZ3  LYS  29           2HZ      LYS  29  -5.668   2.056  -3.322
  175    H    GLN  30           H        GLN  30  -9.133  -0.429   1.087
  176    HA   GLN  30           HA       GLN  30  -9.593  -1.507   3.473
  177    HB3  GLN  30           2HB      GLN  30 -10.838  -3.192   1.429
  178    HG3  GLN  30           2HG      GLN  30 -11.853  -1.222   3.454
  179   HE21  GLN  30          1HE2      GLN  30 -14.166  -1.340   3.828
  180   HE22  GLN  30          2HE2      GLN  30 -15.228  -1.549   2.483
  181    H    THR  31           H        THR  31  -8.888  -3.139   4.676
  182    HA   THR  31           HA       THR  31  -7.089  -5.093   3.523
  183    HB   THR  31           HB       THR  31  -6.446  -5.653   5.698
  184    HG1  THR  31           1HG      THR  31  -8.921  -4.540   6.579
  185   HG21  THR  31          3HG2      THR  31  -5.723  -3.657   6.546
  186   HG22  THR  31          1HG2      THR  31  -7.300  -2.888   6.381
  187   HG23  THR  31          2HG2      THR  31  -6.272  -3.105   4.964
  188    H    GLU  32           H        GLU  32  -7.724  -7.134   5.525
  189    HA   GLU  32           HA       GLU  32  -9.976  -8.365   4.111
  190    HB3  GLU  32           2HB      GLU  32  -8.450  -9.991   6.036
  191    HG3  GLU  32           2HG      GLU  32  -8.474 -10.734   3.208
  192    H    CYS  33           H        CYS  33  -9.883  -6.408   6.535
  193    HA   CYS  33           HA       CYS  33 -11.610  -8.006   8.307
  194    HB3  CYS  33           2HB      CYS  33  -9.478  -7.016   9.271
  195    H    GLY  34           H        GLY  34 -11.316  -5.068   6.438
  196    HA2  GLY  34           1HA      GLY  34 -13.577  -4.414   5.502
  197    HA3  GLY  34           2HA      GLY  34 -14.082  -4.353   7.185
  198    H    HIS  35           H        HIS  35 -11.872  -3.122   8.334
  199    HA   HIS  35           HA       HIS  35 -12.431  -0.440   8.050
  200    HB3  HIS  35           2HB      HIS  35 -10.143  -0.068   9.088
  201    HD2  HIS  35           2HD      HIS  35 -12.112   0.749  10.973
  202    HE1  HIS  35           1HE      HIS  35 -12.344  -3.040  12.866
  203    HE2  HIS  35           2HE      HIS  35 -13.034  -0.620  12.964
  204    H    ARG  36           H        ARG  36 -10.383   1.131   7.545
  205    HA   ARG  36           HA       ARG  36  -9.198   0.420   4.977
  206    HB3  ARG  36           2HB      ARG  36  -9.969   2.508   3.924
  207    HG3  ARG  36           2HG      ARG  36 -11.946   0.495   4.836
  208    HD3  ARG  36           2HD      ARG  36 -12.937   2.591   3.002
  209    HE   ARG  36           HE       ARG  36 -14.769   1.334   3.482
  210   HH11  ARG  36          1HH1      ARG  36 -12.863   1.637   6.378
  211   HH12  ARG  36          2HH1      ARG  36 -13.995   0.777   7.369
  212   HH21  ARG  36          1HH2      ARG  36 -16.267   0.200   4.775
  213   HH22  ARG  36          2HH2      ARG  36 -15.931  -0.040   6.457
  214    H    PHE  37           H        PHE  37  -7.473   1.844   4.332
  215    HA   PHE  37           HA       PHE  37  -6.539   3.777   6.297
  216    HB3  PHE  37           2HB      PHE  37  -4.219   2.662   6.175
  217    HD1  PHE  37           2HD      PHE  37  -6.717   0.110   7.070
  218    HD2  PHE  37           1HD      PHE  37  -4.257   3.293   8.459
  219    HE1  PHE  37           2HE      PHE  37  -7.196  -0.539   9.394
  220    HE2  PHE  37           1HE      PHE  37  -4.733   2.649  10.786
  221    HZ   PHE  37           HZ       PHE  37  -6.205   0.732  11.256
  222    H    CYS  38           H        CYS  38  -4.579   4.949   5.508
  223    HA   CYS  38           HA       CYS  38  -4.908   5.526   2.679
  224    HB3  CYS  38           2HB      CYS  38  -4.801   7.341   4.405
  225    H    GLU  39           H        GLU  39  -2.851   6.037   1.427
  226    HA   GLU  39           HA       GLU  39  -1.393   3.756   0.963
  227    HB3  GLU  39           2HB      GLU  39   0.385   5.575   0.118
  228    HG3  GLU  39           2HG      GLU  39  -2.309   5.211  -1.172
  229    H    SER  40           H        SER  40  -0.128   6.637   2.650
  230    HA   SER  40           HA       SER  40   2.281   5.630   3.484
  231    HB3  SER  40           2HB      SER  40   1.900   7.192   5.539
  232    HG   SER  40           HG       SER  40   1.530   8.730   3.299
  233    H    CYS  41           H        CYS  41  -0.212   6.049   5.953
  234    HA   CYS  41           HA       CYS  41   0.619   4.394   7.864
  235    HB3  CYS  41           2HB      CYS  41  -1.784   3.869   8.386
  236    H    MET  42           H        MET  42  -1.307   3.260   5.091
  237    HA   MET  42           HA       MET  42  -1.448   0.578   5.686
  238    HB3  MET  42           2HB      MET  42  -1.167   1.959   3.019
  239    HG3  MET  42           2HG      MET  42  -0.626  -0.643   3.212
  240    HE1  MET  42           3HE      MET  42  -4.036  -1.483   5.320
  241    HE2  MET  42           1HE      MET  42  -2.303  -1.221   5.520
  242    HE3  MET  42           2HE      MET  42  -3.364   0.140   5.151
  243    H    ALA  43           H        ALA  43   1.114   2.208   3.821
  244    HA   ALA  43           HA       ALA  43   2.719  -0.063   3.433
  245    HB1  ALA  43           3HB      ALA  43   4.495   2.038   3.476
  246    HB2  ALA  43           1HB      ALA  43   3.590   1.473   2.072
  247    HB3  ALA  43           2HB      ALA  43   2.969   2.808   3.044
  248    H    ALA  44           H        ALA  44   2.323   2.053   6.157
  249    HA   ALA  44           HA       ALA  44   4.755   1.385   7.485
  250    HB1  ALA  44           3HB      ALA  44   4.136   3.060   8.801
  251    HB2  ALA  44           1HB      ALA  44   2.624   3.176   7.899
  252    HB3  ALA  44           2HB      ALA  44   2.717   2.159   9.337
  253    H    LEU  45           H        LEU  45   1.375   0.464   8.183
  254    HA   LEU  45           HA       LEU  45   1.859  -1.394  10.162
  255    HB3  LEU  45           2HB      LEU  45  -0.287  -2.396   9.570
  256    HG   LEU  45           HG       LEU  45  -0.385   0.603   9.251
  257   HD11  LEU  45          1HD1      LEU  45  -2.697  -0.921  10.278
  258   HD12  LEU  45          2HD1      LEU  45  -2.385  -1.028   8.546
  259   HD13  LEU  45          3HD1      LEU  45  -2.644   0.545   9.299
  260   HD21  LEU  45          3HD2      LEU  45  -0.178  -1.232  11.552
  261   HD22  LEU  45          1HD2      LEU  45  -1.337   0.088  11.708
  262   HD23  LEU  45          2HD2      LEU  45   0.359   0.439  11.376
  263    H    LEU  46           H        LEU  46   1.534  -2.041   6.672
  264    HA   LEU  46           HA       LEU  46   2.002  -4.764   6.702
  265    HB3  LEU  46           2HB      LEU  46   2.720  -4.533   4.385
  266    HG   LEU  46           HG       LEU  46   0.427  -2.725   5.106
  267   HD11  LEU  46          1HD1      LEU  46  -0.134  -2.548   2.794
  268   HD12  LEU  46          2HD1      LEU  46   1.206  -3.597   2.331
  269   HD13  LEU  46          3HD1      LEU  46   1.528  -1.992   2.991
  270   HD21  LEU  46          3HD2      LEU  46  -0.204  -4.920   5.513
  271   HD22  LEU  46          1HD2      LEU  46   0.737  -5.548   4.159
  272   HD23  LEU  46          2HD2      LEU  46  -0.755  -4.656   3.857
  273    H    SER  47           H        SER  47   4.326  -2.107   6.702
  274    HA   SER  47           HA       SER  47   6.663  -3.579   6.296
  275    HB3  SER  47           2HB      SER  47   6.286  -1.075   7.959
  276    HG   SER  47           HG       SER  47   8.321  -2.073   8.280
  277    H    SER  48           H        SER  48   4.522  -3.612   8.920
  278    HA   SER  48           HA       SER  48   6.375  -4.233  10.999
  279    HB3  SER  48           2HB      SER  48   3.399  -4.767  10.821
  280    HG   SER  48           HG       SER  48   3.997  -4.460  13.277
  281    H    SER  49           H        SER  49   6.397  -6.319  12.158
  282    HA   SER  49           HA       SER  49   6.886  -8.461  10.311
  283    HB3  SER  49           2HB      SER  49   7.130  -8.163  13.297
  284    HG   SER  49           HG       SER  49   6.856 -10.249  13.394
  285    H    SER  50           H        SER  50   4.093  -7.310  11.473
  286    HA   SER  50           HA       SER  50   2.575  -9.573  10.773
  287    HB3  SER  50           2HB      SER  50   1.709  -9.456  13.427
  288    HG   SER  50           HG       SER  50   3.493 -11.370  12.337
  289    HA   PRO  51           HA       PRO  51   0.447  -5.453  10.847
  290    HB3  PRO  51           2HB      PRO  51   1.158  -4.977   8.715
  291    HG3  PRO  51           2HG      PRO  51   1.777  -6.673   7.250
  292    HD3  PRO  51           2HD      PRO  51   3.014  -7.276   9.098
  293    H    LYS  52           H        LYS  52  -1.551  -5.374  11.644
  294    HA   LYS  52           HA       LYS  52  -3.452  -7.497  10.889
  295    HB3  LYS  52           2HB      LYS  52  -4.330  -7.526  13.067
  296    HG3  LYS  52           2HG      LYS  52  -1.364  -7.295  13.081
  297    HD3  LYS  52           2HD      LYS  52  -2.821  -7.978  15.600
  298    HE3  LYS  52           2HE      LYS  52  -0.050  -7.206  14.790
  299    HZ1  LYS  52           3HZ      LYS  52  -0.143  -5.770  16.543
  300    HZ2  LYS  52           1HZ      LYS  52   0.259  -7.191  17.368
  301    HZ3  LYS  52           2HZ      LYS  52  -1.341  -6.641  17.361
  302    H    CYS  53           H        CYS  53  -3.696  -4.341  12.528
  303    HA   CYS  53           HA       CYS  53  -4.744  -2.730  10.659
  304    HB3  CYS  53           2HB      CYS  53  -6.788  -4.752  11.499
  305    H    THR  54           H        THR  54  -4.061  -1.124  11.989
  306    HA   THR  54           HA       THR  54  -4.140  -0.721  14.614
  307    HB   THR  54           HB       THR  54  -4.148   1.035  12.359
  308    HG1  THR  54           1HG      THR  54  -2.610   0.684  14.218
  309   HG21  THR  54          3HG2      THR  54  -5.152   3.030  13.442
  310   HG22  THR  54          1HG2      THR  54  -5.798   1.981  14.705
  311   HG23  THR  54          2HG2      THR  54  -6.341   1.793  13.037
  312    H    ALA  55           H        ALA  55  -6.963  -0.462  12.512
  313    HA   ALA  55           HA       ALA  55  -8.802   0.593  14.308
  314    HB1  ALA  55           3HB      ALA  55  -9.950  -1.468  12.604
  315    HB2  ALA  55           1HB      ALA  55 -10.258   0.268  12.649
  316    HB3  ALA  55           2HB      ALA  55  -8.892  -0.361  11.727
  317    H    CYS  56           H        CYS  56  -8.918  -2.836  13.387
  318    HA   CYS  56           HA       CYS  56  -9.567  -3.471  16.189
  319    HB3  CYS  56           2HB      CYS  56 -11.419  -3.929  14.677
  320    H    GLN  57           H        GLN  57  -7.535  -4.223  13.470
  321    HA   GLN  57           HA       GLN  57  -5.468  -5.241  13.482
  322    HB3  GLN  57           2HB      GLN  57  -4.463  -6.010  15.440
  323    HG3  GLN  57           2HG      GLN  57  -6.187  -4.513  17.176
  324   HE21  GLN  57          1HE2      GLN  57  -3.726  -3.277  14.988
  325   HE22  GLN  57          2HE2      GLN  57  -2.492  -3.092  16.184
  326    H    GLU  58           H        GLU  58  -6.199  -6.570  11.824
  327    HA   GLU  58           HA       GLU  58  -6.908  -9.299  12.671
  328    HB3  GLU  58           2HB      GLU  58  -7.984  -8.936  10.106
  329    HG3  GLU  58           2HG      GLU  58 -10.158  -8.686  11.717
  330    H    SER  59           H        SER  59  -6.103  -7.621   9.628
  331    HA   SER  59           HA       SER  59  -3.549  -8.744   9.331
  332    HB3  SER  59           2HB      SER  59  -4.832 -10.127   7.212
  333    HG   SER  59           HG       SER  59  -2.975 -10.928   8.055
  334    H    ILE  60           H        ILE  60  -2.521  -7.437   7.975
  335    HA   ILE  60           HA       ILE  60  -4.077  -6.117   5.848
  336    HB   ILE  60           HB       ILE  60  -1.638  -4.791   6.912
  337   HG13  ILE  60          2HG1      ILE  60  -2.995  -5.536   8.908
  338   HG21  ILE  60          1HG2      ILE  60  -3.849  -4.166   5.218
  339   HG22  ILE  60          2HG2      ILE  60  -3.820  -3.040   6.576
  340   HG23  ILE  60          3HG2      ILE  60  -2.399  -3.217   5.547
  341   HD11  ILE  60          3HD1      ILE  60  -3.409  -2.683   9.110
  342   HD12  ILE  60          1HD1      ILE  60  -2.335  -3.740  10.025
  343   HD13  ILE  60          2HD1      ILE  60  -1.814  -3.081   8.475
  344    H    VAL  61           H        VAL  61  -3.398  -6.507   3.852
  345    HA   VAL  61           HA       VAL  61  -0.565  -6.935   3.318
  346    HB   VAL  61           HB       VAL  61  -2.682  -8.968   2.611
  347   HG11  VAL  61          1HG1      VAL  61  -1.189  -8.574   0.710
  348   HG12  VAL  61          2HG1      VAL  61   0.208  -8.870   1.749
  349   HG13  VAL  61          3HG1      VAL  61  -0.935 -10.171   1.413
  350   HG21  VAL  61          3HG2      VAL  61  -1.245 -10.513   3.863
  351   HG22  VAL  61          1HG2      VAL  61  -0.161  -9.179   4.252
  352   HG23  VAL  61          2HG2      VAL  61  -1.810  -9.184   4.874
  353    H    LYS  62           H        LYS  62   0.059  -6.163   1.373
  354    HA   LYS  62           HA       LYS  62  -1.588  -4.433  -0.069
  355    HB3  LYS  62           2HB      LYS  62   0.786  -4.162  -0.184
  356    HG3  LYS  62           2HG      LYS  62   1.137  -6.646  -1.801
  357    HD3  LYS  62           2HD      LYS  62   2.944  -4.917  -0.116
  358    HE3  LYS  62           2HE      LYS  62   3.297  -7.559  -0.341
  359    HZ1  LYS  62           3HZ      LYS  62   3.448  -7.785  -2.643
  360    HZ2  LYS  62           1HZ      LYS  62   5.062  -7.771  -2.134
  361    HZ3  LYS  62           2HZ      LYS  62   4.381  -6.387  -2.828
  362    H    ASP  63           H        ASP  63  -0.481  -7.706  -0.935
  363    HA   ASP  63           HA       ASP  63  -1.770  -7.959  -3.370
  364    HB3  ASP  63           2HB      ASP  63  -1.269 -10.204  -3.258
  365    H    LYS  64           H        LYS  64  -3.006  -8.805  -0.144
  366    HA   LYS  64           HA       LYS  64  -5.611  -9.470  -1.171
  367    HB3  LYS  64           2HB      LYS  64  -6.174 -10.073   1.024
  368    HG3  LYS  64           2HG      LYS  64  -4.354 -11.330   1.949
  369    HD3  LYS  64           2HD      LYS  64  -3.601 -11.473  -0.909
  370    HE3  LYS  64           2HE      LYS  64  -3.190 -13.176   1.002
  371    HZ1  LYS  64           3HZ      LYS  64  -5.047 -14.868   0.969
  372    HZ2  LYS  64           1HZ      LYS  64  -6.041 -13.641   0.361
  373    HZ3  LYS  64           2HZ      LYS  64  -5.325 -13.472   1.884
  374    H    VAL  65           H        VAL  65  -4.134  -6.607  -0.886
  375    HA   VAL  65           HA       VAL  65  -6.424  -5.141   0.196
  376    HB   VAL  65           HB       VAL  65  -3.577  -4.618  -0.011
  377   HG11  VAL  65          1HG1      VAL  65  -4.257  -3.202  -1.886
  378   HG12  VAL  65          2HG1      VAL  65  -5.439  -2.397  -0.851
  379   HG13  VAL  65          3HG1      VAL  65  -3.715  -2.235  -0.514
  380   HG21  VAL  65          3HG2      VAL  65  -5.908  -3.661   1.596
  381   HG22  VAL  65          1HG2      VAL  65  -4.451  -4.505   2.122
  382   HG23  VAL  65          2HG2      VAL  65  -4.372  -2.799   1.681
  383    H    PHE  66           H        PHE  66  -7.576  -3.620  -0.980
  384    HA   PHE  66           HA       PHE  66  -6.946  -3.036  -3.718
  385    HB3  PHE  66           2HB      PHE  66  -7.927  -5.024  -4.374
  386    HD1  PHE  66           1HD      PHE  66 -10.637  -3.802  -2.122
  387    HD2  PHE  66           2HD      PHE  66  -8.141  -7.042  -3.301
  388    HE1  PHE  66           1HE      PHE  66 -11.830  -5.285  -0.563
  389    HE2  PHE  66           2HE      PHE  66  -9.331  -8.530  -1.745
  390    HZ   PHE  66           HZ       PHE  66 -11.179  -7.652  -0.373
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1 -34.431  -4.898 -13.323
    2    HA2  GLY   1           1HA      GLY   1 -32.300  -3.896 -13.077
    3    HA3  GLY   1           2HA      GLY   1 -32.951  -2.405 -13.738
    4    H    SER   2           H        SER   2 -35.309  -2.496 -11.975
    5    HA   SER   2           HA       SER   2 -34.664  -0.784 -10.008
    6    HB3  SER   2           2HB      SER   2 -36.541  -1.995  -8.632
    7    HG   SER   2           HG       SER   2 -37.129  -1.058 -11.244
    8    H    SER   3           H        SER   3 -33.554  -0.753  -8.155
    9    HA   SER   3           HA       SER   3 -32.572  -3.326  -7.105
   10    HB3  SER   3           2HB      SER   3 -30.668  -2.175  -7.879
   11    HG   SER   3           HG       SER   3 -30.863   0.186  -6.598
   12    H    GLY   4           H        GLY   4 -34.620  -0.782  -6.483
   13    HA2  GLY   4           1HA      GLY   4 -35.117  -1.645  -3.810
   14    HA3  GLY   4           2HA      GLY   4 -34.278  -0.101  -3.832
   15    H    SER   5           H        SER   5 -35.346   1.349  -5.737
   16    HA   SER   5           HA       SER   5 -38.090   1.199  -6.202
   17    HB3  SER   5           2HB      SER   5 -37.330   2.759  -3.726
   18    HG   SER   5           HG       SER   5 -39.926   2.752  -4.783
   19    H    SER   6           H        SER   6 -35.441   3.416  -5.428
   20    HA   SER   6           HA       SER   6 -35.973   4.840  -7.925
   21    HB3  SER   6           2HB      SER   6 -36.958   6.493  -6.718
   22    HG   SER   6           HG       SER   6 -36.649   6.737  -4.475
   23    H    GLY   7           H        GLY   7 -33.918   2.955  -6.783
   24    HA2  GLY   7           1HA      GLY   7 -31.516   4.524  -6.516
   25    HA3  GLY   7           2HA      GLY   7 -31.617   2.771  -6.585
   26    H    PHE   8           H        PHE   8 -31.297   5.707  -8.426
   27    HA   PHE   8           HA       PHE   8 -30.025   4.270 -10.568
   28    HB3  PHE   8           2HB      PHE   8 -32.432   5.913 -11.329
   29    HD1  PHE   8           2HD      PHE   8 -31.281   2.592 -12.453
   30    HD2  PHE   8           1HD      PHE   8 -31.576   6.740 -13.365
   31    HE1  PHE   8           2HE      PHE   8 -30.597   2.128 -14.770
   32    HE2  PHE   8           1HE      PHE   8 -30.892   6.281 -15.683
   33    HZ   PHE   8           HZ       PHE   8 -30.401   3.974 -16.389
   34    H    VAL   9           H        VAL   9 -28.263   5.572  -9.991
   35    HA   VAL   9           HA       VAL   9 -28.193   8.120 -11.312
   36    HB   VAL   9           HB       VAL   9 -29.152   8.517  -8.935
   37   HG11  VAL   9          1HG1      VAL   9 -26.222   8.194  -8.286
   38   HG12  VAL   9          2HG1      VAL   9 -27.471   8.792  -7.192
   39   HG13  VAL   9          3HG1      VAL   9 -27.519   7.122  -7.757
   40   HG21  VAL   9          3HG2      VAL   9 -27.771  10.623  -8.740
   41   HG22  VAL   9          1HG2      VAL   9 -26.828  10.029 -10.108
   42   HG23  VAL   9          2HG2      VAL   9 -28.549  10.361 -10.301
   43    H    LYS  10           H        LYS  10 -26.065   8.948 -11.548
   44    HA   LYS  10           HA       LYS  10 -24.009   6.894 -11.198
   45    HB3  LYS  10           2HB      LYS  10 -23.892   9.440 -12.824
   46    HG3  LYS  10           2HG      LYS  10 -21.798   7.850 -12.123
   47    HD3  LYS  10           2HD      LYS  10 -23.120   6.701 -14.528
   48    HE3  LYS  10           2HE      LYS  10 -20.331   6.013 -14.482
   49    HZ1  LYS  10           3HZ      LYS  10 -21.509   5.573 -16.417
   50    HZ2  LYS  10           1HZ      LYS  10 -20.581   6.922 -16.840
   51    HZ3  LYS  10           2HZ      LYS  10 -22.221   7.107 -16.470
   52    H    THR  11           H        THR  11 -24.695  10.270 -10.444
   53    HA   THR  11           HA       THR  11 -22.353  11.214  -9.461
   54    HB   THR  11           HB       THR  11 -24.631  11.680  -7.634
   55    HG1  THR  11           1HG      THR  11 -25.972  12.451  -9.129
   56   HG21  THR  11          3HG2      THR  11 -22.439  12.983  -7.800
   57   HG22  THR  11          1HG2      THR  11 -23.930  13.923  -7.760
   58   HG23  THR  11          2HG2      THR  11 -23.092  13.662  -9.291
   59    H    VAL  12           H        VAL  12 -21.373  11.310  -7.367
   60    HA   VAL  12           HA       VAL  12 -21.930   8.944  -5.696
   61    HB   VAL  12           HB       VAL  12 -19.836   8.589  -6.829
   62   HG11  VAL  12          1HG1      VAL  12 -19.581  11.354  -6.710
   63   HG12  VAL  12          2HG1      VAL  12 -18.283  10.741  -5.685
   64   HG13  VAL  12          3HG1      VAL  12 -18.408  10.210  -7.362
   65   HG21  VAL  12          3HG2      VAL  12 -18.606   7.952  -5.006
   66   HG22  VAL  12          1HG2      VAL  12 -18.885   9.469  -4.151
   67   HG23  VAL  12          2HG2      VAL  12 -20.161   8.255  -4.233
   68    H    GLU  13           H        GLU  13 -22.472   9.376  -3.664
   69    HA   GLU  13           HA       GLU  13 -21.651  11.960  -2.511
   70    HB3  GLU  13           2HB      GLU  13 -23.790  11.805  -1.164
   71    HG3  GLU  13           2HG      GLU  13 -25.155  12.008  -3.568
   72    H    ASP  14           H        ASP  14 -19.798  10.836  -1.659
   73    HA   ASP  14           HA       ASP  14 -19.863  10.225   0.983
   74    HB3  ASP  14           2HB      ASP  14 -19.489   7.548   0.469
   75    H    LYS  15           H        LYS  15 -17.890   9.064   1.772
   76    HA   LYS  15           HA       LYS  15 -15.767   8.625  -0.127
   77    HB3  LYS  15           2HB      LYS  15 -15.663  11.044   0.027
   78    HG3  LYS  15           2HG      LYS  15 -14.946  10.996   2.905
   79    HD3  LYS  15           2HD      LYS  15 -16.538  13.044   1.397
   80    HE3  LYS  15           2HE      LYS  15 -15.121  14.508   2.976
   81    HZ1  LYS  15           3HZ      LYS  15 -17.100  14.639   3.931
   82    HZ2  LYS  15           1HZ      LYS  15 -16.716  13.290   4.875
   83    HZ3  LYS  15           2HZ      LYS  15 -17.529  13.090   3.406
   84    H    TYR  16           H        TYR  16 -13.606   8.362   1.220
   85    HA   TYR  16           HA       TYR  16 -14.286   6.799   3.626
   86    HB3  TYR  16           2HB      TYR  16 -12.515   5.254   3.077
   87    HD1  TYR  16           1HD      TYR  16 -13.326   6.351  -0.337
   88    HD2  TYR  16           2HD      TYR  16 -14.409   3.783   2.878
   89    HE1  TYR  16           1HE      TYR  16 -14.809   5.096  -1.846
   90    HE2  TYR  16           2HE      TYR  16 -15.894   2.521   1.377
   91    HH   TYR  16           HH       TYR  16 -15.841   2.908  -2.015
   92    H    LYS  17           H        LYS  17 -12.304   6.458   5.060
   93    HA   LYS  17           HA       LYS  17 -10.405   8.657   5.033
   94    HB3  LYS  17           2HB      LYS  17 -12.589   8.357   7.052
   95    HG3  LYS  17           2HG      LYS  17 -10.867  10.172   8.199
   96    HD3  LYS  17           2HD      LYS  17 -10.448   8.015   9.739
   97    HE3  LYS  17           2HE      LYS  17 -12.549  10.012   9.488
   98    HZ1  LYS  17           3HZ      LYS  17 -13.316   7.932  11.363
   99    HZ2  LYS  17           1HZ      LYS  17 -13.626   7.597   9.734
  100    HZ3  LYS  17           2HZ      LYS  17 -14.282   8.980  10.451
  101    H    CYS  18           H        CYS  18  -8.504   8.184   6.060
  102    HA   CYS  18           HA       CYS  18  -7.877   5.478   6.518
  103    HB3  CYS  18           2HB      CYS  18  -6.404   8.022   7.209
  104    H    GLU  19           H        GLU  19  -7.683   4.272   8.349
  105    HA   GLU  19           HA       GLU  19  -9.063   5.253  10.697
  106    HB3  GLU  19           2HB      GLU  19  -8.278   2.795  11.434
  107    HG3  GLU  19           2HG      GLU  19 -10.340   1.924  10.748
  108    H    LYS  20           H        LYS  20  -6.397   6.322   9.933
  109    HA   LYS  20           HA       LYS  20  -5.061   5.820  12.504
  110    HB3  LYS  20           2HB      LYS  20  -3.168   6.500  10.423
  111    HG3  LYS  20           2HG      LYS  20  -3.475   4.253  12.379
  112    HD3  LYS  20           2HD      LYS  20  -1.202   4.574  10.422
  113    HE3  LYS  20           2HE      LYS  20  -0.437   2.469  11.279
  114    HZ1  LYS  20           3HZ      LYS  20  -1.136   3.846  13.774
  115    HZ2  LYS  20           1HZ      LYS  20  -0.158   4.648  12.651
  116    HZ3  LYS  20           2HZ      LYS  20   0.338   3.166  13.297
  117    H    CYS  21           H        CYS  21  -4.747   7.936   9.645
  118    HA   CYS  21           HA       CYS  21  -4.355  10.210  11.457
  119    HB3  CYS  21           2HB      CYS  21  -2.589  10.054   9.874
  120    H    HIS  22           H        HIS  22  -6.857   8.740  10.040
  121    HA   HIS  22           HA       HIS  22  -8.976   9.341   9.469
  122    HB3  HIS  22           2HB      HIS  22  -9.846  10.760  10.969
  123    HD2  HIS  22           2HD      HIS  22  -7.657   9.074  12.504
  124    HE1  HIS  22           1HE      HIS  22  -6.342  12.740  14.186
  125    HE2  HIS  22           2HE      HIS  22  -6.231  10.227  14.327
  126    H    LEU  23           H        LEU  23  -6.692   9.900   7.657
  127    HA   LEU  23           HA       LEU  23  -7.219  12.318   6.255
  128    HB3  LEU  23           2HB      LEU  23  -6.000  10.663   4.432
  129    HG   LEU  23           HG       LEU  23  -4.810  12.460   6.512
  130   HD11  LEU  23          1HD1      LEU  23  -2.847  11.729   4.595
  131   HD12  LEU  23          2HD1      LEU  23  -3.463  10.258   5.347
  132   HD13  LEU  23          3HD1      LEU  23  -2.799  11.549   6.348
  133   HD21  LEU  23          3HD2      LEU  23  -5.795  13.613   4.699
  134   HD22  LEU  23          1HD2      LEU  23  -5.101  12.502   3.519
  135   HD23  LEU  23          2HD2      LEU  23  -4.057  13.621   4.396
  136    H    VAL  24           H        VAL  24  -8.928  12.743   5.042
  137    HA   VAL  24           HA       VAL  24 -10.794  10.753   4.241
  138    HB   VAL  24           HB       VAL  24 -10.525  13.681   3.610
  139   HG11  VAL  24          1HG1      VAL  24 -12.622  11.774   2.579
  140   HG12  VAL  24          2HG1      VAL  24 -12.715  13.533   2.478
  141   HG13  VAL  24          3HG1      VAL  24 -11.443  12.665   1.618
  142   HG21  VAL  24          3HG2      VAL  24 -12.235  14.003   5.124
  143   HG22  VAL  24          1HG2      VAL  24 -12.857  12.364   4.931
  144   HG23  VAL  24          2HG2      VAL  24 -11.379  12.644   5.852
  145    H    LEU  25           H        LEU  25 -10.475   9.355   2.647
  146    HA   LEU  25           HA       LEU  25  -9.123  10.297   0.204
  147    HB3  LEU  25           2HB      LEU  25  -7.631   8.678   0.403
  148    HG   LEU  25           HG       LEU  25  -9.051   8.132   2.957
  149   HD11  LEU  25          1HD1      LEU  25  -6.796   6.350   2.547
  150   HD12  LEU  25          2HD1      LEU  25  -8.147   5.991   1.471
  151   HD13  LEU  25          3HD1      LEU  25  -8.393   6.020   3.217
  152   HD21  LEU  25          3HD2      LEU  25  -7.351   9.819   2.937
  153   HD22  LEU  25          1HD2      LEU  25  -6.207   8.727   2.156
  154   HD23  LEU  25          2HD2      LEU  25  -6.731   8.418   3.812
  155    H    CYS  26           H        CYS  26  -9.649   8.830  -1.713
  156    HA   CYS  26           HA       CYS  26 -12.554   8.399  -1.734
  157    HB3  CYS  26           2HB      CYS  26 -11.205   8.281  -4.320
  158    H    SER  27           H        SER  27  -9.490   6.891  -2.654
  159    HA   SER  27           HA       SER  27 -10.896   4.303  -2.772
  160    HB3  SER  27           2HB      SER  27 -10.269   4.811  -5.022
  161    HG   SER  27           HG       SER  27  -8.066   5.334  -5.507
  162    HA   PRO  28           HA       PRO  28  -7.690   4.129   0.552
  163    HB3  PRO  28           2HB      PRO  28  -9.286   4.488   2.164
  164    HG3  PRO  28           2HG      PRO  28 -11.525   4.000   1.764
  165    HD3  PRO  28           2HD      PRO  28 -11.048   5.244  -0.117
  166    H    LYS  29           H        LYS  29  -7.570   1.856   2.047
  167    HA   LYS  29           HA       LYS  29  -7.350  -0.299   0.048
  168    HB3  LYS  29           2HB      LYS  29  -5.293  -1.015   1.005
  169    HG3  LYS  29           2HG      LYS  29  -3.809   0.923   0.901
  170    HD3  LYS  29           2HD      LYS  29  -6.015   0.981  -1.159
  171    HE3  LYS  29           2HE      LYS  29  -3.208   1.652  -1.821
  172    HZ1  LYS  29           3HZ      LYS  29  -4.816   1.672  -3.558
  173    HZ2  LYS  29           1HZ      LYS  29  -4.396   3.279  -3.243
  174    HZ3  LYS  29           2HZ      LYS  29  -5.864   2.663  -2.675
  175    H    GLN  30           H        GLN  30  -9.663  -0.299   1.255
  176    HA   GLN  30           HA       GLN  30 -10.228  -1.161   3.711
  177    HB3  GLN  30           2HB      GLN  30 -11.401  -2.929   1.653
  178    HG3  GLN  30           2HG      GLN  30 -12.596  -0.988   3.617
  179   HE21  GLN  30          1HE2      GLN  30 -14.857  -2.156   4.174
  180   HE22  GLN  30          2HE2      GLN  30 -15.872  -2.333   2.787
  181    H    THR  31           H        THR  31  -9.063  -2.442   4.990
  182    HA   THR  31           HA       THR  31  -7.433  -4.566   4.104
  183    HB   THR  31           HB       THR  31  -7.042  -5.081   6.403
  184    HG1  THR  31           1HG      THR  31  -9.527  -3.800   6.783
  185   HG21  THR  31          3HG2      THR  31  -7.569  -2.120   6.420
  186   HG22  THR  31          1HG2      THR  31  -6.262  -2.833   5.475
  187   HG23  THR  31          2HG2      THR  31  -6.280  -3.010   7.229
  188    H    GLU  32           H        GLU  32  -7.934  -6.662   5.845
  189    HA   GLU  32           HA       GLU  32 -10.216  -7.902   4.525
  190    HB3  GLU  32           2HB      GLU  32  -8.508  -9.401   6.449
  191    HG3  GLU  32           2HG      GLU  32 -10.063 -10.766   5.367
  192    H    CYS  33           H        CYS  33 -10.159  -5.955   6.958
  193    HA   CYS  33           HA       CYS  33 -11.891  -7.591   8.693
  194    HB3  CYS  33           2HB      CYS  33  -9.734  -6.701   9.698
  195    H    GLY  34           H        GLY  34 -11.544  -4.642   6.878
  196    HA2  GLY  34           1HA      GLY  34 -13.837  -3.930   6.027
  197    HA3  GLY  34           2HA      GLY  34 -14.242  -3.806   7.732
  198    H    HIS  35           H        HIS  35 -11.981  -2.627   8.763
  199    HA   HIS  35           HA       HIS  35 -12.423   0.070   8.351
  200    HB3  HIS  35           2HB      HIS  35 -10.172   0.401   9.432
  201    HD2  HIS  35           2HD      HIS  35 -12.256   1.241  11.222
  202    HE1  HIS  35           1HE      HIS  35 -12.364  -2.468  13.279
  203    HE2  HIS  35           2HE      HIS  35 -13.157  -0.078  13.257
  204    H    ARG  36           H        ARG  36 -10.431   1.575   7.734
  205    HA   ARG  36           HA       ARG  36  -9.153   0.655   5.276
  206    HB3  ARG  36           2HB      ARG  36  -9.868   2.848   4.175
  207    HG3  ARG  36           2HG      ARG  36 -11.628   0.510   4.632
  208    HD3  ARG  36           2HD      ARG  36 -12.654   2.599   2.808
  209    HE   ARG  36           HE       ARG  36 -14.204   0.913   2.883
  210   HH11  ARG  36          1HH1      ARG  36 -13.237   1.731   6.125
  211   HH12  ARG  36          2HH1      ARG  36 -14.453   0.750   6.875
  212   HH21  ARG  36          1HH2      ARG  36 -15.809  -0.382   3.857
  213   HH22  ARG  36          2HH2      ARG  36 -15.915  -0.453   5.583
  214    H    PHE  37           H        PHE  37  -7.382   1.977   4.599
  215    HA   PHE  37           HA       PHE  37  -6.500   4.028   6.490
  216    HB3  PHE  37           2HB      PHE  37  -4.158   2.958   6.322
  217    HD1  PHE  37           1HD      PHE  37  -6.704   0.471   7.321
  218    HD2  PHE  37           2HD      PHE  37  -4.035   3.532   8.594
  219    HE1  PHE  37           1HE      PHE  37  -7.116  -0.152   9.665
  220    HE2  PHE  37           2HE      PHE  37  -4.440   2.913  10.941
  221    HZ   PHE  37           HZ       PHE  37  -5.982   1.069  11.479
  222    H    CYS  38           H        CYS  38  -4.393   5.061   5.636
  223    HA   CYS  38           HA       CYS  38  -4.846   5.674   2.814
  224    HB3  CYS  38           2HB      CYS  38  -4.735   7.515   4.505
  225    H    GLU  39           H        GLU  39  -2.865   6.125   1.478
  226    HA   GLU  39           HA       GLU  39  -1.389   3.890   1.000
  227    HB3  GLU  39           2HB      GLU  39   0.405   5.708   0.187
  228    HG3  GLU  39           2HG      GLU  39  -2.160   5.852  -1.292
  229    H    SER  40           H        SER  40  -0.058   6.728   2.710
  230    HA   SER  40           HA       SER  40   2.329   5.658   3.529
  231    HB3  SER  40           2HB      SER  40   2.034   7.221   5.574
  232    HG   SER  40           HG       SER  40   2.014   9.089   4.050
  233    H    CYS  41           H        CYS  41  -0.088   6.142   6.050
  234    HA   CYS  41           HA       CYS  41   0.717   4.419   7.913
  235    HB3  CYS  41           2HB      CYS  41  -1.662   4.046   8.550
  236    H    MET  42           H        MET  42  -1.224   3.452   5.099
  237    HA   MET  42           HA       MET  42  -1.539   0.763   5.681
  238    HB3  MET  42           2HB      MET  42  -1.223   2.166   3.029
  239    HG3  MET  42           2HG      MET  42  -0.854  -0.472   3.190
  240    HE1  MET  42           3HE      MET  42  -3.453   0.379   5.246
  241    HE2  MET  42           1HE      MET  42  -4.206  -1.211   5.362
  242    HE3  MET  42           2HE      MET  42  -2.453  -1.056   5.483
  243    H    ALA  43           H        ALA  43   1.103   2.331   3.888
  244    HA   ALA  43           HA       ALA  43   2.574  -0.033   3.414
  245    HB1  ALA  43           3HB      ALA  43   3.149   2.881   3.265
  246    HB2  ALA  43           1HB      ALA  43   4.505   1.753   3.240
  247    HB3  ALA  43           2HB      ALA  43   3.243   1.643   2.013
  248    H    ALA  44           H        ALA  44   2.334   2.092   6.151
  249    HA   ALA  44           HA       ALA  44   4.752   1.328   7.437
  250    HB1  ALA  44           3HB      ALA  44   2.714   3.186   7.900
  251    HB2  ALA  44           1HB      ALA  44   2.715   2.121   9.306
  252    HB3  ALA  44           2HB      ALA  44   4.193   2.960   8.835
  253    H    LEU  45           H        LEU  45   1.371   0.504   8.242
  254    HA   LEU  45           HA       LEU  45   1.875  -1.425  10.146
  255    HB3  LEU  45           2HB      LEU  45  -0.336  -2.273   9.722
  256    HG   LEU  45           HG       LEU  45  -0.294   0.703   9.234
  257   HD11  LEU  45          1HD1      LEU  45  -2.380  -0.512   8.464
  258   HD12  LEU  45          2HD1      LEU  45  -2.608   0.762   9.661
  259   HD13  LEU  45          3HD1      LEU  45  -2.642  -0.930  10.157
  260   HD21  LEU  45          3HD2      LEU  45  -1.274   0.276  11.733
  261   HD22  LEU  45          1HD2      LEU  45   0.408   0.658  11.364
  262   HD23  LEU  45          2HD2      LEU  45  -0.084  -1.019  11.598
  263    H    LEU  46           H        LEU  46   1.305  -1.985   6.671
  264    HA   LEU  46           HA       LEU  46   1.687  -4.719   6.617
  265    HB3  LEU  46           2HB      LEU  46   2.296  -4.449   4.260
  266    HG   LEU  46           HG       LEU  46   0.079  -2.585   5.099
  267   HD11  LEU  46          1HD1      LEU  46   0.512  -3.688   2.340
  268   HD12  LEU  46          2HD1      LEU  46   1.119  -2.107   2.830
  269   HD13  LEU  46          3HD1      LEU  46  -0.613  -2.434   2.861
  270   HD21  LEU  46          3HD2      LEU  46  -1.296  -4.505   4.185
  271   HD22  LEU  46          1HD2      LEU  46  -0.458  -4.802   5.708
  272   HD23  LEU  46          2HD2      LEU  46   0.191  -5.455   4.203
  273    H    SER  47           H        SER  47   4.051  -2.163   6.836
  274    HA   SER  47           HA       SER  47   6.272  -3.995   6.412
  275    HB3  SER  47           2HB      SER  47   6.348  -1.062   7.157
  276    HG   SER  47           HG       SER  47   8.336  -2.395   5.711
  277    H    SER  48           H        SER  48   4.361  -4.050   8.779
  278    HA   SER  48           HA       SER  48   6.291  -3.659  10.956
  279    HB3  SER  48           2HB      SER  48   3.303  -4.141  11.095
  280    HG   SER  48           HG       SER  48   3.749  -3.285  13.287
  281    H    SER  49           H        SER  49   5.791  -5.984   8.909
  282    HA   SER  49           HA       SER  49   6.311  -8.211   8.947
  283    HB3  SER  49           2HB      SER  49   6.347  -8.572  11.863
  284    HG   SER  49           HG       SER  49   8.160  -8.986   9.725
  285    H    SER  50           H        SER  50   4.317  -7.474  11.815
  286    HA   SER  50           HA       SER  50   2.360  -9.447  10.832
  287    HB3  SER  50           2HB      SER  50   2.323  -8.816  13.716
  288    HG   SER  50           HG       SER  50   2.142 -11.140  13.745
  289    HA   PRO  51           HA       PRO  51   0.374  -5.242  11.007
  290    HB3  PRO  51           2HB      PRO  51   0.868  -4.816   8.803
  291    HG3  PRO  51           2HG      PRO  51   1.293  -6.550   7.313
  292    HD3  PRO  51           2HD      PRO  51   2.706  -7.150   9.033
  293    H    LYS  52           H        LYS  52  -1.666  -4.924  11.713
  294    HA   LYS  52           HA       LYS  52  -3.610  -7.107  11.342
  295    HB3  LYS  52           2HB      LYS  52  -4.402  -6.820  13.586
  296    HG3  LYS  52           2HG      LYS  52  -1.642  -7.459  13.120
  297    HD3  LYS  52           2HD      LYS  52  -2.042  -6.845  15.983
  298    HE3  LYS  52           2HE      LYS  52   0.400  -6.126  14.474
  299    HZ1  LYS  52           3HZ      LYS  52   1.125  -7.701  16.494
  300    HZ2  LYS  52           1HZ      LYS  52  -0.333  -7.098  17.106
  301    HZ3  LYS  52           2HZ      LYS  52   0.898  -6.031  16.649
  302    H    CYS  53           H        CYS  53  -3.743  -3.863  12.805
  303    HA   CYS  53           HA       CYS  53  -4.850  -2.318  10.929
  304    HB3  CYS  53           2HB      CYS  53  -6.875  -4.315  11.870
  305    H    THR  54           H        THR  54  -4.002  -0.779  12.302
  306    HA   THR  54           HA       THR  54  -4.149  -0.325  14.915
  307    HB   THR  54           HB       THR  54  -3.885   1.371  12.653
  308    HG1  THR  54           1HG      THR  54  -2.280   1.479  14.092
  309   HG21  THR  54          3HG2      THR  54  -4.862   3.460  13.579
  310   HG22  THR  54          1HG2      THR  54  -5.690   2.492  14.799
  311   HG23  THR  54          2HG2      THR  54  -6.079   2.279  13.092
  312    H    ALA  55           H        ALA  55  -6.878  -0.047  12.724
  313    HA   ALA  55           HA       ALA  55  -8.715   1.249  14.351
  314    HB1  ALA  55           3HB      ALA  55 -10.201   0.778  12.735
  315    HB2  ALA  55           1HB      ALA  55  -8.792   0.170  11.864
  316    HB3  ALA  55           2HB      ALA  55  -9.829  -0.946  12.755
  317    H    CYS  56           H        CYS  56  -8.902  -2.253  13.758
  318    HA   CYS  56           HA       CYS  56  -9.668  -2.593  16.584
  319    HB3  CYS  56           2HB      CYS  56 -11.526  -3.083  15.098
  320    H    GLN  57           H        GLN  57  -7.514  -3.528  14.074
  321    HA   GLN  57           HA       GLN  57  -5.520  -4.659  14.240
  322    HB3  GLN  57           2HB      GLN  57  -5.987  -6.009  16.790
  323    HG3  GLN  57           2HG      GLN  57  -3.859  -4.419  15.502
  324   HE21  GLN  57          1HE2      GLN  57  -4.163  -2.466  16.768
  325   HE22  GLN  57          2HE2      GLN  57  -3.488  -2.380  18.357
  326    H    GLU  58           H        GLU  58  -6.290  -5.979  12.563
  327    HA   GLU  58           HA       GLU  58  -7.104  -8.665  13.445
  328    HB3  GLU  58           2HB      GLU  58  -8.161  -8.456  10.914
  329    HG3  GLU  58           2HG      GLU  58  -9.926  -7.588  13.122
  330    H    SER  59           H        SER  59  -6.599  -7.549  10.151
  331    HA   SER  59           HA       SER  59  -3.911  -8.515   9.965
  332    HB3  SER  59           2HB      SER  59  -5.554 -10.090   8.114
  333    HG   SER  59           HG       SER  59  -3.841 -11.284   8.295
  334    H    ILE  60           H        ILE  60  -2.937  -7.347   8.451
  335    HA   ILE  60           HA       ILE  60  -4.584  -6.209   6.288
  336    HB   ILE  60           HB       ILE  60  -2.018  -4.916   7.071
  337   HG13  ILE  60          2HG1      ILE  60  -3.311  -5.375   9.192
  338   HG21  ILE  60          1HG2      ILE  60  -2.802  -3.188   5.874
  339   HG22  ILE  60          2HG2      ILE  60  -3.933  -4.370   5.219
  340   HG23  ILE  60          3HG2      ILE  60  -4.424  -3.327   6.553
  341   HD11  ILE  60          3HD1      ILE  60  -3.598  -2.534   9.225
  342   HD12  ILE  60          1HD1      ILE  60  -2.401  -3.547  10.030
  343   HD13  ILE  60          2HD1      ILE  60  -2.110  -2.975   8.388
  344    H    VAL  61           H        VAL  61  -4.125  -6.981   4.346
  345    HA   VAL  61           HA       VAL  61  -1.344  -7.538   3.633
  346    HB   VAL  61           HB       VAL  61  -3.597  -9.526   3.391
  347   HG11  VAL  61          1HG1      VAL  61  -1.200  -9.161   1.722
  348   HG12  VAL  61          2HG1      VAL  61  -1.483 -10.805   2.299
  349   HG13  VAL  61          3HG1      VAL  61  -2.724  -9.972   1.362
  350   HG21  VAL  61          3HG2      VAL  61  -1.203 -10.699   4.281
  351   HG22  VAL  61          1HG2      VAL  61  -1.379  -9.188   5.174
  352   HG23  VAL  61          2HG2      VAL  61  -2.668 -10.392   5.214
  353    H    LYS  62           H        LYS  62  -0.976  -6.303   1.920
  354    HA   LYS  62           HA       LYS  62  -2.595  -4.880   0.352
  355    HB3  LYS  62           2HB      LYS  62  -0.297  -4.669  -0.078
  356    HG3  LYS  62           2HG      LYS  62  -0.214  -7.563  -0.909
  357    HD3  LYS  62           2HD      LYS  62   2.237  -7.162  -0.987
  358    HE3  LYS  62           2HE      LYS  62   1.392  -5.161  -2.914
  359    HZ1  LYS  62           3HZ      LYS  62   3.238  -6.987  -2.933
  360    HZ2  LYS  62           1HZ      LYS  62   2.477  -6.520  -4.370
  361    HZ3  LYS  62           2HZ      LYS  62   2.010  -7.946  -3.592
  362    H    ASP  63           H        ASP  63  -1.838  -8.299  -0.248
  363    HA   ASP  63           HA       ASP  63  -3.297  -8.652  -2.585
  364    HB3  ASP  63           2HB      ASP  63  -3.471 -10.936  -0.767
  365    H    LYS  64           H        LYS  64  -4.360  -8.941   0.785
  366    HA   LYS  64           HA       LYS  64  -7.107  -9.401  -0.070
  367    HB3  LYS  64           2HB      LYS  64  -7.568 -10.058   2.110
  368    HG3  LYS  64           2HG      LYS  64  -5.724 -11.391   2.987
  369    HD3  LYS  64           2HD      LYS  64  -5.354 -11.699   0.063
  370    HE3  LYS  64           2HE      LYS  64  -6.245 -13.535   2.286
  371    HZ1  LYS  64           3HZ      LYS  64  -6.864 -14.908   0.680
  372    HZ2  LYS  64           1HZ      LYS  64  -5.260 -14.968   0.147
  373    HZ3  LYS  64           2HZ      LYS  64  -6.333 -13.851  -0.530
  374    H    VAL  65           H        VAL  65  -5.606  -6.801  -0.410
  375    HA   VAL  65           HA       VAL  65  -7.339  -5.038   1.180
  376    HB   VAL  65           HB       VAL  65  -4.591  -4.831   0.263
  377   HG11  VAL  65          1HG1      VAL  65  -5.508  -3.424  -1.480
  378   HG12  VAL  65          2HG1      VAL  65  -6.425  -2.500  -0.288
  379   HG13  VAL  65          3HG1      VAL  65  -4.663  -2.431  -0.293
  380   HG21  VAL  65          3HG2      VAL  65  -6.355  -3.694   2.361
  381   HG22  VAL  65          1HG2      VAL  65  -4.787  -4.488   2.505
  382   HG23  VAL  65          2HG2      VAL  65  -4.880  -2.811   1.965
  383    H    PHE  66           H        PHE  66  -8.779  -3.686   0.237
  384    HA   PHE  66           HA       PHE  66  -8.742  -2.788  -2.406
  385    HB3  PHE  66           2HB      PHE  66  -9.199  -4.848  -3.344
  386    HD1  PHE  66           2HD      PHE  66 -10.947  -4.647  -0.103
  387    HD2  PHE  66           1HD      PHE  66  -9.681  -7.158  -3.297
  388    HE1  PHE  66           2HE      PHE  66 -11.511  -6.631   1.238
  389    HE2  PHE  66           1HE      PHE  66 -10.245  -9.146  -1.961
  390    HZ   PHE  66           HZ       PHE  66 -11.160  -8.884   0.310
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -49.679  16.221  17.303
    2    HA2  GLY   1           1HA      GLY   1 -50.597  14.531  15.101
    3    HA3  GLY   1           2HA      GLY   1 -49.924  16.099  14.679
    4    H    SER   2           H        SER   2 -47.896  15.962  14.021
    5    HA   SER   2           HA       SER   2 -46.180  13.870  15.183
    6    HB3  SER   2           2HB      SER   2 -45.471  15.294  12.646
    7    HG   SER   2           HG       SER   2 -44.841  12.991  12.244
    8    H    SER   3           H        SER   3 -43.937  14.388  15.551
    9    HA   SER   3           HA       SER   3 -43.529  16.679  17.055
   10    HB3  SER   3           2HB      SER   3 -41.078  15.688  15.796
   11    HG   SER   3           HG       SER   3 -41.152  15.011  18.287
   12    H    GLY   4           H        GLY   4 -42.221  18.556  16.688
   13    HA2  GLY   4           1HA      GLY   4 -42.811  19.876  14.256
   14    HA3  GLY   4           2HA      GLY   4 -41.729  20.465  15.509
   15    H    SER   5           H        SER   5 -39.635  18.928  15.579
   16    HA   SER   5           HA       SER   5 -37.930  19.619  13.649
   17    HB3  SER   5           2HB      SER   5 -36.852  17.241  14.027
   18    HG   SER   5           HG       SER   5 -36.968  18.399  16.474
   19    H    SER   6           H        SER   6 -37.570  19.270  11.548
   20    HA   SER   6           HA       SER   6 -38.287  16.869  10.194
   21    HB3  SER   6           2HB      SER   6 -39.842  19.251   9.224
   22    HG   SER   6           HG       SER   6 -40.923  17.738   8.121
   23    H    GLY   7           H        GLY   7 -35.916  17.458  10.012
   24    HA2  GLY   7           1HA      GLY   7 -35.007  19.600   8.453
   25    HA3  GLY   7           2HA      GLY   7 -34.150  18.084   8.688
   26    H    PHE   8           H        PHE   8 -34.578  19.877   6.303
   27    HA   PHE   8           HA       PHE   8 -36.267  18.699   4.429
   28    HB3  PHE   8           2HB      PHE   8 -35.049  19.888   2.763
   29    HD1  PHE   8           1HD      PHE   8 -36.967  20.641   5.034
   30    HD2  PHE   8           2HD      PHE   8 -33.265  22.274   3.711
   31    HE1  PHE   8           1HE      PHE   8 -37.624  22.839   5.921
   32    HE2  PHE   8           2HE      PHE   8 -33.916  24.475   4.598
   33    HZ   PHE   8           HZ       PHE   8 -36.097  24.759   5.704
   34    H    VAL   9           H        VAL   9 -35.995  17.127   2.860
   35    HA   VAL   9           HA       VAL   9 -34.329  14.929   3.565
   36    HB   VAL   9           HB       VAL   9 -36.465  14.502   2.527
   37   HG11  VAL   9          1HG1      VAL   9 -35.987  15.180  -0.190
   38   HG12  VAL   9          2HG1      VAL   9 -37.248  15.779   0.890
   39   HG13  VAL   9          3HG1      VAL   9 -35.696  16.613   0.794
   40   HG21  VAL   9          3HG2      VAL   9 -34.192  13.200   1.926
   41   HG22  VAL   9          1HG2      VAL   9 -35.778  12.709   1.333
   42   HG23  VAL   9          2HG2      VAL   9 -34.710  13.664   0.306
   43    H    LYS  10           H        LYS  10 -32.180  15.501   3.452
   44    HA   LYS  10           HA       LYS  10 -31.105  15.754   0.742
   45    HB3  LYS  10           2HB      LYS  10 -29.410  17.415   1.689
   46    HG3  LYS  10           2HG      LYS  10 -32.221  18.476   1.674
   47    HD3  LYS  10           2HD      LYS  10 -29.621  19.674   0.720
   48    HE3  LYS  10           2HE      LYS  10 -32.357  20.358   0.284
   49    HZ1  LYS  10           3HZ      LYS  10 -31.599  21.634   2.500
   50    HZ2  LYS  10           1HZ      LYS  10 -32.684  22.278   1.372
   51    HZ3  LYS  10           2HZ      LYS  10 -31.054  22.727   1.329
   52    H    THR  11           H        THR  11 -29.316  14.560   0.392
   53    HA   THR  11           HA       THR  11 -28.262  13.044   2.673
   54    HB   THR  11           HB       THR  11 -27.431  12.294  -0.066
   55    HG1  THR  11           1HG      THR  11 -29.543  12.633  -0.585
   56   HG21  THR  11          3HG2      THR  11 -28.634  10.203   1.456
   57   HG22  THR  11          1HG2      THR  11 -27.569  11.129   2.513
   58   HG23  THR  11          2HG2      THR  11 -26.938  10.418   1.027
   59    H    VAL  12           H        VAL  12 -25.931  12.549   2.672
   60    HA   VAL  12           HA       VAL  12 -24.346  14.781   1.577
   61    HB   VAL  12           HB       VAL  12 -24.043  13.380   4.233
   62   HG11  VAL  12          1HG1      VAL  12 -21.846  13.707   3.977
   63   HG12  VAL  12          2HG1      VAL  12 -22.074  14.763   2.581
   64   HG13  VAL  12          3HG1      VAL  12 -22.209  15.416   4.214
   65   HG21  VAL  12          3HG2      VAL  12 -25.547  15.030   4.682
   66   HG22  VAL  12          1HG2      VAL  12 -24.064  15.972   4.833
   67   HG23  VAL  12          2HG2      VAL  12 -25.005  16.041   3.343
   68    H    GLU  13           H        GLU  13 -23.448  13.827  -0.183
   69    HA   GLU  13           HA       GLU  13 -22.284  11.170   0.029
   70    HB3  GLU  13           2HB      GLU  13 -21.958  11.292  -2.348
   71    HG3  GLU  13           2HG      GLU  13 -24.469  12.755  -2.452
   72    H    ASP  14           H        ASP  14 -20.392  11.132   1.083
   73    HA   ASP  14           HA       ASP  14 -18.329  13.073   0.264
   74    HB3  ASP  14           2HB      ASP  14 -19.124  13.259   2.650
   75    H    LYS  15           H        LYS  15 -16.178  11.804   1.542
   76    HA   LYS  15           HA       LYS  15 -15.949   9.334  -0.049
   77    HB3  LYS  15           2HB      LYS  15 -13.896   9.951  -0.785
   78    HG3  LYS  15           2HG      LYS  15 -15.376  11.969  -1.189
   79    HD3  LYS  15           2HD      LYS  15 -14.424  12.607   1.430
   80    HE3  LYS  15           2HE      LYS  15 -12.579  13.721   0.175
   81    HZ1  LYS  15           3HZ      LYS  15 -12.983  15.018  -1.559
   82    HZ2  LYS  15           1HZ      LYS  15 -14.131  15.926  -0.711
   83    HZ3  LYS  15           2HZ      LYS  15 -14.597  14.515  -1.519
   84    H    TYR  16           H        TYR  16 -13.822   8.117   0.861
   85    HA   TYR  16           HA       TYR  16 -14.583   7.309   3.528
   86    HB3  TYR  16           2HB      TYR  16 -12.920   5.531   3.235
   87    HD1  TYR  16           2HD      TYR  16 -15.814   6.734   1.894
   88    HD2  TYR  16           1HD      TYR  16 -12.875   3.764   1.096
   89    HE1  TYR  16           2HE      TYR  16 -17.467   5.455   0.601
   90    HE2  TYR  16           1HE      TYR  16 -14.520   2.475  -0.200
   91    HH   TYR  16           HH       TYR  16 -17.015   2.256  -0.307
   92    H    LYS  17           H        LYS  17 -12.552   6.694   4.972
   93    HA   LYS  17           HA       LYS  17 -10.537   8.794   4.955
   94    HB3  LYS  17           2HB      LYS  17 -12.688   8.517   7.010
   95    HG3  LYS  17           2HG      LYS  17 -10.826  10.188   8.184
   96    HD3  LYS  17           2HD      LYS  17 -10.556   7.955   9.654
   97    HE3  LYS  17           2HE      LYS  17 -12.182  10.236   9.683
   98    HZ1  LYS  17           3HZ      LYS  17 -14.213   9.356   9.341
   99    HZ2  LYS  17           1HZ      LYS  17 -14.077   8.908  10.966
  100    HZ3  LYS  17           2HZ      LYS  17 -13.744   7.783   9.749
  101    H    CYS  18           H        CYS  18  -8.631   8.197   5.898
  102    HA   CYS  18           HA       CYS  18  -8.071   5.471   6.203
  103    HB3  CYS  18           2HB      CYS  18  -6.560   7.936   7.071
  104    H    GLU  19           H        GLU  19  -7.841   4.140   7.958
  105    HA   GLU  19           HA       GLU  19  -9.275   4.934  10.344
  106    HB3  GLU  19           2HB      GLU  19  -8.535   2.466  10.961
  107    HG3  GLU  19           2HG      GLU  19 -10.504   1.599  10.072
  108    H    LYS  20           H        LYS  20  -6.630   6.115   9.711
  109    HA   LYS  20           HA       LYS  20  -5.359   5.526  12.287
  110    HB3  LYS  20           2HB      LYS  20  -3.306   6.164  10.419
  111    HG3  LYS  20           2HG      LYS  20  -3.990   3.708  11.996
  112    HD3  LYS  20           2HD      LYS  20  -1.523   4.148  10.314
  113    HE3  LYS  20           2HE      LYS  20  -0.638   2.264  11.220
  114    HZ1  LYS  20           3HZ      LYS  20  -0.975   3.688  13.120
  115    HZ2  LYS  20           1HZ      LYS  20  -1.165   2.072  13.585
  116    HZ3  LYS  20           2HZ      LYS  20  -2.524   3.058  13.372
  117    H    CYS  21           H        CYS  21  -4.678   7.618   9.480
  118    HA   CYS  21           HA       CYS  21  -4.322   9.875  11.289
  119    HB3  CYS  21           2HB      CYS  21  -2.590   9.627   9.653
  120    H    HIS  22           H        HIS  22  -6.901   8.507   9.940
  121    HA   HIS  22           HA       HIS  22  -9.008   9.182   9.412
  122    HB3  HIS  22           2HB      HIS  22  -9.840  10.743  10.812
  123    HD2  HIS  22           2HD      HIS  22  -7.881   8.683  12.313
  124    HE1  HIS  22           1HE      HIS  22  -6.432  12.080  14.402
  125    HE2  HIS  22           2HE      HIS  22  -6.512   9.564  14.324
  126    H    LEU  23           H        LEU  23  -6.646   9.756   7.608
  127    HA   LEU  23           HA       LEU  23  -7.129  12.140   6.185
  128    HB3  LEU  23           2HB      LEU  23  -6.023  10.548   4.308
  129    HG   LEU  23           HG       LEU  23  -3.745  10.975   5.635
  130   HD11  LEU  23          1HD1      LEU  23  -3.723  13.228   4.589
  131   HD12  LEU  23          2HD1      LEU  23  -5.436  13.028   4.220
  132   HD13  LEU  23          3HD1      LEU  23  -4.248  11.941   3.501
  133   HD21  LEU  23          3HD2      LEU  23  -5.456  13.191   6.703
  134   HD22  LEU  23          1HD2      LEU  23  -3.824  12.714   7.176
  135   HD23  LEU  23          2HD2      LEU  23  -5.202  11.711   7.631
  136    H    VAL  24           H        VAL  24  -8.955  12.630   5.171
  137    HA   VAL  24           HA       VAL  24 -10.899  10.746   4.369
  138    HB   VAL  24           HB       VAL  24 -10.521  13.666   3.753
  139   HG11  VAL  24          1HG1      VAL  24 -12.932  13.457   2.860
  140   HG12  VAL  24          2HG1      VAL  24 -11.598  12.995   1.802
  141   HG13  VAL  24          3HG1      VAL  24 -12.537  11.753   2.631
  142   HG21  VAL  24          3HG2      VAL  24 -11.269  13.402   5.946
  143   HG22  VAL  24          1HG2      VAL  24 -12.753  13.687   5.037
  144   HG23  VAL  24          2HG2      VAL  24 -12.320  12.050   5.527
  145    H    LEU  25           H        LEU  25 -10.504   9.285   2.828
  146    HA   LEU  25           HA       LEU  25  -9.276  10.217   0.316
  147    HB3  LEU  25           2HB      LEU  25  -7.896   8.480   0.342
  148    HG   LEU  25           HG       LEU  25  -8.991   8.170   3.101
  149   HD11  LEU  25          1HD1      LEU  25  -7.982   5.994   1.567
  150   HD12  LEU  25          2HD1      LEU  25  -8.458   6.027   3.264
  151   HD13  LEU  25          3HD1      LEU  25  -6.799   6.413   2.807
  152   HD21  LEU  25          3HD2      LEU  25  -6.326   8.826   1.871
  153   HD22  LEU  25          1HD2      LEU  25  -6.533   8.492   3.591
  154   HD23  LEU  25          2HD2      LEU  25  -7.362   9.863   2.854
  155    H    CYS  26           H        CYS  26  -9.913   8.774  -1.589
  156    HA   CYS  26           HA       CYS  26 -12.828   8.416  -1.504
  157    HB3  CYS  26           2HB      CYS  26 -12.923   8.999  -3.753
  158    H    SER  27           H        SER  27  -9.811   6.810  -2.164
  159    HA   SER  27           HA       SER  27 -11.218   4.259  -2.286
  160    HB3  SER  27           2HB      SER  27 -10.911   5.021  -4.649
  161    HG   SER  27           HG       SER  27  -8.295   4.461  -4.832
  162    HA   PRO  28           HA       PRO  28  -7.494   4.116   0.416
  163    HB3  PRO  28           2HB      PRO  28  -8.826   4.325   2.276
  164    HG3  PRO  28           2HG      PRO  28 -11.069   3.719   2.219
  165    HD3  PRO  28           2HD      PRO  28 -10.972   5.050   0.341
  166    H    LYS  29           H        LYS  29  -7.015   1.804   1.776
  167    HA   LYS  29           HA       LYS  29  -6.856  -0.199  -0.378
  168    HB3  LYS  29           2HB      LYS  29  -4.710  -0.677   0.200
  169    HG3  LYS  29           2HG      LYS  29  -3.422   1.212   0.990
  170    HD3  LYS  29           2HD      LYS  29  -5.512   2.672  -0.488
  171    HE3  LYS  29           2HE      LYS  29  -2.672   1.979  -1.225
  172    HZ1  LYS  29           3HZ      LYS  29  -4.066   2.887  -3.004
  173    HZ2  LYS  29           1HZ      LYS  29  -2.824   3.953  -2.573
  174    HZ3  LYS  29           2HZ      LYS  29  -4.407   4.243  -2.052
  175    H    GLN  30           H        GLN  30  -9.122  -0.603   0.617
  176    HA   GLN  30           HA       GLN  30  -9.794  -1.595   2.995
  177    HB3  GLN  30           2HB      GLN  30 -10.624  -3.522   0.983
  178    HG3  GLN  30           2HG      GLN  30 -11.987  -1.460   2.668
  179   HE21  GLN  30          1HE2      GLN  30 -14.350  -3.140   2.650
  180   HE22  GLN  30          2HE2      GLN  30 -15.187  -2.790   1.180
  181    H    THR  31           H        THR  31  -8.882  -2.934   4.390
  182    HA   THR  31           HA       THR  31  -6.856  -4.804   3.583
  183    HB   THR  31           HB       THR  31  -6.466  -5.208   5.873
  184    HG1  THR  31           1HG      THR  31  -8.466  -3.930   7.111
  185   HG21  THR  31          3HG2      THR  31  -7.513  -2.394   5.966
  186   HG22  THR  31          1HG2      THR  31  -6.098  -2.818   5.003
  187   HG23  THR  31          2HG2      THR  31  -6.083  -3.067   6.749
  188    H    GLU  32           H        GLU  32  -7.506  -6.779   5.642
  189    HA   GLU  32           HA       GLU  32  -9.512  -8.290   4.119
  190    HB3  GLU  32           2HB      GLU  32  -8.060  -9.842   6.084
  191    HG3  GLU  32           2HG      GLU  32  -7.211 -10.864   3.802
  192    H    CYS  33           H        CYS  33  -9.724  -6.290   6.498
  193    HA   CYS  33           HA       CYS  33 -11.505  -7.994   8.113
  194    HB3  CYS  33           2HB      CYS  33  -9.396  -7.218   9.289
  195    H    GLY  34           H        GLY  34 -11.138  -5.203   6.195
  196    HA2  GLY  34           1HA      GLY  34 -13.313  -4.331   5.358
  197    HA3  GLY  34           2HA      GLY  34 -13.808  -4.257   7.042
  198    H    HIS  35           H        HIS  35 -11.914  -3.034   8.374
  199    HA   HIS  35           HA       HIS  35 -12.196  -0.376   8.020
  200    HB3  HIS  35           2HB      HIS  35  -9.965  -0.098   9.163
  201    HD2  HIS  35           2HD      HIS  35 -12.030   0.679  10.977
  202    HE1  HIS  35           1HE      HIS  35 -12.298  -3.146  12.792
  203    HE2  HIS  35           2HE      HIS  35 -13.015  -0.734  12.907
  204    H    ARG  36           H        ARG  36 -10.713   1.317   7.251
  205    HA   ARG  36           HA       ARG  36  -9.243   0.489   4.836
  206    HB3  ARG  36           2HB      ARG  36  -9.946   2.685   3.841
  207    HG3  ARG  36           2HG      ARG  36 -11.841   0.488   4.420
  208    HD3  ARG  36           2HD      ARG  36 -12.765   2.901   2.897
  209    HE   ARG  36           HE       ARG  36 -14.333   1.274   2.477
  210   HH11  ARG  36          1HH1      ARG  36 -13.598   1.345   5.879
  211   HH12  ARG  36          2HH1      ARG  36 -14.897   0.286   6.314
  212   HH21  ARG  36          1HH2      ARG  36 -16.048  -0.121   3.037
  213   HH22  ARG  36          2HH2      ARG  36 -16.291  -0.548   4.698
  214    H    PHE  37           H        PHE  37  -7.463   1.832   4.224
  215    HA   PHE  37           HA       PHE  37  -6.522   3.759   6.203
  216    HB3  PHE  37           2HB      PHE  37  -4.247   2.662   6.178
  217    HD1  PHE  37           2HD      PHE  37  -6.508  -0.177   6.599
  218    HD2  PHE  37           1HD      PHE  37  -4.662   3.151   8.505
  219    HE1  PHE  37           2HE      PHE  37  -7.127  -1.096   8.796
  220    HE2  PHE  37           1HE      PHE  37  -5.278   2.237  10.705
  221    HZ   PHE  37           HZ       PHE  37  -6.512   0.110  10.852
  222    H    CYS  38           H        CYS  38  -4.572   4.940   5.431
  223    HA   CYS  38           HA       CYS  38  -4.893   5.562   2.611
  224    HB3  CYS  38           2HB      CYS  38  -4.747   7.327   4.414
  225    H    GLU  39           H        GLU  39  -2.657   6.267   1.558
  226    HA   GLU  39           HA       GLU  39  -1.275   3.927   0.955
  227    HB3  GLU  39           2HB      GLU  39   0.536   5.719   0.190
  228    HG3  GLU  39           2HG      GLU  39  -2.170   5.681  -1.121
  229    H    SER  40           H        SER  40   0.012   6.721   2.766
  230    HA   SER  40           HA       SER  40   2.381   5.629   3.613
  231    HB3  SER  40           2HB      SER  40   1.653   7.118   5.803
  232    HG   SER  40           HG       SER  40   2.844   8.688   4.834
  233    H    CYS  41           H        CYS  41  -0.185   6.022   6.018
  234    HA   CYS  41           HA       CYS  41   0.560   4.319   7.919
  235    HB3  CYS  41           2HB      CYS  41  -1.840   3.818   8.372
  236    H    MET  42           H        MET  42  -1.196   3.269   5.009
  237    HA   MET  42           HA       MET  42  -1.377   0.565   5.551
  238    HB3  MET  42           2HB      MET  42  -1.020   2.018   2.932
  239    HG3  MET  42           2HG      MET  42  -0.462  -0.584   3.070
  240    HE1  MET  42           3HE      MET  42  -2.202  -1.240   5.309
  241    HE2  MET  42           1HE      MET  42  -3.262   0.122   4.946
  242    HE3  MET  42           2HE      MET  42  -3.926  -1.508   5.051
  243    H    ALA  43           H        ALA  43   1.174   2.142   3.614
  244    HA   ALA  43           HA       ALA  43   2.808  -0.113   3.352
  245    HB1  ALA  43           3HB      ALA  43   4.496   2.134   3.386
  246    HB2  ALA  43           1HB      ALA  43   3.815   1.312   1.982
  247    HB3  ALA  43           2HB      ALA  43   2.959   2.673   2.710
  248    H    ALA  44           H        ALA  44   2.229   1.903   6.055
  249    HA   ALA  44           HA       ALA  44   4.722   1.362   7.396
  250    HB1  ALA  44           3HB      ALA  44   2.432   2.280   9.000
  251    HB2  ALA  44           1HB      ALA  44   4.077   2.908   8.899
  252    HB3  ALA  44           2HB      ALA  44   2.894   3.330   7.661
  253    H    LEU  45           H        LEU  45   1.326   0.486   8.064
  254    HA   LEU  45           HA       LEU  45   1.756  -1.282  10.137
  255    HB3  LEU  45           2HB      LEU  45  -0.366  -2.377   9.407
  256    HG   LEU  45           HG       LEU  45  -0.497   0.638   9.371
  257   HD11  LEU  45          1HD1      LEU  45  -2.748  -1.147  10.170
  258   HD12  LEU  45          2HD1      LEU  45  -2.472  -0.806   8.462
  259   HD13  LEU  45          3HD1      LEU  45  -2.782   0.516   9.587
  260   HD21  LEU  45          3HD2      LEU  45  -1.467  -0.306  11.776
  261   HD22  LEU  45          1HD2      LEU  45   0.111   0.433  11.504
  262   HD23  LEU  45          2HD2      LEU  45  -0.058  -1.322  11.469
  263    H    LEU  46           H        LEU  46   1.451  -2.117   6.682
  264    HA   LEU  46           HA       LEU  46   1.917  -4.822   6.830
  265    HB3  LEU  46           2HB      LEU  46   2.662  -4.716   4.536
  266    HG   LEU  46           HG       LEU  46   0.546  -2.619   5.010
  267   HD11  LEU  46          1HD1      LEU  46   0.114  -2.539   2.753
  268   HD12  LEU  46          2HD1      LEU  46   0.902  -4.083   2.435
  269   HD13  LEU  46          3HD1      LEU  46   1.875  -2.649   2.763
  270   HD21  LEU  46          3HD2      LEU  46   0.308  -5.513   4.194
  271   HD22  LEU  46          1HD2      LEU  46  -1.014  -4.383   4.484
  272   HD23  LEU  46          2HD2      LEU  46   0.018  -4.893   5.821
  273    H    SER  47           H        SER  47   4.247  -2.191   6.937
  274    HA   SER  47           HA       SER  47   6.511  -3.995   6.904
  275    HB3  SER  47           2HB      SER  47   7.076  -1.261   7.749
  276    HG   SER  47           HG       SER  47   7.817  -2.947   5.604
  277    H    SER  48           H        SER  48   4.538  -4.262   9.043
  278    HA   SER  48           HA       SER  48   6.211  -3.588  11.372
  279    HB3  SER  48           2HB      SER  48   3.236  -4.150  11.303
  280    HG   SER  48           HG       SER  48   3.789  -2.905  13.463
  281    H    SER  49           H        SER  49   5.856  -6.030   9.396
  282    HA   SER  49           HA       SER  49   6.412  -8.242   9.576
  283    HB3  SER  49           2HB      SER  49   7.327  -9.107  11.548
  284    HG   SER  49           HG       SER  49   7.829  -6.627  12.506
  285    H    SER  50           H        SER  50   4.243  -7.358  12.267
  286    HA   SER  50           HA       SER  50   2.394  -9.453  11.330
  287    HB3  SER  50           2HB      SER  50   2.647 -10.341  13.381
  288    HG   SER  50           HG       SER  50   3.454  -8.327  14.951
  289    HA   PRO  51           HA       PRO  51   0.347  -5.262  11.060
  290    HB3  PRO  51           2HB      PRO  51   1.088  -4.902   8.915
  291    HG3  PRO  51           2HG      PRO  51   1.726  -6.675   7.553
  292    HD3  PRO  51           2HD      PRO  51   2.937  -7.176   9.448
  293    H    LYS  52           H        LYS  52  -1.593  -5.264  11.989
  294    HA   LYS  52           HA       LYS  52  -3.514  -7.373  11.250
  295    HB3  LYS  52           2HB      LYS  52  -4.344  -7.394  13.422
  296    HG3  LYS  52           2HG      LYS  52  -1.405  -6.857  13.531
  297    HD3  LYS  52           2HD      LYS  52  -3.032  -7.703  15.917
  298    HE3  LYS  52           2HE      LYS  52  -0.172  -7.018  15.378
  299    HZ1  LYS  52           3HZ      LYS  52   0.172  -6.821  17.771
  300    HZ2  LYS  52           1HZ      LYS  52  -1.500  -6.853  18.029
  301    HZ3  LYS  52           2HZ      LYS  52  -0.799  -5.564  17.188
  302    H    CYS  53           H        CYS  53  -3.767  -4.167  12.784
  303    HA   CYS  53           HA       CYS  53  -4.813  -2.613  10.872
  304    HB3  CYS  53           2HB      CYS  53  -6.848  -4.629  11.739
  305    H    THR  54           H        THR  54  -4.160  -0.963  12.158
  306    HA   THR  54           HA       THR  54  -4.251  -0.488  14.770
  307    HB   THR  54           HB       THR  54  -4.180   1.184  12.495
  308    HG1  THR  54           1HG      THR  54  -3.768   1.909  15.219
  309   HG21  THR  54          3HG2      THR  54  -6.082   2.188  14.614
  310   HG22  THR  54          1HG2      THR  54  -6.465   1.865  12.925
  311   HG23  THR  54          2HG2      THR  54  -5.371   3.183  13.343
  312    H    ALA  55           H        ALA  55  -7.074  -0.116  12.650
  313    HA   ALA  55           HA       ALA  55  -8.916   0.884  14.435
  314    HB1  ALA  55           3HB      ALA  55 -10.264   0.639  12.690
  315    HB2  ALA  55           1HB      ALA  55  -8.983  -0.249  11.866
  316    HB3  ALA  55           2HB      ALA  55 -10.184  -1.117  12.823
  317    H    CYS  56           H        CYS  56  -9.152  -2.530  13.522
  318    HA   CYS  56           HA       CYS  56  -9.783  -3.150  16.329
  319    HB3  CYS  56           2HB      CYS  56 -11.582  -3.601  14.695
  320    H    GLN  57           H        GLN  57  -7.773  -4.017  13.603
  321    HA   GLN  57           HA       GLN  57  -5.701  -5.029  13.641
  322    HB3  GLN  57           2HB      GLN  57  -4.670  -5.707  15.620
  323    HG3  GLN  57           2HG      GLN  57  -6.223  -4.154  17.383
  324   HE21  GLN  57          1HE2      GLN  57  -4.422  -2.486  14.957
  325   HE22  GLN  57          2HE2      GLN  57  -2.962  -2.304  15.863
  326    H    GLU  58           H        GLU  58  -6.304  -6.484  12.081
  327    HA   GLU  58           HA       GLU  58  -7.064  -9.147  13.066
  328    HB3  GLU  58           2HB      GLU  58  -8.417  -7.482  11.013
  329    HG3  GLU  58           2HG      GLU  58  -7.547  -9.358   9.672
  330    H    SER  59           H        SER  59  -6.146  -7.524  10.022
  331    HA   SER  59           HA       SER  59  -3.636  -8.690   9.756
  332    HB3  SER  59           2HB      SER  59  -5.001 -10.172   7.714
  333    HG   SER  59           HG       SER  59  -3.998 -11.922   9.026
  334    H    ILE  60           H        ILE  60  -2.582  -7.560   8.252
  335    HA   ILE  60           HA       ILE  60  -4.144  -6.330   6.078
  336    HB   ILE  60           HB       ILE  60  -1.731  -4.907   7.062
  337   HG13  ILE  60          2HG1      ILE  60  -3.039  -5.572   9.115
  338   HG21  ILE  60          1HG2      ILE  60  -4.105  -3.339   6.624
  339   HG22  ILE  60          2HG2      ILE  60  -2.559  -3.292   5.780
  340   HG23  ILE  60          3HG2      ILE  60  -3.811  -4.421   5.264
  341   HD11  ILE  60          3HD1      ILE  60  -2.318  -3.721  10.078
  342   HD12  ILE  60          1HD1      ILE  60  -2.008  -3.052   8.477
  343   HD13  ILE  60          2HD1      ILE  60  -3.558  -2.764   9.268
  344    H    VAL  61           H        VAL  61  -3.544  -7.387   4.295
  345    HA   VAL  61           HA       VAL  61  -0.661  -7.641   3.752
  346    HB   VAL  61           HB       VAL  61  -2.803  -9.713   3.346
  347   HG11  VAL  61          1HG1      VAL  61  -0.364  -9.223   1.745
  348   HG12  VAL  61          2HG1      VAL  61  -0.693 -10.894   2.209
  349   HG13  VAL  61          3HG1      VAL  61  -1.890  -9.981   1.289
  350   HG21  VAL  61          3HG2      VAL  61  -1.856 -10.484   5.215
  351   HG22  VAL  61          1HG2      VAL  61  -0.461 -10.897   4.217
  352   HG23  VAL  61          2HG2      VAL  61  -0.502  -9.361   5.083
  353    H    LYS  62           H        LYS  62  -0.039  -6.779   1.881
  354    HA   LYS  62           HA       LYS  62  -1.535  -5.179   0.276
  355    HB3  LYS  62           2HB      LYS  62   0.786  -5.088  -0.043
  356    HG3  LYS  62           2HG      LYS  62   0.782  -7.991  -0.849
  357    HD3  LYS  62           2HD      LYS  62   2.686  -5.816  -1.173
  358    HE3  LYS  62           2HE      LYS  62   3.337  -7.315   0.979
  359    HZ1  LYS  62           3HZ      LYS  62   5.287  -8.648  -0.291
  360    HZ2  LYS  62           1HZ      LYS  62   3.994  -8.888  -1.354
  361    HZ3  LYS  62           2HZ      LYS  62   3.856  -9.357   0.264
  362    H    ASP  63           H        ASP  63  -0.998  -8.653  -0.174
  363    HA   ASP  63           HA       ASP  63  -2.309  -8.977  -2.607
  364    HB3  ASP  63           2HB      ASP  63  -2.872 -11.261  -1.022
  365    H    LYS  64           H        LYS  64  -3.638  -9.344   0.678
  366    HA   LYS  64           HA       LYS  64  -6.313  -9.715  -0.243
  367    HB3  LYS  64           2HB      LYS  64  -6.933  -9.802   2.030
  368    HG3  LYS  64           2HG      LYS  64  -5.305 -11.163   3.165
  369    HD3  LYS  64           2HD      LYS  64  -5.027 -11.752   0.226
  370    HE3  LYS  64           2HE      LYS  64  -3.803 -13.259   1.652
  371    HZ1  LYS  64           3HZ      LYS  64  -4.787 -13.046   3.750
  372    HZ2  LYS  64           1HZ      LYS  64  -5.152 -14.628   3.274
  373    HZ3  LYS  64           2HZ      LYS  64  -6.333 -13.421   3.177
  374    H    VAL  65           H        VAL  65  -4.428  -7.059  -0.363
  375    HA   VAL  65           HA       VAL  65  -6.653  -5.200   0.156
  376    HB   VAL  65           HB       VAL  65  -3.743  -4.459  -0.129
  377   HG11  VAL  65          1HG1      VAL  65  -5.084  -2.566  -0.504
  378   HG12  VAL  65          2HG1      VAL  65  -6.212  -3.006   0.779
  379   HG13  VAL  65          3HG1      VAL  65  -4.589  -2.446   1.184
  380   HG21  VAL  65          3HG2      VAL  65  -4.804  -4.284   2.558
  381   HG22  VAL  65          1HG2      VAL  65  -4.837  -5.940   1.950
  382   HG23  VAL  65          2HG2      VAL  65  -3.320  -5.041   1.980
  383    H    PHE  66           H        PHE  66  -6.960  -3.433  -1.331
  384    HA   PHE  66           HA       PHE  66  -7.182  -2.492  -3.392
  385    HB3  PHE  66           2HB      PHE  66  -5.393  -2.682  -4.999
  386    HD1  PHE  66           2HD      PHE  66  -3.524  -3.983  -2.142
  387    HD2  PHE  66           1HD      PHE  66  -5.001  -0.488  -4.071
  388    HE1  PHE  66           2HE      PHE  66  -2.046  -2.594  -0.750
  389    HE2  PHE  66           1HE      PHE  66  -3.524   0.906  -2.682
  390    HZ   PHE  66           HZ       PHE  66  -2.044  -0.147  -1.018
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1 -39.078  37.546  -2.797
    2    HA2  GLY   1           1HA      GLY   1 -41.400  37.924  -2.465
    3    HA3  GLY   1           2HA      GLY   1 -41.668  37.608  -4.173
    4    H    SER   2           H        SER   2 -42.608  35.740  -4.627
    5    HA   SER   2           HA       SER   2 -42.228  33.492  -2.760
    6    HB3  SER   2           2HB      SER   2 -44.457  33.133  -2.600
    7    HG   SER   2           HG       SER   2 -45.352  35.402  -3.741
    8    H    SER   3           H        SER   3 -42.072  31.430  -3.640
    9    HA   SER   3           HA       SER   3 -42.268  31.035  -6.495
   10    HB3  SER   3           2HB      SER   3 -39.835  30.071  -6.449
   11    HG   SER   3           HG       SER   3 -39.816  32.858  -6.354
   12    H    GLY   4           H        GLY   4 -40.099  29.203  -4.450
   13    HA2  GLY   4           1HA      GLY   4 -41.584  27.359  -3.184
   14    HA3  GLY   4           2HA      GLY   4 -41.729  26.835  -4.855
   15    H    SER   5           H        SER   5 -40.481  25.497  -2.556
   16    HA   SER   5           HA       SER   5 -38.330  24.284  -3.765
   17    HB3  SER   5           2HB      SER   5 -36.975  26.196  -3.757
   18    HG   SER   5           HG       SER   5 -36.870  27.619  -2.009
   19    H    SER   6           H        SER   6 -38.086  22.426  -2.719
   20    HA   SER   6           HA       SER   6 -38.940  22.287   0.088
   21    HB3  SER   6           2HB      SER   6 -39.565  20.694  -2.138
   22    HG   SER   6           HG       SER   6 -38.712  18.717  -0.628
   23    H    GLY   7           H        GLY   7 -36.174  22.435  -1.746
   24    HA2  GLY   7           1HA      GLY   7 -34.290  22.322   0.143
   25    HA3  GLY   7           2HA      GLY   7 -34.592  20.612  -0.124
   26    H    PHE   8           H        PHE   8 -32.526  20.216  -0.916
   27    HA   PHE   8           HA       PHE   8 -32.154  20.991  -3.699
   28    HB3  PHE   8           2HB      PHE   8 -29.613  21.310  -2.992
   29    HD1  PHE   8           2HD      PHE   8 -30.852  22.454  -5.092
   30    HD2  PHE   8           1HD      PHE   8 -30.729  23.992  -1.125
   31    HE1  PHE   8           2HE      PHE   8 -31.269  24.717  -5.960
   32    HE2  PHE   8           1HE      PHE   8 -31.146  26.258  -1.987
   33    HZ   PHE   8           HZ       PHE   8 -31.415  26.624  -4.408
   34    H    VAL   9           H        VAL   9 -31.045  19.494  -4.915
   35    HA   VAL   9           HA       VAL   9 -29.687  17.278  -3.636
   36    HB   VAL   9           HB       VAL   9 -31.872  16.364  -3.516
   37   HG11  VAL   9          1HG1      VAL   9 -33.004  16.186  -5.981
   38   HG12  VAL   9          2HG1      VAL   9 -33.399  17.420  -4.782
   39   HG13  VAL   9          3HG1      VAL   9 -32.239  17.773  -6.064
   40   HG21  VAL   9          3HG2      VAL   9 -31.012  15.146  -6.094
   41   HG22  VAL   9          1HG2      VAL   9 -29.918  15.064  -4.713
   42   HG23  VAL   9          2HG2      VAL   9 -31.536  14.372  -4.598
   43    H    LYS  10           H        LYS  10 -27.877  17.121  -4.771
   44    HA   LYS  10           HA       LYS  10 -27.805  16.470  -7.499
   45    HB3  LYS  10           2HB      LYS  10 -27.623  19.349  -6.831
   46    HG3  LYS  10           2HG      LYS  10 -25.726  18.021  -8.738
   47    HD3  LYS  10           2HD      LYS  10 -25.277  20.495  -9.387
   48    HE3  LYS  10           2HE      LYS  10 -27.568  20.166 -10.891
   49    HZ1  LYS  10           3HZ      LYS  10 -25.247  20.435 -11.670
   50    HZ2  LYS  10           1HZ      LYS  10 -26.116  19.268 -12.534
   51    HZ3  LYS  10           2HZ      LYS  10 -24.983  18.790 -11.372
   52    H    THR  11           H        THR  11 -26.111  17.919  -4.773
   53    HA   THR  11           HA       THR  11 -23.493  17.229  -5.634
   54    HB   THR  11           HB       THR  11 -23.976  17.427  -2.722
   55    HG1  THR  11           1HG      THR  11 -24.129  19.858  -3.220
   56   HG21  THR  11          3HG2      THR  11 -21.839  18.053  -2.791
   57   HG22  THR  11          1HG2      THR  11 -22.232  19.404  -3.854
   58   HG23  THR  11          2HG2      THR  11 -21.859  17.822  -4.539
   59    H    VAL  12           H        VAL  12 -22.079  15.787  -4.192
   60    HA   VAL  12           HA       VAL  12 -23.517  13.366  -3.359
   61    HB   VAL  12           HB       VAL  12 -22.758  12.896  -5.609
   62   HG11  VAL  12          1HG1      VAL  12 -19.908  12.940  -5.179
   63   HG12  VAL  12          2HG1      VAL  12 -20.861  13.683  -6.465
   64   HG13  VAL  12          3HG1      VAL  12 -20.606  14.542  -4.946
   65   HG21  VAL  12          3HG2      VAL  12 -22.632  11.118  -3.888
   66   HG22  VAL  12          1HG2      VAL  12 -21.463  10.907  -5.191
   67   HG23  VAL  12          2HG2      VAL  12 -20.938  11.532  -3.627
   68    H    GLU  13           H        GLU  13 -23.109  13.547  -1.210
   69    HA   GLU  13           HA       GLU  13 -20.367  14.048  -0.323
   70    HB3  GLU  13           2HB      GLU  13 -21.292  14.411   1.870
   71    HG3  GLU  13           2HG      GLU  13 -21.985  15.996  -0.280
   72    H    ASP  14           H        ASP  14 -19.281  12.151  -0.619
   73    HA   ASP  14           HA       ASP  14 -19.686  10.094   1.308
   74    HB3  ASP  14           2HB      ASP  14 -19.813   8.859  -1.363
   75    H    LYS  15           H        LYS  15 -17.751   9.301   1.807
   76    HA   LYS  15           HA       LYS  15 -15.764   8.658  -0.128
   77    HB3  LYS  15           2HB      LYS  15 -15.299  10.982  -0.236
   78    HG3  LYS  15           2HG      LYS  15 -14.643  11.506   2.544
   79    HD3  LYS  15           2HD      LYS  15 -15.807  13.580   2.092
   80    HE3  LYS  15           2HE      LYS  15 -13.710  12.539   0.417
   81    HZ1  LYS  15           3HZ      LYS  15 -14.245  14.751  -1.053
   82    HZ2  LYS  15           1HZ      LYS  15 -15.768  14.025  -0.927
   83    HZ3  LYS  15           2HZ      LYS  15 -14.468  13.156  -1.571
   84    H    TYR  16           H        TYR  16 -13.573   8.244   1.106
   85    HA   TYR  16           HA       TYR  16 -14.282   6.826   3.586
   86    HB3  TYR  16           2HB      TYR  16 -12.541   5.244   3.090
   87    HD1  TYR  16           1HD      TYR  16 -13.254   6.402  -0.338
   88    HD2  TYR  16           2HD      TYR  16 -14.393   3.760   2.797
   89    HE1  TYR  16           1HE      TYR  16 -14.701   5.176  -1.905
   90    HE2  TYR  16           2HE      TYR  16 -15.841   2.526   1.239
   91    HH   TYR  16           HH       TYR  16 -15.963   2.152  -1.258
   92    H    LYS  17           H        LYS  17 -12.265   6.456   5.015
   93    HA   LYS  17           HA       LYS  17 -10.373   8.653   5.001
   94    HB3  LYS  17           2HB      LYS  17 -12.580   8.386   7.002
   95    HG3  LYS  17           2HG      LYS  17 -10.856  10.199   8.150
   96    HD3  LYS  17           2HD      LYS  17 -10.470   8.052   9.713
   97    HE3  LYS  17           2HE      LYS  17 -12.497  10.097   9.450
   98    HZ1  LYS  17           3HZ      LYS  17 -14.266   9.131  10.549
   99    HZ2  LYS  17           1HZ      LYS  17 -13.365   7.799  11.077
  100    HZ3  LYS  17           2HZ      LYS  17 -13.830   7.916   9.455
  101    H    CYS  18           H        CYS  18  -8.485   8.177   6.049
  102    HA   CYS  18           HA       CYS  18  -7.881   5.471   6.541
  103    HB3  CYS  18           2HB      CYS  18  -6.399   8.016   7.208
  104    H    GLU  19           H        GLU  19  -7.703   4.284   8.386
  105    HA   GLU  19           HA       GLU  19  -9.103   5.293  10.710
  106    HB3  GLU  19           2HB      GLU  19  -8.382   2.857  11.504
  107    HG3  GLU  19           2HG      GLU  19 -10.363   1.906  10.507
  108    H    LYS  20           H        LYS  20  -6.436   6.361   9.969
  109    HA   LYS  20           HA       LYS  20  -5.124   5.878  12.555
  110    HB3  LYS  20           2HB      LYS  20  -3.205   6.534  10.492
  111    HG3  LYS  20           2HG      LYS  20  -3.546   4.302  12.458
  112    HD3  LYS  20           2HD      LYS  20  -1.255   4.595  10.519
  113    HE3  LYS  20           2HE      LYS  20  -0.229   2.915  11.616
  114    HZ1  LYS  20           3HZ      LYS  20  -2.161   3.673  13.741
  115    HZ2  LYS  20           1HZ      LYS  20  -0.703   4.465  13.405
  116    HZ3  LYS  20           2HZ      LYS  20  -0.689   2.876  13.986
  117    H    CYS  21           H        CYS  21  -4.761   7.963   9.678
  118    HA   CYS  21           HA       CYS  21  -4.384  10.254  11.469
  119    HB3  CYS  21           2HB      CYS  21  -2.610  10.078   9.896
  120    H    HIS  22           H        HIS  22  -6.877   8.774  10.028
  121    HA   HIS  22           HA       HIS  22  -8.993   9.375   9.451
  122    HB3  HIS  22           2HB      HIS  22  -9.871  10.816  10.926
  123    HD2  HIS  22           2HD      HIS  22  -7.703   9.128  12.492
  124    HE1  HIS  22           1HE      HIS  22  -6.389  12.799  14.162
  125    HE2  HIS  22           2HE      HIS  22  -6.289  10.287  14.321
  126    H    LEU  23           H        LEU  23  -6.678   9.932   7.659
  127    HA   LEU  23           HA       LEU  23  -7.190  12.329   6.227
  128    HB3  LEU  23           2HB      LEU  23  -5.979  10.650   4.423
  129    HG   LEU  23           HG       LEU  23  -4.782  12.452   6.495
  130   HD11  LEU  23          1HD1      LEU  23  -3.449  10.228   5.362
  131   HD12  LEU  23          2HD1      LEU  23  -2.776  11.526   6.346
  132   HD13  LEU  23          3HD1      LEU  23  -2.817  11.682   4.589
  133   HD21  LEU  23          3HD2      LEU  23  -4.475  12.596   3.520
  134   HD22  LEU  23          1HD2      LEU  23  -4.388  13.888   4.718
  135   HD23  LEU  23          2HD2      LEU  23  -5.946  13.175   4.302
  136    H    VAL  24           H        VAL  24  -8.917  12.753   5.036
  137    HA   VAL  24           HA       VAL  24 -10.781  10.767   4.231
  138    HB   VAL  24           HB       VAL  24 -10.519  13.669   3.447
  139   HG11  VAL  24          1HG1      VAL  24 -13.142  12.867   3.010
  140   HG12  VAL  24          2HG1      VAL  24 -11.931  13.237   1.780
  141   HG13  VAL  24          3HG1      VAL  24 -12.162  11.573   2.319
  142   HG21  VAL  24          3HG2      VAL  24 -12.300  14.056   5.003
  143   HG22  VAL  24          1HG2      VAL  24 -12.500  12.326   5.277
  144   HG23  VAL  24          2HG2      VAL  24 -11.039  13.142   5.829
  145    H    LEU  25           H        LEU  25 -10.442   9.357   2.651
  146    HA   LEU  25           HA       LEU  25  -9.080  10.289   0.209
  147    HB3  LEU  25           2HB      LEU  25  -7.630   8.628   0.383
  148    HG   LEU  25           HG       LEU  25  -9.014   8.146   2.972
  149   HD11  LEU  25          1HD1      LEU  25  -8.102   5.988   1.502
  150   HD12  LEU  25          2HD1      LEU  25  -8.366   6.037   3.244
  151   HD13  LEU  25          3HD1      LEU  25  -6.763   6.366   2.586
  152   HD21  LEU  25          3HD2      LEU  25  -6.674   8.445   3.781
  153   HD22  LEU  25          1HD2      LEU  25  -7.324   9.836   2.913
  154   HD23  LEU  25          2HD2      LEU  25  -6.189   8.749   2.112
  155    H    CYS  26           H        CYS  26  -9.607   8.784  -1.702
  156    HA   CYS  26           HA       CYS  26 -12.517   8.344  -1.713
  157    HB3  CYS  26           2HB      CYS  26 -12.620   9.172  -3.830
  158    H    SER  27           H        SER  27  -9.416   6.895  -2.323
  159    HA   SER  27           HA       SER  27 -10.756   4.316  -2.752
  160    HB3  SER  27           2HB      SER  27  -8.365   5.309  -4.324
  161    HG   SER  27           HG       SER  27  -9.612   3.104  -5.260
  162    HA   PRO  28           HA       PRO  28  -7.607   4.111   0.643
  163    HB3  PRO  28           2HB      PRO  28  -9.218   4.474   2.240
  164    HG3  PRO  28           2HG      PRO  28 -11.457   4.016   1.811
  165    HD3  PRO  28           2HD      PRO  28 -10.944   5.271  -0.052
  166    H    LYS  29           H        LYS  29  -7.530   1.823   2.119
  167    HA   LYS  29           HA       LYS  29  -7.361  -0.334   0.119
  168    HB3  LYS  29           2HB      LYS  29  -5.222  -0.879   0.713
  169    HG3  LYS  29           2HG      LYS  29  -3.815   1.026   1.108
  170    HD3  LYS  29           2HD      LYS  29  -5.670   2.603  -0.390
  171    HE3  LYS  29           2HE      LYS  29  -3.256   0.936  -1.046
  172    HZ1  LYS  29           3HZ      LYS  29  -4.030   0.969  -3.140
  173    HZ2  LYS  29           1HZ      LYS  29  -3.500   2.576  -3.128
  174    HZ3  LYS  29           2HZ      LYS  29  -5.130   2.220  -2.849
  175    H    GLN  30           H        GLN  30  -9.566  -0.690   1.114
  176    HA   GLN  30           HA       GLN  30 -10.104  -1.406   3.694
  177    HB3  GLN  30           2HB      GLN  30 -11.267  -3.231   1.689
  178    HG3  GLN  30           2HG      GLN  30 -12.474  -1.243   3.598
  179   HE21  GLN  30          1HE2      GLN  30 -14.586  -3.048   4.167
  180   HE22  GLN  30          2HE2      GLN  30 -15.658  -3.042   2.812
  181    H    THR  31           H        THR  31  -8.792  -2.601   4.931
  182    HA   THR  31           HA       THR  31  -7.126  -4.674   4.080
  183    HB   THR  31           HB       THR  31  -6.696  -5.149   6.348
  184    HG1  THR  31           1HG      THR  31  -9.349  -4.298   6.715
  185   HG21  THR  31          3HG2      THR  31  -7.618  -2.291   6.499
  186   HG22  THR  31          1HG2      THR  31  -6.214  -2.773   5.547
  187   HG23  THR  31          2HG2      THR  31  -6.230  -3.040   7.290
  188    H    GLU  32           H        GLU  32  -7.815  -6.670   6.103
  189    HA   GLU  32           HA       GLU  32  -9.901  -8.062   4.581
  190    HB3  GLU  32           2HB      GLU  32  -8.357  -9.547   6.613
  191    HG3  GLU  32           2HG      GLU  32  -8.858 -10.085   3.695
  192    H    CYS  33           H        CYS  33 -10.037  -6.066   6.970
  193    HA   CYS  33           HA       CYS  33 -11.825  -7.719   8.631
  194    HB3  CYS  33           2HB      CYS  33  -9.742  -6.788   9.748
  195    H    GLY  34           H        GLY  34 -11.407  -4.747   6.851
  196    HA2  GLY  34           1HA      GLY  34 -13.656  -4.080   5.848
  197    HA3  GLY  34           2HA      GLY  34 -14.170  -3.965   7.525
  198    H    HIS  35           H        HIS  35 -11.917  -2.776   8.652
  199    HA   HIS  35           HA       HIS  35 -12.400  -0.085   8.307
  200    HB3  HIS  35           2HB      HIS  35 -10.076   0.226   9.324
  201    HD2  HIS  35           2HD      HIS  35 -12.149   1.209  11.074
  202    HE1  HIS  35           1HE      HIS  35 -12.352  -2.410  13.282
  203    HE2  HIS  35           2HE      HIS  35 -13.077  -0.001  13.165
  204    H    ARG  36           H        ARG  36 -10.379   1.450   7.742
  205    HA   ARG  36           HA       ARG  36  -9.139   0.634   5.233
  206    HB3  ARG  36           2HB      ARG  36  -9.885   2.854   4.213
  207    HG3  ARG  36           2HG      ARG  36 -11.663   0.513   4.639
  208    HD3  ARG  36           2HD      ARG  36 -12.585   2.723   2.867
  209    HE   ARG  36           HE       ARG  36 -14.085   0.989   2.660
  210   HH11  ARG  36          1HH1      ARG  36 -13.491   1.642   6.028
  211   HH12  ARG  36          2HH1      ARG  36 -14.781   0.629   6.586
  212   HH21  ARG  36          1HH2      ARG  36 -15.786  -0.348   3.382
  213   HH22  ARG  36          2HH2      ARG  36 -16.085  -0.503   5.080
  214    H    PHE  37           H        PHE  37  -7.384   1.987   4.584
  215    HA   PHE  37           HA       PHE  37  -6.511   4.014   6.497
  216    HB3  PHE  37           2HB      PHE  37  -4.166   2.929   6.360
  217    HD1  PHE  37           2HD      PHE  37  -6.711   0.453   7.375
  218    HD2  PHE  37           1HD      PHE  37  -4.089   3.564   8.625
  219    HE1  PHE  37           2HE      PHE  37  -7.147  -0.129   9.725
  220    HE2  PHE  37           1HE      PHE  37  -4.519   2.987  10.977
  221    HZ   PHE  37           HZ       PHE  37  -6.051   1.139  11.530
  222    H    CYS  38           H        CYS  38  -4.425   5.077   5.678
  223    HA   CYS  38           HA       CYS  38  -4.819   5.664   2.845
  224    HB3  CYS  38           2HB      CYS  38  -4.721   7.509   4.536
  225    H    GLU  39           H        GLU  39  -2.848   6.064   1.510
  226    HA   GLU  39           HA       GLU  39  -1.366   3.832   1.073
  227    HB3  GLU  39           2HB      GLU  39   0.418   5.513   0.155
  228    HG3  GLU  39           2HG      GLU  39  -2.387   5.651  -0.925
  229    H    SER  40           H        SER  40  -0.073   6.680   2.796
  230    HA   SER  40           HA       SER  40   2.316   5.620   3.636
  231    HB3  SER  40           2HB      SER  40   1.663   7.167   5.786
  232    HG   SER  40           HG       SER  40   2.725   7.648   3.269
  233    H    CYS  41           H        CYS  41  -0.111   6.123   6.141
  234    HA   CYS  41           HA       CYS  41   0.679   4.403   8.013
  235    HB3  CYS  41           2HB      CYS  41  -1.700   4.050   8.649
  236    H    MET  42           H        MET  42  -1.306   3.428   5.228
  237    HA   MET  42           HA       MET  42  -1.622   0.747   5.813
  238    HB3  MET  42           2HB      MET  42  -1.315   2.158   3.166
  239    HG3  MET  42           2HG      MET  42  -0.731  -0.207   2.851
  240    HE1  MET  42           3HE      MET  42  -4.697  -1.009   5.007
  241    HE2  MET  42           1HE      MET  42  -3.525   0.193   5.547
  242    HE3  MET  42           2HE      MET  42  -4.342   0.393   3.996
  243    H    ALA  43           H        ALA  43   0.924   2.143   3.734
  244    HA   ALA  43           HA       ALA  43   2.401  -0.208   3.416
  245    HB1  ALA  43           3HB      ALA  43   4.316   1.695   3.211
  246    HB2  ALA  43           1HB      ALA  43   3.183   1.280   1.924
  247    HB3  ALA  43           2HB      ALA  43   2.859   2.660   2.974
  248    H    ALA  44           H        ALA  44   2.382   2.165   5.989
  249    HA   ALA  44           HA       ALA  44   4.789   1.397   7.250
  250    HB1  ALA  44           3HB      ALA  44   4.067   2.693   9.108
  251    HB2  ALA  44           1HB      ALA  44   3.513   3.521   7.651
  252    HB3  ALA  44           2HB      ALA  44   2.378   2.573   8.614
  253    H    LEU  45           H        LEU  45   1.405   0.501   7.907
  254    HA   LEU  45           HA       LEU  45   1.948  -1.265  10.021
  255    HB3  LEU  45           2HB      LEU  45  -0.289  -2.162   9.606
  256    HG   LEU  45           HG       LEU  45  -0.189   0.836   9.312
  257   HD11  LEU  45          1HD1      LEU  45  -2.305  -0.167   8.448
  258   HD12  LEU  45          2HD1      LEU  45  -2.514   0.896   9.839
  259   HD13  LEU  45          3HD1      LEU  45  -2.570  -0.853  10.051
  260   HD21  LEU  45          3HD2      LEU  45  -1.216  -0.215  11.787
  261   HD22  LEU  45          1HD2      LEU  45   0.130   0.890  11.509
  262   HD23  LEU  45          2HD2      LEU  45   0.396  -0.853  11.460
  263    H    LEU  46           H        LEU  46   1.530  -1.860   6.545
  264    HA   LEU  46           HA       LEU  46   1.725  -4.626   6.548
  265    HB3  LEU  46           2HB      LEU  46   2.567  -4.389   4.225
  266    HG   LEU  46           HG       LEU  46   0.238  -2.610   4.924
  267   HD11  LEU  46          1HD1      LEU  46   1.175  -3.494   2.198
  268   HD12  LEU  46          2HD1      LEU  46   1.233  -1.849   2.829
  269   HD13  LEU  46          3HD1      LEU  46  -0.323  -2.632   2.551
  270   HD21  LEU  46          3HD2      LEU  46  -0.580  -4.804   3.435
  271   HD22  LEU  46          1HD2      LEU  46  -0.774  -4.575   5.174
  272   HD23  LEU  46          2HD2      LEU  46   0.623  -5.453   4.550
  273    H    SER  47           H        SER  47   4.190  -2.222   6.992
  274    HA   SER  47           HA       SER  47   6.326  -4.195   6.709
  275    HB3  SER  47           2HB      SER  47   7.224  -1.600   7.613
  276    HG   SER  47           HG       SER  47   8.161  -1.767   5.384
  277    H    SER  48           H        SER  48   4.385  -4.356   8.890
  278    HA   SER  48           HA       SER  48   6.107  -3.807  11.211
  279    HB3  SER  48           2HB      SER  48   3.124  -4.297  11.037
  280    HG   SER  48           HG       SER  48   4.062  -3.379  13.408
  281    H    SER  49           H        SER  49   6.413  -6.069   9.366
  282    HA   SER  49           HA       SER  49   6.532  -8.364   9.334
  283    HB3  SER  49           2HB      SER  49   7.568  -9.229  11.534
  284    HG   SER  49           HG       SER  49   8.971  -7.007  10.544
  285    H    SER  50           H        SER  50   3.920  -7.224  10.212
  286    HA   SER  50           HA       SER  50   2.398  -9.417  10.562
  287    HB3  SER  50           2HB      SER  50   2.071  -9.030  13.241
  288    HG   SER  50           HG       SER  50   4.071 -10.802  12.377
  289    HA   PRO  51           HA       PRO  51   0.383  -5.192  10.619
  290    HB3  PRO  51           2HB      PRO  51   0.846  -4.790   8.405
  291    HG3  PRO  51           2HG      PRO  51   1.288  -6.538   6.936
  292    HD3  PRO  51           2HD      PRO  51   2.729  -7.086   8.649
  293    H    LYS  52           H        LYS  52  -1.586  -4.980  11.490
  294    HA   LYS  52           HA       LYS  52  -3.529  -7.162  11.100
  295    HB3  LYS  52           2HB      LYS  52  -4.267  -6.913  13.369
  296    HG3  LYS  52           2HG      LYS  52  -1.381  -7.291  12.921
  297    HD3  LYS  52           2HD      LYS  52  -2.203  -7.401  15.756
  298    HE3  LYS  52           2HE      LYS  52   0.300  -6.149  14.758
  299    HZ1  LYS  52           3HZ      LYS  52  -0.515  -7.855  17.017
  300    HZ2  LYS  52           1HZ      LYS  52   0.283  -6.363  17.039
  301    HZ3  LYS  52           2HZ      LYS  52   1.114  -7.760  16.574
  302    H    CYS  53           H        CYS  53  -3.661  -3.942  12.611
  303    HA   CYS  53           HA       CYS  53  -4.841  -2.385  10.792
  304    HB3  CYS  53           2HB      CYS  53  -6.812  -4.423  11.756
  305    H    THR  54           H        THR  54  -3.969  -0.861  12.172
  306    HA   THR  54           HA       THR  54  -4.058  -0.451  14.794
  307    HB   THR  54           HB       THR  54  -3.980   1.321  12.527
  308    HG1  THR  54           1HG      THR  54  -2.999   1.303  15.186
  309   HG21  THR  54          3HG2      THR  54  -6.036   2.292  13.261
  310   HG22  THR  54          1HG2      THR  54  -4.738   3.372  13.768
  311   HG23  THR  54          2HG2      THR  54  -5.502   2.299  14.941
  312    H    ALA  55           H        ALA  55  -6.839  -0.159  12.672
  313    HA   ALA  55           HA       ALA  55  -8.649   1.097  14.358
  314    HB1  ALA  55           3HB      ALA  55 -10.166   0.630  12.771
  315    HB2  ALA  55           1HB      ALA  55  -8.776   0.040  11.862
  316    HB3  ALA  55           2HB      ALA  55  -9.783  -1.091  12.766
  317    H    CYS  56           H        CYS  56  -8.828  -2.398  13.730
  318    HA   CYS  56           HA       CYS  56  -9.513  -2.777  16.572
  319    HB3  CYS  56           2HB      CYS  56 -11.411  -3.261  15.136
  320    H    GLN  57           H        GLN  57  -7.412  -3.652  14.003
  321    HA   GLN  57           HA       GLN  57  -5.410  -4.775  14.103
  322    HB3  GLN  57           2HB      GLN  57  -5.799  -6.180  16.632
  323    HG3  GLN  57           2HG      GLN  57  -3.726  -4.566  15.309
  324   HE21  GLN  57          1HE2      GLN  57  -4.841  -2.833  17.013
  325   HE22  GLN  57          2HE2      GLN  57  -3.834  -2.588  18.396
  326    H    GLU  58           H        GLU  58  -6.173  -6.080  12.423
  327    HA   GLU  58           HA       GLU  58  -6.966  -8.783  13.273
  328    HB3  GLU  58           2HB      GLU  58  -8.088  -8.588  10.794
  329    HG3  GLU  58           2HG      GLU  58 -10.220  -7.851  12.197
  330    H    SER  59           H        SER  59  -6.553  -7.650   9.979
  331    HA   SER  59           HA       SER  59  -3.849  -8.561   9.726
  332    HB3  SER  59           2HB      SER  59  -5.231 -10.192   7.835
  333    HG   SER  59           HG       SER  59  -4.232 -11.738   9.634
  334    H    ILE  60           H        ILE  60  -2.938  -7.372   8.191
  335    HA   ILE  60           HA       ILE  60  -4.660  -6.272   6.066
  336    HB   ILE  60           HB       ILE  60  -2.109  -4.914   6.772
  337   HG13  ILE  60          2HG1      ILE  60  -3.305  -5.420   8.939
  338   HG21  ILE  60          1HG2      ILE  60  -4.447  -3.266   6.414
  339   HG22  ILE  60          2HG2      ILE  60  -2.954  -3.318   5.478
  340   HG23  ILE  60          3HG2      ILE  60  -4.276  -4.419   5.091
  341   HD11  ILE  60          3HD1      ILE  60  -1.977  -3.194   8.314
  342   HD12  ILE  60          1HD1      ILE  60  -3.559  -2.497   8.659
  343   HD13  ILE  60          2HD1      ILE  60  -2.733  -3.458   9.885
  344    H    VAL  61           H        VAL  61  -4.098  -6.640   4.009
  345    HA   VAL  61           HA       VAL  61  -1.363  -7.286   3.294
  346    HB   VAL  61           HB       VAL  61  -3.599  -9.280   2.923
  347   HG11  VAL  61          1HG1      VAL  61  -2.612  -9.918   1.038
  348   HG12  VAL  61          2HG1      VAL  61  -1.303  -8.758   1.271
  349   HG13  VAL  61          3HG1      VAL  61  -1.197 -10.366   1.988
  350   HG21  VAL  61          3HG2      VAL  61  -1.665 -10.722   3.978
  351   HG22  VAL  61          1HG2      VAL  61  -1.136  -9.155   4.591
  352   HG23  VAL  61          2HG2      VAL  61  -2.741  -9.764   4.993
  353    H    LYS  62           H        LYS  62  -0.988  -6.056   1.583
  354    HA   LYS  62           HA       LYS  62  -2.668  -4.587   0.082
  355    HB3  LYS  62           2HB      LYS  62  -0.380  -4.269  -0.319
  356    HG3  LYS  62           2HG      LYS  62  -0.059  -7.037  -1.434
  357    HD3  LYS  62           2HD      LYS  62   1.512  -4.900  -1.781
  358    HE3  LYS  62           2HE      LYS  62   2.323  -6.116   0.849
  359    HZ1  LYS  62           3HZ      LYS  62   4.226  -4.316   0.276
  360    HZ2  LYS  62           1HZ      LYS  62   3.984  -5.021  -1.244
  361    HZ3  LYS  62           2HZ      LYS  62   4.405  -5.987   0.079
  362    H    ASP  63           H        ASP  63  -1.843  -7.974  -0.551
  363    HA   ASP  63           HA       ASP  63  -3.282  -8.269  -2.939
  364    HB3  ASP  63           2HB      ASP  63  -3.433 -10.756  -1.793
  365    H    LYS  64           H        LYS  64  -4.256  -8.745   0.433
  366    HA   LYS  64           HA       LYS  64  -6.971  -9.410  -0.361
  367    HB3  LYS  64           2HB      LYS  64  -7.370  -9.925   1.915
  368    HG3  LYS  64           2HG      LYS  64  -4.947 -10.929   2.599
  369    HD3  LYS  64           2HD      LYS  64  -6.978 -11.997   0.645
  370    HE3  LYS  64           2HE      LYS  64  -4.528 -13.244   1.817
  371    HZ1  LYS  64           3HZ      LYS  64  -5.411 -15.365   1.749
  372    HZ2  LYS  64           1HZ      LYS  64  -6.761 -14.902   0.838
  373    HZ3  LYS  64           2HZ      LYS  64  -6.660 -14.483   2.474
  374    H    VAL  65           H        VAL  65  -5.219  -6.619   0.124
  375    HA   VAL  65           HA       VAL  65  -7.283  -5.039   1.368
  376    HB   VAL  65           HB       VAL  65  -4.520  -4.703   0.828
  377   HG11  VAL  65          1HG1      VAL  65  -4.409  -2.499  -0.134
  378   HG12  VAL  65          2HG1      VAL  65  -5.264  -3.568  -1.247
  379   HG13  VAL  65          3HG1      VAL  65  -6.167  -2.421  -0.254
  380   HG21  VAL  65          3HG2      VAL  65  -6.645  -3.447   2.439
  381   HG22  VAL  65          1HG2      VAL  65  -5.045  -4.019   2.913
  382   HG23  VAL  65          2HG2      VAL  65  -5.224  -2.449   2.130
  383    H    PHE  66           H        PHE  66  -8.714  -3.674   0.410
  384    HA   PHE  66           HA       PHE  66  -9.431  -4.162  -2.294
  385    HB3  PHE  66           2HB      PHE  66 -10.989  -2.147  -1.855
  386    HD1  PHE  66           2HD      PHE  66 -10.119  -5.416  -0.641
  387    HD2  PHE  66           1HD      PHE  66 -13.235  -2.522  -0.820
  388    HE1  PHE  66           2HE      PHE  66 -11.766  -7.160  -0.095
  389    HE2  PHE  66           1HE      PHE  66 -14.887  -4.261  -0.273
  390    HZ   PHE  66           HZ       PHE  66 -14.153  -6.584   0.089