*HEADER    MOTOR PROTEIN,PROTEIN TRANSPORT         20-MAR-15   2N0Z              
*TITLE     SOLUTION STRUCTURE OF MYUB (1080-1122) OF HUMAN MYOSIN VI             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCONVENTIONAL MYOSIN-VI;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 1080-1122;                                        
*COMPND   5 SYNONYM: UNCONVENTIONAL MYOSIN-6;                                    
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: MYO6, KIAA0389;                                                
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PGEX6P                                     
*KEYWDS    MOTOR PROTEIN,PROTEIN TRANSPORT                                       
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    F.HE, K.WALTERS                                                       
*REVDAT   2   13-OCT-21 2N0Z    1                                                
*REVDAT   1   09-MAR-16 2N0Z    0                                                


 15 LEU  HA     18 TRP  HE1     4.12            #peak     3 #SUP  0.96  #QF  0.96
 15 LEU  QD2    18 TRP  HE1     3.83            #peak     4 #SUP  0.99  #QF  0.99
 14 ASP  HA     15 LEU  H       2.94            #peak     6 #SUP  0.93  #QF  0.93
 14 ASP  HB3    15 LEU  H       4.87            #peak     8 #SUP  0.98  #QF  0.98
 15 LEU  H      15 LEU  HG      3.56            #peak    10 #SUP  0.99  #QF  0.99
 32 ASP  HA     33 ILE  H       2.83            #peak    12 #SUP  0.96  #QF  0.96
 32 ASP  HB2    33 ILE  H       4.53            #peak    14 #SUP  0.95  #QF  0.95
 33 ILE  H      33 ILE  HB      3.27            #peak    15 #SUP  1.00
 33 ILE  H      33 ILE  HG13    3.51            #peak    16 #SUP  1.00
 33 ILE  H      33 ILE  HG12    3.51            #peak    17 #SUP  0.99  #QF  0.99
 50 TYR  H      51 HIS  H       4.13            #peak    19 #SUP  0.99  #QF  0.99
 50 TYR  QD     51 HIS  H       5.11            #peak    20 #SUP  0.95  #QF  0.93
 51 HIS  H      51 HIS  HD2     5.50            #peak    20 #SUP  0.95  #QF  0.93
 50 TYR  HA     51 HIS  H       3.17            #peak    21 #SUP  0.97  #QF  0.97
 50 TYR  HB2    51 HIS  H       4.76            #peak    25 #SUP  0.97  #QF  0.97
 35 LEU  H      36 LEU  H       3.33            #peak    26 #SUP  1.00
 32 ASP  HB3    35 LEU  H       4.17            #peak    30 #SUP  0.99  #QF  0.99
 34 GLU  HB2    35 LEU  H       3.58            #peak    32 #SUP  0.99  #QF  0.99
 35 LEU  H      35 LEU  HB2     3.29            #peak    33 #SUP  0.99  #QF  0.99
 35 LEU  H      36 LEU  HG      4.94            #peak    34 #SUP  0.93  #QF  0.93
 35 LEU  H      38 ALA  QB      4.70            #peak    35 #SUP  0.98  #QF  0.98
 35 LEU  H      35 LEU  HG      3.19            #peak    36 #SUP  0.97  #QF  0.97
 35 LEU  H      35 LEU  QD1     3.87            #peak    37 #SUP  1.00
 35 LEU  H      35 LEU  QD2     4.12            #peak    38 #SUP  0.99  #QF  0.99
 30 SER  HG     32 ASP  H       4.95            #peak    40 #SUP  0.68  #QF  0.68
 31 CYS  HB2    32 ASP  H       4.59            #peak    44 #SUP  0.99  #QF  0.25
 32 ASP  H      32 ASP  HB2     3.32            #peak    45 #SUP  0.93  #QF  0.93
 10 THR  HA     11 LYS  H       2.81            #peak    48 #SUP  0.95  #QF  0.95
 11 LYS  H      11 LYS  QB      3.19            #peak    49 #SUP  0.99  #QF  0.99
 11 LYS  H      11 LYS  HG2     5.05            #peak    50 #SUP  1.00
 19 LYS  HA     20 TYR  H       3.52            #peak    52 #SUP  0.99  #QF  0.99
 20 TYR  H      20 TYR  HB2     3.83            #peak    54 #SUP  0.98  #QF  0.98
 20 TYR  H      20 TYR  HB3     3.90            #peak    55 #SUP  0.99  #QF  0.99
 50 TYR  H      50 TYR  HB3     3.88            #peak    59 #SUP  0.99  #QF  0.99
 50 TYR  H      50 TYR  HB2     3.88            #peak    60 #SUP  0.95  #QF  0.95
 49 VAL  QG2    50 TYR  H       4.47            #peak    61 #SUP  0.99  #QF  0.99
 18 TRP  HB3    19 LYS  H       3.79            #peak    63 #SUP  0.99  #QF  0.95
 19 LYS  H      22 GLU  HB2     3.65            #peak    64 #SUP  0.99  #QF  0.60
 19 LYS  H      19 LYS  HG2     4.31            #peak    65 #SUP  0.84  #QF  0.46
 11 LYS  H      12 LYS  H       4.37            #peak    66 #SUP  1.00
 11 LYS  HA     12 LYS  H       2.78            #peak    67 #SUP  0.94  #QF  0.94
 11 LYS  QB     12 LYS  H       3.96            #peak    68 #SUP  0.64  #QF  0.64
 12 LYS  H      12 LYS  QD      3.55            #peak    69 #SUP  0.81  #QF  0.67
 12 LYS  H      12 LYS  HG2     4.34            #peak    70 #SUP  0.86  #QF  0.86
 12 LYS  H      12 LYS  HG3     4.34            #peak    71 #SUP  0.99  #QF  0.99
  2 PRO  HA      3 LEU  H       3.44            #peak    72 #SUP  0.60  #QF  0.60
  3 LEU  H       3 LEU  HG      4.33            #peak    73 #SUP  0.91  #QF  0.89
 26 THR  HB     27 ILE  H       3.51            #peak    76 #SUP  0.96  #QF  0.96
 27 ILE  H      27 ILE  HB      3.04            #peak    78 #SUP  0.99  #QF  0.99
 27 ILE  H      27 ILE  HG13    3.28            #peak    79 #SUP  0.99  #QF  0.99
 26 THR  QG2    27 ILE  H       4.03            #peak    80 #SUP  0.99  #QF  0.99
 27 ILE  H      27 ILE  HG12    3.83            #peak    81 #SUP  1.00
 27 ILE  H      27 ILE  QG2     3.87            #peak    82 #SUP  1.00
 27 ILE  H      27 ILE  QD1     3.84            #peak    83 #SUP  0.99  #QF  0.99
 18 TRP  HE3    23 LEU  H       3.99            #peak    84 #SUP  0.96  #QF  0.96
 22 GLU  H      23 LEU  H       3.26            #peak    85 #SUP  1.00
 22 GLU  HB2    23 LEU  H       3.84            #peak    87 #SUP  0.99  #QF  0.99
 23 LEU  H      23 LEU  HB2     3.48            #peak    88 #SUP  0.99  #QF  0.99
 23 LEU  H      23 LEU  HG      3.39            #peak    89 #SUP  1.00
 22 GLU  HB3    23 LEU  H       3.88            #peak    90 #SUP  0.99  #QF  0.99
 23 LEU  H      23 LEU  HB3     3.83            #peak    91 #SUP  1.00
 23 LEU  H      23 LEU  QD1     4.03            #peak    93 #SUP  1.00
 18 TRP  H      18 TRP  HD1     3.79            #peak    95 #SUP  0.97  #QF  0.97
 18 TRP  H      18 TRP  HB2     3.08            #peak    98 #SUP  0.73  #QF  0.73
 17 LYS  HB3    18 TRP  H       4.48            #peak    99 #SUP  0.98  #QF  0.98
 38 ALA  H      39 CYS  H       3.25            #peak   100 #SUP  0.99  #QF  0.99
 35 LEU  HA     38 ALA  H       3.87            #peak   103 #SUP  0.94  #QF  0.94
 37 ALA  QB     38 ALA  H       3.21            #peak   104 #SUP  0.92  #QF  0.92
 38 ALA  H      38 ALA  QB      2.87            #peak   105 #SUP  0.99  #QF  0.99
 30 SER  HA     31 CYS  H       2.90            #peak   108 #SUP  0.86  #QF  0.86
 30 SER  HB3    31 CYS  H       4.05            #peak   109 #SUP  0.97  #QF  0.97
 31 CYS  H      31 CYS  HB3     4.00            #peak   110 #SUP  0.59  #QF  0.59
 42 GLU  H      43 PHE  H       3.43            #peak   111 #SUP  0.93  #QF  0.93
 39 CYS  HA     42 GLU  H       4.14            #peak   112 #SUP  1.00
 42 GLU  H      42 GLU  HB2     3.79            #peak   113 #SUP  0.96  #QF  0.96
 42 GLU  H      42 GLU  HB3     3.79            #peak   114 #SUP  0.98  #QF  0.98
 41 GLU  HB2    42 GLU  H       3.54            #peak   118 #SUP  0.77  #QF  0.59
 41 GLU  HB3    42 GLU  H       4.02            #peak   118 #SUP  0.77  #QF  0.59
 34 GLU  H      35 LEU  HB2     4.79            #peak   120 #SUP  0.93  #QF  0.93
 33 ILE  QG2    34 GLU  H       3.84            #peak   121 #SUP  0.99  #QF  0.99
 34 GLU  H      34 GLU  HG2     3.85            #peak   124 #SUP  0.99  #QF  0.99
 34 GLU  H      34 GLU  HB2     3.17            #peak   125 #SUP  0.91  #QF  0.91
 33 ILE  HB     34 GLU  H       3.70            #peak   126 #SUP  0.99  #QF  0.99
 36 LEU  H      36 LEU  HB2     3.27            #peak   129 #SUP  0.96  #QF  0.96
 36 LEU  H      36 LEU  HG      3.35            #peak   130 #SUP  0.99  #QF  0.99
 36 LEU  H      36 LEU  HB3     3.59            #peak   131 #SUP  1.00
 35 LEU  HB3    36 LEU  H       3.82            #peak   132 #SUP  0.96  #QF  0.96
 36 LEU  H      36 LEU  QD2     3.76            #peak   133 #SUP  0.90  #QF  0.90
 13 TYR  HA     14 ASP  H       3.21            #peak   136 #SUP  0.95  #QF  0.95
 14 ASP  H      14 ASP  HB2     4.15            #peak   137 #SUP  0.89  #QF  0.89
 13 TYR  HB3    14 ASP  H       3.86            #peak   138 #SUP  1.00  #QF  0.95
 14 ASP  H      14 ASP  HB3     4.15            #peak   138 #SUP  1.00  #QF  0.95
 45 ARG  H      46 ARG  H       3.45            #peak   139 #SUP  0.99  #QF  0.99
 42 GLU  HA     45 ARG  H       3.68            #peak   140 #SUP  0.88  #QF  0.88
 41 GLU  HA     45 ARG  H       4.34            #peak   141 #SUP  0.49  #QF  0.49
 45 ARG  H      45 ARG  HG2     4.07            #peak   145 #SUP  0.85  #QF  0.85
 36 LEU  H      37 ALA  H       3.53            #peak   147 #SUP  1.00
 34 GLU  HA     37 ALA  H       3.83            #peak   148 #SUP  0.96  #QF  0.96
 33 ILE  HA     37 ALA  H       4.20            #peak   150 #SUP  1.00  #QF  0.60
 36 LEU  HB2    37 ALA  H       3.56            #peak   151 #SUP  1.00
 36 LEU  HB3    37 ALA  H       3.60            #peak   153 #SUP  0.98  #QF  0.98
 39 CYS  H      40 ARG  H       3.58            #peak   154 #SUP  1.00
 39 CYS  HB2    40 ARG  H       4.01            #peak   157 #SUP  0.98  #QF  0.98
 39 CYS  HB3    40 ARG  H       4.01            #peak   158 #SUP  0.98  #QF  0.98
 40 ARG  H      40 ARG  HG3     4.22            #peak   160 #SUP  1.00
 38 ALA  HA     40 ARG  H       4.81            #peak   161 #SUP  0.97  #QF  0.97
 37 ALA  HA     40 ARG  H       4.14            #peak   162 #SUP  0.67  #QF  0.67
 42 GLU  HB3    43 PHE  H       4.16            #peak   163 #SUP  0.99  #QF  0.99
 40 ARG  H      41 GLU  H       3.43            #peak   164 #SUP  0.99  #QF  0.99
 41 GLU  H      41 GLU  HG3     3.95            #peak   168 #SUP  0.98  #QF  0.98
 41 GLU  H      41 GLU  HB2     2.97            #peak   169 #SUP  0.79  #QF  0.79
 39 CYS  H      39 CYS  HB2     3.78            #peak   174 #SUP  0.98  #QF  0.98
 39 CYS  H      39 CYS  HB3     3.78            #peak   175 #SUP  0.80  #QF  0.80
 38 ALA  QB     39 CYS  H       3.39            #peak   176 #SUP  0.99  #QF  0.99
 42 GLU  HB2    43 PHE  H       4.16            #peak   180 #SUP  0.68  #QF  0.68
 13 TYR  H      13 TYR  QD      3.68            #peak   181 #SUP  0.99  #QF  0.99
 13 TYR  H      13 TYR  HB2     3.12            #peak   184 #SUP  0.87  #QF  0.87
 12 LYS  HB2    13 TYR  H       3.93            #peak   185 #SUP  0.91  #QF  0.68
 12 LYS  HB3    13 TYR  H       3.93            #peak   185 #SUP  0.91  #QF  0.68
 49 VAL  H      50 TYR  H       4.50            #peak   186 #SUP  1.00
 49 VAL  H      49 VAL  HB      3.56            #peak   189 #SUP  0.91  #QF  0.91
 49 VAL  H      49 VAL  QG2     4.01            #peak   191 #SUP  0.92  #QF  0.92
 47 LEU  HB3    48 LYS  H       4.14            #peak   193 #SUP  0.91  #QF  0.91
 47 LEU  H      48 LYS  H       3.31            #peak   194 #SUP  0.72  #QF  0.72
 48 LYS  H      48 LYS  QB      3.18            #peak   195 #SUP  0.95  #QF  0.41
 47 LEU  H      49 VAL  H       4.22            #peak   197 #SUP  0.35  #QF  0.35
 44 HIS  HA     47 LEU  H       4.13            #peak   198 #SUP  0.99  #QF  0.99
 46 ARG  HB2    47 LEU  H       3.96            #peak   200 #SUP  0.76  #QF  0.76
 46 ARG  HB3    47 LEU  H       3.96            #peak   201 #SUP  0.98  #QF  0.98
 47 LEU  H      47 LEU  HB2     3.10            #peak   202 #SUP  0.74  #QF  0.74
 47 LEU  H      47 LEU  HB3     3.59            #peak   203 #SUP  1.00
 47 LEU  H      47 LEU  QD1     4.23            #peak   204 #SUP  0.98  #QF  0.95
 26 THR  H      26 THR  HG1     3.16            #peak   207 #SUP  0.76  #QF  0.76
 26 THR  H      26 THR  HB      3.19            #peak   208 #SUP  0.95  #QF  0.95
 23 LEU  HA     26 THR  H       4.01            #peak   210 #SUP  0.93  #QF  0.93
 25 ASP  HB2    26 THR  H       4.03            #peak   212 #SUP  0.81  #QF  0.69
 26 THR  H      26 THR  QG2     3.78            #peak   213 #SUP  1.00
 21 ALA  HA     25 ASP  H       4.04            #peak   216 #SUP  0.98  #QF  0.98
 25 ASP  H      25 ASP  HB2     3.52            #peak   218 #SUP  0.84  #QF  0.72
 25 ASP  H      25 ASP  HB3     3.52            #peak   218 #SUP  0.84  #QF  0.72
 24 ARG  HB2    25 ASP  H       3.64            #peak   219 #SUP  0.92  #QF  0.92
 24 ARG  HB3    25 ASP  H       3.64            #peak   220 #SUP  0.95  #QF  0.95
 17 LYS  H      18 TRP  HD1     4.26            #peak   222 #SUP  0.88  #QF  0.88
 17 LYS  H      17 LYS  HB2     4.17            #peak   225 #SUP  0.99  #QF  0.99
 17 LYS  H      17 LYS  QD      4.63            #peak   226 #SUP  1.00
 23 LEU  H      24 ARG  H       3.50            #peak   229 #SUP  1.00
 24 ARG  H      43 PHE  QD      5.50            #peak   230 #SUP  0.91  #QF  0.59
 24 ARG  H      43 PHE  QE      5.50            #peak   230 #SUP  0.91  #QF  0.59
 24 ARG  H      24 ARG  HB3     3.46            #peak   232 #SUP  0.99  #QF  0.99
 23 LEU  HB3    24 ARG  H       4.04            #peak   233 #SUP  0.98  #QF  0.98
 20 TYR  QD     21 ALA  H       3.94            #peak   234 #SUP  1.00
 21 ALA  H      22 GLU  H       3.49            #peak   235 #SUP  0.99  #QF  0.99
 20 TYR  HB2    21 ALA  H       3.98            #peak   238 #SUP  1.00
 20 TYR  HB3    21 ALA  H       3.39            #peak   239 #SUP  0.99  #QF  0.99
 19 LYS  HB3    21 ALA  H       3.94            #peak   240 #SUP  0.99  #QF  0.99
 19 LYS  HB2    21 ALA  H       3.94            #peak   241 #SUP  0.98  #QF  0.98
 29 THR  H      30 SER  H       2.83            #peak   243 #SUP  0.96  #QF  0.96
 29 THR  HB     30 SER  H       3.31            #peak   246 #SUP  0.99  #QF  0.67
 30 SER  H      30 SER  HB3     3.53            #peak   246 #SUP  0.99  #QF  0.67
 26 THR  HA     30 SER  H       3.90            #peak   247 #SUP  0.98  #QF  0.98
 30 SER  H      30 SER  HB2     3.10            #peak   248 #SUP  0.91  #QF  0.91
 26 THR  QG2    30 SER  H       3.88            #peak   249 #SUP  0.88  #QF  0.88
  4 GLY  QA      5 SER  H       3.50            #peak   252 #SUP  1.00
  5 SER  H       5 SER  QB      3.89            #peak   253 #SUP  1.00
 15 LEU  H      16 SER  H       3.16            #peak   254 #SUP  0.97  #QF  0.97
 16 SER  H      17 LYS  H       3.47            #peak   255 #SUP  0.96  #QF  0.96
 14 ASP  HA     16 SER  H       3.73            #peak   256 #SUP  0.87  #QF  0.87
 16 SER  H      16 SER  HB3     3.43            #peak   258 #SUP  0.90  #QF  0.90
 16 SER  H      16 SER  HB2     3.43            #peak   259 #SUP  0.87  #QF  0.87
 43 PHE  H      44 HIS  H       3.55            #peak   260 #SUP  0.90  #QF  0.90
 43 PHE  HB3    44 HIS  H       3.36            #peak   264 #SUP  0.89  #QF  0.89
 46 ARG  H      47 LEU  H       3.54            #peak   267 #SUP  0.87  #QF  0.87
 46 ARG  H      46 ARG  HG3     4.24            #peak   271 #SUP  0.94  #QF  0.94
 19 LYS  HB2    22 GLU  H       3.88            #peak   274 #SUP  0.99  #QF  0.92
 27 ILE  H      28 ASN  H       3.42            #peak   275 #SUP  1.00
 28 ASN  H      29 THR  H       3.27            #peak   276 #SUP  0.97  #QF  0.97
 28 ASN  H      28 ASN  HB2     2.94            #peak   280 #SUP  0.89  #QF  0.89
 27 ILE  HB     28 ASN  H       3.57            #peak   281 #SUP  0.99  #QF  0.99
 10 THR  H      11 LYS  H       4.19            #peak   283 #SUP  1.00
 10 THR  H      10 THR  HB      3.61            #peak   285 #SUP  0.86  #QF  0.86
  9 GLY  QA     10 THR  H       2.92            #peak   286 #SUP  1.00
 28 ASN  HB2    28 ASN  HD21    3.40            #peak   293 #SUP  0.97  #QF  0.97
 28 ASN  HB2    28 ASN  HD22    3.78            #peak   294 #SUP  1.00
  3 LEU  H       4 GLY  H       4.10            #peak   297 #SUP  0.56  #QF  0.56
 29 THR  H      29 THR  HB      3.78            #peak   305 #SUP  1.00
 26 THR  HA     29 THR  H       4.16            #peak   306 #SUP  0.96  #QF  0.96
 27 ILE  HA     29 THR  H       4.52            #peak   307 #SUP  0.96  #QF  0.96
 28 ASN  HB2    29 THR  H       3.87            #peak   308 #SUP  1.00  #QF  0.98
 28 ASN  HB3    29 THR  H       4.45            #peak   308 #SUP  1.00  #QF  0.98
 28 ASN  HB2    30 SER  H       5.50            #peak   311 #SUP  0.97  #QF  0.97
 30 SER  H      30 SER  HG      4.43            #peak   312 #SUP  0.79  #QF  0.79
 29 THR  H      36 LEU  QD2     5.50            #peak   313 #SUP  0.86  #QF  0.86
 27 ILE  QG2    29 THR  H       5.24            #peak   314 #SUP  0.99  #QF  0.99
 27 ILE  H      29 THR  H       4.97            #peak   315 #SUP  0.98  #QF  0.98
 27 ILE  QD1    28 ASN  H       4.88            #peak   316 #SUP  0.97  #QF  0.97
 28 ASN  H      29 THR  QG2     4.48            #peak   317 #SUP  1.00
 27 ILE  HG13   28 ASN  H       4.42            #peak   318 #SUP  1.00
 25 ASP  HB2    28 ASN  H       5.50            #peak   319 #SUP  0.98  #QF  0.91
 25 ASP  HB3    28 ASN  H       5.50            #peak   319 #SUP  0.98  #QF  0.91
 26 THR  HA     28 ASN  H       4.87            #peak   320 #SUP  0.99  #QF  0.99
 28 ASN  H      28 ASN  HD22    4.74            #peak   321 #SUP  0.99  #QF  0.99
 24 ARG  HG3    28 ASN  HD22    4.86            #peak   323 #SUP  1.00
 24 ARG  HG2    28 ASN  HD22    4.94            #peak   324 #SUP  0.98  #QF  0.98
 24 ARG  HG3    28 ASN  HD21    4.77            #peak   325 #SUP  0.99  #QF  0.99
 25 ASP  HA     28 ASN  HD21    4.47            #peak   326 #SUP  0.91  #QF  0.91
 27 ILE  H      28 ASN  HB2     4.76            #peak   327 #SUP  0.93  #QF  0.93
 23 LEU  HA     27 ILE  H       4.34            #peak   329 #SUP  0.78  #QF  0.78
 26 THR  HG1    27 ILE  H       4.30            #peak   331 #SUP  0.84  #QF  0.84
 23 LEU  QD2    26 THR  H       5.49            #peak   332 #SUP  0.90  #QF  0.90
 26 THR  H      27 ILE  HG13    4.78            #peak   333 #SUP  0.95  #QF  0.95
 26 THR  H      27 ILE  HB      5.50            #peak   334 #SUP  1.00  #QF  0.89
 18 TRP  HZ3    26 THR  H       4.58            #peak   336 #SUP  0.91  #QF  0.91
 26 THR  H      27 ILE  H       3.39            #peak   337 #SUP  0.99  #QF  0.99
 24 ARG  H      25 ASP  H       3.49            #peak   340 #SUP  0.99  #QF  0.99
 21 ALA  HA     24 ARG  H       4.15            #peak   343 #SUP  0.97  #QF  0.97
 22 GLU  H      24 ARG  H       4.53            #peak   345 #SUP  0.95  #QF  0.95
 18 TRP  HB3    23 LEU  H       4.34            #peak   347 #SUP  0.91  #QF  0.91
 23 LEU  H      25 ASP  H       4.64            #peak   350 #SUP  0.95  #QF  0.95
 19 LYS  H      23 LEU  H       5.26            #peak   352 #SUP  0.96  #QF  0.96
 18 TRP  HB3    22 GLU  H       5.50            #peak   353 #SUP  0.95  #QF  0.95
 19 LYS  HA     22 GLU  H       5.00            #peak   355 #SUP  0.96  #QF  0.96
 19 LYS  HA     21 ALA  H       4.57            #peak   358 #SUP  1.00
 21 ALA  H      23 LEU  H       4.77            #peak   359 #SUP  1.00
 20 TYR  H      21 ALA  H       3.93            #peak   360 #SUP  0.99  #QF  0.99
 19 LYS  H      21 ALA  H       5.50            #peak   361 #SUP  1.00
 19 LYS  HB2    20 TYR  H       4.54            #peak   362 #SUP  0.96  #QF  0.95
 19 LYS  HB3    20 TYR  H       4.54            #peak   363 #SUP  0.99  #QF  0.99
 20 TYR  H      20 TYR  QD      4.66            #peak   364 #SUP  1.00
 19 LYS  H      23 LEU  HB2     5.50            #peak   366 #SUP  0.58  #QF  0.58
 19 LYS  H      22 GLU  H       4.74            #peak   367 #SUP  0.99  #QF  0.99
 18 TRP  HD1    19 LYS  H       5.34            #peak   368 #SUP  0.83  #QF  0.83
 19 LYS  H      20 TYR  H       5.16            #peak   370 #SUP  0.99  #QF  0.99
 18 TRP  H      19 LYS  H       4.52            #peak   372 #SUP  0.99  #QF  0.99
 17 LYS  HB2    18 TRP  H       4.48            #peak   374 #SUP  0.97  #QF  0.97
 18 TRP  H      23 LEU  QD2     5.36            #peak   376 #SUP  0.90  #QF  0.90
 18 TRP  HB2    18 TRP  HE1     5.08            #peak   378 #SUP  0.97  #QF  0.97
 15 LEU  QD2    16 SER  H       4.66            #peak   379 #SUP  1.00
 15 LEU  HB3    16 SER  H       4.70            #peak   380 #SUP  0.99  #QF  0.99
 15 LEU  HB2    16 SER  H       4.70            #peak   381 #SUP  0.94  #QF  0.94
 15 LEU  H      15 LEU  QD2     4.21            #peak   382 #SUP  0.95  #QF  0.95
 15 LEU  H      15 LEU  QD1     4.39            #peak   383 #SUP  0.98  #QF  0.98
 14 ASP  HB2    15 LEU  H       4.87            #peak   384 #SUP  0.98  #QF  0.98
 15 LEU  H      16 SER  HA      5.14            #peak   385 #SUP  0.90  #QF  0.90
 14 ASP  H      15 LEU  H       4.84            #peak   386 #SUP  0.98  #QF  0.98
 14 ASP  H      15 LEU  QD2     4.96            #peak   387 #SUP  0.97  #QF  0.97
 13 TYR  QD     14 ASP  H       4.64            #peak   388 #SUP  0.96  #QF  0.96
 12 LYS  HG3    13 TYR  H       4.70            #peak   391 #SUP  0.93  #QF  0.93
 12 LYS  HG2    13 TYR  H       4.70            #peak   392 #SUP  0.98  #QF  0.98
 13 TYR  H      13 TYR  QE      5.12            #peak   394 #SUP  0.99  #QF  0.99
 13 TYR  H      14 ASP  H       4.42            #peak   395 #SUP  0.96  #QF  0.96
  9 GLY  H      10 THR  H       4.49            #peak   397 #SUP  0.90  #QF  0.90
 31 CYS  H      35 LEU  QD1     4.93            #peak   402 #SUP  0.75  #QF  0.75
 26 THR  QG2    31 CYS  H       5.29            #peak   403 #SUP  0.85  #QF  0.85
 31 CYS  H      32 ASP  HB2     4.56            #peak   404 #SUP  0.87  #QF  0.87
 30 SER  HB2    31 CYS  H       4.41            #peak   405 #SUP  0.97  #QF  0.97
 30 SER  HG     31 CYS  H       4.34            #peak   406 #SUP  0.84  #QF  0.84
 31 CYS  H      32 ASP  HA      5.48            #peak   407 #SUP  0.84  #QF  0.84
 32 ASP  H      36 LEU  QD2     4.23            #peak   409 #SUP  0.83  #QF  0.83
 32 ASP  H      35 LEU  HB3     5.37            #peak   410 #SUP  0.81  #QF  0.81
 32 ASP  H      36 LEU  HG      4.67            #peak   411 #SUP  0.98  #QF  0.98
 32 ASP  H      35 LEU  HB2     4.58            #peak   412 #SUP  0.93  #QF  0.93
 30 SER  HB3    32 ASP  H       5.42            #peak   414 #SUP  0.99  #QF  0.99
 32 ASP  HB3    33 ILE  H       4.52            #peak   415 #SUP  0.98  #QF  0.98
 33 ILE  H      34 GLU  HB2     5.33            #peak   416 #SUP  0.75  #QF  0.75
 32 ASP  HA     34 GLU  H       4.14            #peak   419 #SUP  0.91  #QF  0.91
 33 ILE  H      34 GLU  H       3.50            #peak   420 #SUP  0.97  #QF  0.97
 34 GLU  H      36 LEU  H       4.33            #peak   421 #SUP  0.97  #QF  0.97
 13 TYR  QE     35 LEU  H       4.78            #peak   422 #SUP  1.00
 34 GLU  H      35 LEU  H       3.16            #peak   423 #SUP  1.00
 35 LEU  QD2    36 LEU  H       4.97            #peak   424 #SUP  0.97  #QF  0.97
 32 ASP  HB2    36 LEU  H       5.00            #peak   426 #SUP  0.95  #QF  0.95
 32 ASP  HB3    36 LEU  H       4.67            #peak   427 #SUP  0.97  #QF  0.97
 34 GLU  HA     36 LEU  H       4.92            #peak   428 #SUP  0.96  #QF  0.96
 36 LEU  QD1    37 ALA  H       4.58            #peak   430 #SUP  1.00
 36 LEU  QD2    37 ALA  H       4.68            #peak   431 #SUP  0.94  #QF  0.94
 34 GLU  HB2    37 ALA  H       5.50            #peak   432 #SUP  0.94  #QF  0.94
 35 LEU  H      37 ALA  H       4.50            #peak   433 #SUP  0.99  #QF  0.99
 15 LEU  QD1    38 ALA  H       5.04            #peak   434 #SUP  1.00
 35 LEU  QD2    38 ALA  H       5.18            #peak   435 #SUP  1.00
 36 LEU  QD2    38 ALA  H       5.50            #peak   436 #SUP  0.58  #QF  0.58
 36 LEU  HB2    38 ALA  H       5.43            #peak   437 #SUP  1.00  #QF  0.96
 38 ALA  H      40 ARG  H       4.67            #peak   440 #SUP  1.00
 15 LEU  QD1    39 CYS  H       4.18            #peak   441 #SUP  0.98  #QF  0.98
 23 LEU  QD2    39 CYS  H       4.68            #peak   443 #SUP  0.96  #QF  0.96
 37 ALA  QB     39 CYS  H       4.97            #peak   445 #SUP  0.95  #QF  0.95
 39 CYS  H      41 GLU  H       4.54            #peak   447 #SUP  0.98  #QF  0.98
 27 ILE  QD1    40 ARG  H       4.58            #peak   448 #SUP  0.99  #QF  0.99
 23 LEU  QD2    40 ARG  H       5.43            #peak   449 #SUP  0.85  #QF  0.67
 27 ILE  QG2    40 ARG  H       5.50            #peak   449 #SUP  0.85  #QF  0.67
 27 ILE  HG12   40 ARG  H       5.12            #peak   450 #SUP  0.95  #QF  0.87
 36 LEU  QD2    40 ARG  H       5.50            #peak   450 #SUP  0.95  #QF  0.87
 36 LEU  HB3    40 ARG  H       5.36            #peak   451 #SUP  0.99  #QF  0.27
 38 ALA  QB     40 ARG  H       5.50            #peak   451 #SUP  0.99  #QF  0.27
 37 ALA  QB     41 GLU  H       4.95            #peak   457 #SUP  0.95  #QF  0.92
 41 GLU  H      43 PHE  HB3     5.50            #peak   458 #SUP  0.69  #QF  0.35
 39 CYS  HA     41 GLU  H       4.91            #peak   459 #SUP  0.98  #QF  0.98
 38 ALA  H      41 GLU  H       4.65            #peak   460 #SUP  1.00
 15 LEU  QD1    42 GLU  H       4.45            #peak   462 #SUP  0.98  #QF  0.98
 23 LEU  QD2    42 GLU  H       5.23            #peak   463 #SUP  0.98  #QF  0.98
 42 GLU  H      43 PHE  HB3     5.48            #peak   464 #SUP  0.70  #QF  0.29
 42 GLU  H      43 PHE  HB2     5.50            #peak   464 #SUP  0.70  #QF  0.29
 23 LEU  QD2    43 PHE  H       4.70            #peak   465 #SUP  0.94  #QF  0.94
 23 LEU  QD1    43 PHE  H       4.66            #peak   466 #SUP  0.97  #QF  0.97
 27 ILE  QD1    43 PHE  H       5.50            #peak   467 #SUP  0.95  #QF  0.95
 40 ARG  HA     43 PHE  H       4.36            #peak   469 #SUP  0.97  #QF  0.97
 44 HIS  H      47 LEU  HB2     5.50            #peak   472 #SUP  0.61  #QF  0.61
 40 ARG  HA     44 HIS  H       4.47            #peak   473 #SUP  0.74  #QF  0.74
 44 HIS  H      44 HIS  HD2     5.18            #peak   474 #SUP  0.62  #QF  0.62
 44 HIS  H      46 ARG  H       4.50            #peak   475 #SUP  0.93  #QF  0.93
 44 HIS  HD2    45 ARG  H       5.07            #peak   476 #SUP  0.94  #QF  0.94
 42 GLU  HA     46 ARG  H       4.55            #peak   484 #SUP  0.93  #QF  0.93
 46 ARG  H      46 ARG  HE      5.29            #peak   485 #SUP  0.95  #QF  0.95
 43 PHE  HA     46 ARG  HE      4.72            #peak   488 #SUP  0.97  #QF  0.97
 44 HIS  HB2    47 LEU  H       5.50            #peak   490 #SUP  0.78  #QF  0.36
 44 HIS  HB3    47 LEU  H       5.50            #peak   490 #SUP  0.78  #QF  0.36
 49 VAL  HB     50 TYR  H       4.58            #peak   491 #SUP  1.00
 50 TYR  H      50 TYR  QD      4.51            #peak   492 #SUP  0.93  #QF  0.93
 28 ASN  H      36 LEU  QD2     5.00            #peak   493 #SUP  0.87  #QF  0.87
 26 THR  H      28 ASN  H       4.47            #peak   494 #SUP  0.99  #QF  0.99
 24 ARG  HG2    28 ASN  HD21    5.28            #peak   495 #SUP  1.00  #QF  0.99
 27 ILE  HG13   28 ASN  HD21    5.50            #peak   495 #SUP  1.00  #QF  0.99
 28 ASN  H      30 SER  H       4.68            #peak   496 #SUP  0.94  #QF  0.94
 38 ALA  H      41 GLU  HB2     5.17            #peak   498 #SUP  0.99  #QF  0.99
 27 ILE  HG12   39 CYS  H       5.50            #peak   500 #SUP  0.96  #QF  0.62
 36 LEU  QD2    39 CYS  H       5.50            #peak   500 #SUP  0.96  #QF  0.62
 38 ALA  QB     41 GLU  H       4.93            #peak   501 #SUP  0.98  #QF  0.98
 43 PHE  H      43 PHE  QD      4.70            #peak   502 #SUP  0.94  #QF  0.94
 44 HIS  H      45 ARG  H       3.48            #peak   504 #SUP  0.87  #QF  0.87
 43 PHE  HB3    45 ARG  H       5.40            #peak   505 #SUP  0.91  #QF  0.25
 43 PHE  QD     46 ARG  H       5.46            #peak   506 #SUP  0.57  #QF  0.57
 25 ASP  H      26 THR  H       3.22            #peak   508 #SUP  0.94  #QF  0.94
 17 LYS  H      17 LYS  HB3     4.17            #peak   509 #SUP  0.97  #QF  0.97
 17 LYS  H      18 TRP  HB2     5.25            #peak   510 #SUP  0.89  #QF  0.89
 15 LEU  H      17 LYS  H       5.19            #peak   511 #SUP  0.99  #QF  0.99
 23 LEU  HB2    24 ARG  H       3.73            #peak   512 #SUP  0.91  #QF  0.91
 24 ARG  H      24 ARG  HB2     3.46            #peak   513 #SUP  0.95  #QF  0.95
 24 ARG  H      24 ARG  HG2     4.69            #peak   514 #SUP  0.96  #QF  0.96
 21 ALA  QB     23 LEU  H       4.76            #peak   515 #SUP  0.96  #QF  0.96
 22 GLU  H      22 GLU  HG2     4.11            #peak   518 #SUP  0.96  #QF  0.96
 19 LYS  HB3    22 GLU  H       3.88            #peak   519 #SUP  0.99  #QF  0.75
 22 GLU  H      23 LEU  HG      5.01            #peak   520 #SUP  0.92  #QF  0.92
 20 TYR  HB3    22 GLU  H       5.22            #peak   522 #SUP  0.96  #QF  0.96
 18 TRP  HE3    22 GLU  H       5.28            #peak   523 #SUP  0.92  #QF  0.92
 15 LEU  QD2    17 LYS  H       5.50            #peak   524 #SUP  0.98  #QF  0.98
 14 ASP  H      15 LEU  HG      5.50            #peak   525 #SUP  0.94  #QF  0.94
 13 TYR  H      15 LEU  QD2     5.50            #peak   526 #SUP  0.98  #QF  0.98
 18 TRP  HA     18 TRP  HE1     5.00            #peak   528 #SUP  0.99  #QF  0.99
 18 TRP  HE1    23 LEU  QD2     5.18            #peak   529 #SUP  0.97  #QF  0.97
 15 LEU  HG     16 SER  H       5.20            #peak   530 #SUP  1.00
 31 CYS  H      36 LEU  QD1     5.48            #peak   532 #SUP  0.99  #QF  0.99
 43 PHE  HB3    46 ARG  H       5.50            #peak   533 #SUP  0.91  #QF  0.28
 23 LEU  QD2    46 ARG  HE      5.23            #peak   534 #SUP  0.98  #QF  0.98
 12 LYS  H      12 LYS  QE      5.50            #peak   536 #SUP  0.98  #QF  0.36
 18 TRP  HB3    18 TRP  HE3     4.12            #peak     1 #SUP  0.97  #QF  0.48
 13 TYR  QE     34 GLU  HB3     4.44            #peak     4 #SUP  0.68  #QF  0.68
 27 ILE  QD1    43 PHE  QD      3.90            #peak     7 #SUP  0.96  #QF  0.96
 27 ILE  QD1    40 ARG  HA      3.78            #peak     8 #SUP  1.00
 24 ARG  HA     27 ILE  QD1     3.50            #peak     9 #SUP  0.94  #QF  0.94
 27 ILE  HB     27 ILE  QD1     3.26            #peak    11 #SUP  1.00
 33 ILE  HB     33 ILE  QD1     3.38            #peak    14 #SUP  0.99  #QF  0.99
 33 ILE  HA     33 ILE  QD1     3.87            #peak    16 #SUP  1.00
 20 TYR  QE     24 ARG  HD2     4.48            #peak    35 #SUP  0.74  #QF  0.74
 24 ARG  HA     24 ARG  HD2     4.21            #peak    36 #SUP  0.99  #QF  0.99
 23 LEU  HB2    23 LEU  QD2     4.19            #peak    48 #SUP  1.00
 23 LEU  HB3    23 LEU  QD2     3.97            #peak    55 #SUP  1.00
 47 LEU  HB3    47 LEU  QD2     4.07            #peak    75 #SUP  1.00  #QF  0.99
 32 ASP  H      32 ASP  HB3     3.93            #peak    76 #SUP  0.99  #QF  0.99
 32 ASP  HB2    35 LEU  HB2     4.33            #peak    80 #SUP  0.99  #QF  0.99
 32 ASP  HB3    35 LEU  HB2     4.16            #peak    85 #SUP  0.99  #QF  0.99
 35 LEU  H      35 LEU  HB3     3.90            #peak    92 #SUP  1.00
 25 ASP  HB3    26 THR  H       4.03            #peak   101 #SUP  0.96  #QF  0.96
 22 GLU  HA     25 ASP  HB3     4.25            #peak   102 #SUP  0.96  #QF  0.96
 15 LEU  HB3    15 LEU  QD1     4.12            #peak   109 #SUP  1.00
 15 LEU  HB3    15 LEU  QD2     4.20            #peak   110 #SUP  1.00
 13 TYR  HB2    38 ALA  QB      4.12            #peak   115 #SUP  0.92  #QF  0.92
 13 TYR  HB2    15 LEU  HG      4.46            #peak   116 #SUP  1.00  #QF  0.91
 43 PHE  HB2    44 HIS  H       4.05            #peak   121 #SUP  0.98  #QF  0.98
 43 PHE  H      43 PHE  HB2     3.65            #peak   124 #SUP  0.99  #QF  0.99
 34 GLU  HA     34 GLU  HG2     3.78            #peak   164 #SUP  0.99  #QF  0.99
 34 GLU  H      34 GLU  HG3     3.85            #peak   166 #SUP  1.00
 22 GLU  HA     22 GLU  HG2     4.06            #peak   171 #SUP  0.99  #QF  0.99
 22 GLU  H      22 GLU  HG3     4.11            #peak   172 #SUP  0.99  #QF  0.99
 41 GLU  H      41 GLU  HG2     3.95            #peak   176 #SUP  0.99  #QF  0.99
 23 LEU  QD2    42 GLU  HG2     4.72            #peak   182 #SUP  0.98  #QF  0.98
 33 ILE  HA     36 LEU  H       4.24            #peak   200 #SUP  0.95  #QF  0.95
 33 ILE  HA     33 ILE  HG13    3.76            #peak   203 #SUP  1.00
 33 ILE  HA     33 ILE  HG12    3.76            #peak   204 #SUP  0.85  #QF  0.85
 27 ILE  HA     27 ILE  HG13    3.87            #peak   209 #SUP  0.96  #QF  0.96
 30 SER  HB3    35 LEU  QD1     3.74            #peak   213 #SUP  0.62  #QF  0.62
 48 LYS  QB     49 VAL  HA      4.28            #peak   219 #SUP  0.47  #QF  0.47
 48 LYS  QB     49 VAL  H       3.96            #peak   222 #SUP  1.00
 48 LYS  QB     48 LYS  QD      3.49            #peak   223 #SUP  1.00
 17 LYS  HB2    17 LYS  QD      3.94            #peak   232 #SUP  0.99  #QF  0.99
 27 ILE  HG13   39 CYS  HB3     4.44            #peak   274 #SUP  0.96  #QF  0.96
 27 ILE  HA     27 ILE  HG12    3.83            #peak   275 #SUP  1.00
 27 ILE  QG2    27 ILE  HG12    3.76            #peak   279 #SUP  0.99  #QF  0.99
 49 VAL  HA     50 TYR  H       3.23            #peak   288 #SUP  0.94  #QF  0.94
 10 THR  HA     11 LYS  QB      4.55            #peak   298 #SUP  0.97  #QF  0.97
 10 THR  HA     10 THR  QG2     3.14            #peak   299 #SUP  0.98  #QF  0.98
 22 GLU  H      22 GLU  HB2     3.84            #peak   302 #SUP  0.99  #QF  0.99
 18 TRP  HB3    22 GLU  HB2     4.40            #peak   303 #SUP  0.96  #QF  0.96
 22 GLU  HB3    23 LEU  HG      4.32            #peak   322 #SUP  0.59  #QF  0.59
 22 GLU  H      22 GLU  HB3     3.98            #peak   324 #SUP  1.00
 42 GLU  HA     43 PHE  HA      4.90            #peak   335 #SUP  0.89  #QF  0.89
 34 GLU  H      34 GLU  HB3     3.72            #peak   341 #SUP  1.00
 34 GLU  HB3    35 LEU  H       4.23            #peak   342 #SUP  1.00
 43 PHE  HA     43 PHE  QD      3.59            #peak   345 #SUP  0.97  #QF  0.97
 38 ALA  HA     41 GLU  HB2     3.47            #peak   351 #SUP  1.00  #QF  0.90
 11 LYS  HA     11 LYS  QD      4.42            #peak   354 #SUP  0.95  #QF  0.95
 48 LYS  HA     48 LYS  QD      4.01            #peak   356 #SUP  0.92  #QF  0.92
 40 ARG  H      40 ARG  HG2     4.22            #peak   361 #SUP  1.00
 40 ARG  HA     43 PHE  QD      4.62            #peak   374 #SUP  0.99  #QF  0.99
 40 ARG  HA     40 ARG  HG2     3.81            #peak   375 #SUP  0.99  #QF  0.98
 40 ARG  HA     40 ARG  HG3     3.81            #peak   376 #SUP  1.00
 40 ARG  HA     43 PHE  HB3     3.79            #peak   379 #SUP  0.95  #QF  0.90
 45 ARG  H      45 ARG  HG3     4.07            #peak   394 #SUP  0.99  #QF  0.99
 44 HIS  HA     47 LEU  HB2     3.91            #peak   410 #SUP  0.77  #QF  0.77
 34 GLU  HA     34 GLU  HG3     3.78            #peak   416 #SUP  0.76  #QF  0.63
 34 GLU  HA     37 ALA  QB      3.48            #peak   418 #SUP  0.57  #QF  0.57
 45 ARG  HA     45 ARG  HG2     3.66            #peak   424 #SUP  0.99  #QF  0.99
 45 ARG  HA     45 ARG  HG3     3.66            #peak   425 #SUP  0.99  #QF  0.99
 27 ILE  HG13   39 CYS  HB2     4.44            #peak   431 #SUP  0.96  #QF  0.96
 27 ILE  HG12   39 CYS  HB2     4.84            #peak   432 #SUP  0.96  #QF  0.96
 24 ARG  HA     27 ILE  H       4.37            #peak   441 #SUP  0.98  #QF  0.98
 24 ARG  HA     27 ILE  HB      3.86            #peak   442 #SUP  1.00  #QF  0.98
 24 ARG  HA     24 ARG  HG2     3.64            #peak   446 #SUP  0.99  #QF  0.99
 36 LEU  HA     36 LEU  HG      3.98            #peak   451 #SUP  0.98  #QF  0.98
 18 TRP  HB3    23 LEU  HG      4.36            #peak   452 #SUP  0.99  #QF  0.94
 18 TRP  HE3    23 LEU  HG      4.18            #peak   456 #SUP  0.99  #QF  0.97
 18 TRP  HE3    23 LEU  HA      3.76            #peak   461 #SUP  0.96  #QF  0.80
 18 TRP  HZ3    23 LEU  HA      4.07            #peak   461 #SUP  0.96  #QF  0.80
 47 LEU  H      47 LEU  HG      4.17            #peak   466 #SUP  1.00
 23 LEU  HA     23 LEU  HG      4.15            #peak   468 #SUP  0.93  #QF  0.93
 22 GLU  HA     25 ASP  H       4.15            #peak   469 #SUP  0.97  #QF  0.97
 22 GLU  HA     25 ASP  HB2     4.25            #peak   471 #SUP  0.82  #QF  0.82
 22 GLU  HA     22 GLU  HG3     4.06            #peak   473 #SUP  1.00
 18 TRP  HA     19 LYS  H       3.00            #peak   475 #SUP  0.99  #QF  0.99
 18 TRP  HA     18 TRP  HD1     3.85            #peak   477 #SUP  0.95  #QF  0.95
 24 ARG  HG2    25 ASP  H       5.12            #peak   482 #SUP  0.99  #QF  0.99
 35 LEU  HB3    35 LEU  QD1     3.22            #peak   493 #SUP  0.96  #QF  0.71
 50 TYR  HA     50 TYR  QD      3.84            #peak   499 #SUP  1.00
 19 LYS  HA     19 LYS  HG2     4.09            #peak   508 #SUP  0.97  #QF  0.97
 25 ASP  HA     28 ASN  H       3.88            #peak   513 #SUP  0.83  #QF  0.83
 13 TYR  HA     13 TYR  QD      3.46            #peak   516 #SUP  0.97  #QF  0.97
 25 ASP  HA     28 ASN  HB2     3.49            #peak   520 #SUP  0.84  #QF  0.84
 23 LEU  QD1    43 PHE  QD      3.79            #peak   523 #SUP  0.91  #QF  0.89
 20 TYR  HA     23 LEU  QD1     3.45            #peak   524 #SUP  0.96  #QF  0.96
 18 TRP  HB3    23 LEU  QD1     4.07            #peak   525 #SUP  0.84  #QF  0.75
 23 LEU  QD1    43 PHE  HB2     4.22            #peak   526 #SUP  0.92  #QF  0.92
 23 LEU  HB2    23 LEU  QD1     3.44            #peak   528 #SUP  0.99  #QF  0.99
 23 LEU  HB3    23 LEU  QD1     3.51            #peak   530 #SUP  1.00
 24 ARG  HG3    25 ASP  HA      5.12            #peak   531 #SUP  0.78  #QF  0.78
 35 LEU  HA     35 LEU  HG      3.95            #peak   539 #SUP  1.00
 13 TYR  QE     35 LEU  HA      4.41            #peak   542 #SUP  0.97  #QF  0.97
 47 LEU  HA     47 LEU  QD1     3.99            #peak   551 #SUP  0.98  #QF  0.98
 43 PHE  QE     47 LEU  QD1     5.48            #peak   552 #SUP  0.98  #QF  0.91
 36 LEU  H      36 LEU  QD1     3.98            #peak   553 #SUP  0.99  #QF  0.99
 32 ASP  H      36 LEU  QD1     4.36            #peak   554 #SUP  0.93  #QF  0.93
 23 LEU  H      23 LEU  QD2     3.85            #peak   560 #SUP  1.00
 18 TRP  HE3    23 LEU  QD2     3.34            #peak   561 #SUP  0.98  #QF  0.95
 23 LEU  HA     23 LEU  QD2     3.31            #peak   562 #SUP  0.99  #QF  0.99
 23 LEU  QD2    39 CYS  HA      3.48            #peak   563 #SUP  0.99  #QF  0.99
 22 GLU  HB3    23 LEU  QD2     5.26            #peak   570 #SUP  0.97  #QF  0.55
 12 LYS  HA     13 TYR  H       3.37            #peak   574 #SUP  0.81  #QF  0.65
 12 LYS  HA     12 LYS  QD      3.33            #peak   575 #SUP  1.00  #QF  0.97
 11 LYS  HA     11 LYS  HG2     4.13            #peak   576 #SUP  0.91  #QF  0.91
 11 LYS  HA     11 LYS  HG3     4.13            #peak   580 #SUP  0.93  #QF  0.93
 19 LYS  HA     19 LYS  HG3     4.09            #peak   590 #SUP  0.65  #QF  0.65
 17 LYS  HA     17 LYS  QD      4.37            #peak   591 #SUP  0.92  #QF  0.92
 17 LYS  HA     17 LYS  HG2     4.06            #peak   593 #SUP  0.98  #QF  0.98
 17 LYS  HA     17 LYS  HG3     4.06            #peak   594 #SUP  0.97  #QF  0.97
 20 TYR  QD     21 ALA  HA      4.22            #peak   599 #SUP  0.99  #QF  0.99
 21 ALA  HA     24 ARG  HB2     3.92            #peak   600 #SUP  0.96  #QF  0.96
 21 ALA  HA     24 ARG  HG2     5.11            #peak   601 #SUP  1.00
 21 ALA  HA     24 ARG  HB3     3.92            #peak   602 #SUP  0.98  #QF  0.98
 47 LEU  H      47 LEU  QD2     4.23            #peak   611 #SUP  0.97  #QF  0.97
 43 PHE  QD     47 LEU  QD2     5.31            #peak   612 #SUP  0.87  #QF  0.55
 43 PHE  QE     47 LEU  QD2     5.48            #peak   612 #SUP  0.87  #QF  0.55
 47 LEU  HA     47 LEU  QD2     3.99            #peak   613 #SUP  0.92  #QF  0.92
 38 ALA  HA     41 GLU  H       3.87            #peak   617 #SUP  0.98  #QF  0.98
 18 TRP  HZ3    26 THR  QG2     3.52            #peak   621 #SUP  0.69  #QF  0.69
 26 THR  QG2    26 THR  HG1     4.00            #peak   622 #SUP  0.94  #QF  0.94
 26 THR  QG2    30 SER  HB3     3.42            #peak   624 #SUP  0.99  #QF  0.99
 26 THR  HA     26 THR  QG2     3.31            #peak   625 #SUP  1.00
 26 THR  QG2    30 SER  HB2     3.47            #peak   626 #SUP  0.90  #QF  0.21
 26 THR  QG2    35 LEU  QD1     3.14            #peak   628 #SUP  0.73  #QF  0.73
 26 THR  QG2    35 LEU  QD2     3.75            #peak   629 #SUP  0.89  #QF  0.89
 28 ASN  HA     28 ASN  HD22    4.18            #peak   630 #SUP  0.91  #QF  0.91
 18 TRP  HH2    35 LEU  QD2     4.17            #peak   632 #SUP  0.55  #QF  0.55
 13 TYR  QE     35 LEU  QD2     3.70            #peak   633 #SUP  0.98  #QF  0.98
 35 LEU  HA     35 LEU  QD2     2.97            #peak   634 #SUP  0.99  #QF  0.99
 34 GLU  HB2    35 LEU  QD2     4.71            #peak   635 #SUP  0.69  #QF  0.69
 35 LEU  HB2    35 LEU  QD2     3.68            #peak   636 #SUP  0.99  #QF  0.99
 35 LEU  HB3    35 LEU  QD2     3.18            #peak   637 #SUP  1.00  #QF  0.94
 15 LEU  QD1    35 LEU  QD2     4.02            #peak   639 #SUP  0.97  #QF  0.97
 15 LEU  QD2    35 LEU  QD2     3.48            #peak   640 #SUP  0.99  #QF  0.99
 10 THR  H      10 THR  QG2     3.90            #peak   641 #SUP  1.00
 10 THR  QG2    11 LYS  H       4.09            #peak   642 #SUP  0.99  #QF  0.99
 15 LEU  HA     18 TRP  HD1     4.18            #peak   645 #SUP  0.96  #QF  0.96
 29 THR  QG2    30 SER  H       4.25            #peak   647 #SUP  0.99  #QF  0.99
 29 THR  H      29 THR  QG2     3.49            #peak   650 #SUP  1.00
 29 THR  HA     29 THR  QG2     2.96            #peak   651 #SUP  0.97  #QF  0.97
 28 ASN  HB2    29 THR  QG2     3.83            #peak   652 #SUP  0.87  #QF  0.43
 28 ASN  HB3    29 THR  QG2     4.03            #peak   652 #SUP  0.87  #QF  0.43
 49 VAL  QG2    50 TYR  QD      5.22            #peak   654 #SUP  0.91  #QF  0.91
 49 VAL  HA     49 VAL  QG2     3.27            #peak   655 #SUP  0.99  #QF  0.99
 49 VAL  H      49 VAL  QG1     4.01            #peak   657 #SUP  0.96  #QF  0.96
 15 LEU  QD2    18 TRP  HZ2     4.11            #peak   661 #SUP  0.98  #QF  0.98
 15 LEU  QD2    18 TRP  HE3     5.09            #peak   662 #SUP  0.99  #QF  0.97
 15 LEU  QD2    18 TRP  HZ3     5.50            #peak   662 #SUP  0.99  #QF  0.97
 13 TYR  QD     15 LEU  QD2     4.52            #peak   663 #SUP  0.98  #QF  0.98
 15 LEU  HA     15 LEU  QD2     3.07            #peak   664 #SUP  0.97  #QF  0.97
 13 TYR  HB2    15 LEU  QD2     3.82            #peak   665 #SUP  1.00  #QF  0.98
 13 TYR  HB3    15 LEU  QD2     4.03            #peak   665 #SUP  1.00  #QF  0.98
 15 LEU  HB2    15 LEU  QD2     4.20            #peak   667 #SUP  0.98  #QF  0.98
 49 VAL  QG1    50 TYR  H       4.47            #peak   671 #SUP  0.95  #QF  0.95
 49 VAL  QG1    50 TYR  QD      5.22            #peak   672 #SUP  0.82  #QF  0.82
 49 VAL  HA     49 VAL  QG1     3.27            #peak   673 #SUP  0.99  #QF  0.99
  5 SER  HA      6 PRO  HD2     3.22            #peak   675 #SUP  1.00
  5 SER  HA      6 PRO  HD3     3.22            #peak   677 #SUP  1.00
 21 ALA  H      21 ALA  QB      2.91            #peak   679 #SUP  1.00
 20 TYR  QD     21 ALA  QB      4.16            #peak   680 #SUP  0.99  #QF  0.99
 21 ALA  QB     22 GLU  H       3.38            #peak   681 #SUP  0.99  #QF  0.99
 20 TYR  HB3    21 ALA  QB      4.10            #peak   683 #SUP  0.96  #QF  0.96
 13 TYR  QE     38 ALA  QB      4.76            #peak   685 #SUP  0.99  #QF  0.99
 35 LEU  QD2    38 ALA  QB      3.63            #peak   686 #SUP  0.97  #QF  0.97
 13 TYR  QD     38 ALA  QB      3.82            #peak   689 #SUP  0.94  #QF  0.94
 35 LEU  HA     38 ALA  QB      3.48            #peak   691 #SUP  0.99  #QF  0.99
 15 LEU  QD1    38 ALA  QB      3.24            #peak   694 #SUP  0.99  #QF  0.99
 15 LEU  QD2    38 ALA  QB      4.04            #peak   695 #SUP  0.99  #QF  0.99
 38 ALA  QB     39 CYS  HA      4.38            #peak   696 #SUP  0.97  #QF  0.97
 33 ILE  H      33 ILE  QG2     3.77            #peak   697 #SUP  1.00
 33 ILE  HA     33 ILE  QG2     3.15            #peak   698 #SUP  1.00
 27 ILE  QG2    28 ASN  H       3.87            #peak   699 #SUP  0.98  #QF  0.98
 27 ILE  HA     27 ILE  QG2     3.13            #peak   702 #SUP  0.99  #QF  0.99
 27 ILE  QG2    27 ILE  HG13    3.62            #peak   705 #SUP  0.99  #QF  0.99
 26 THR  QG2    30 SER  HA      4.55            #peak   707 #SUP  0.89  #QF  0.89
 26 THR  HA     30 SER  HB3     4.48            #peak   712 #SUP  0.99  #QF  0.99
 29 THR  H      30 SER  HB2     5.40            #peak   718 #SUP  0.90  #QF  0.56
 27 ILE  HA     32 ASP  H       5.50            #peak   719 #SUP  0.39  #QF  0.39
 27 ILE  QG2    28 ASN  HA      3.97            #peak   720 #SUP  0.99  #QF  0.99
 27 ILE  QG2    27 ILE  QD1     3.03            #peak   726 #SUP  1.00
 27 ILE  QD1    28 ASN  HD21    4.89            #peak   730 #SUP  0.53  #QF  0.53
 24 ARG  HA     28 ASN  H       4.74            #peak   735 #SUP  0.98  #QF  0.98
 24 ARG  HA     26 THR  H       4.75            #peak   736 #SUP  0.76  #QF  0.76
 24 ARG  H      24 ARG  HG3     4.47            #peak   743 #SUP  0.99  #QF  0.99
 24 ARG  HG3    25 ASP  H       4.78            #peak   744 #SUP  0.98  #QF  0.98
 23 LEU  HB2    43 PHE  QD      4.62            #peak   746 #SUP  0.85  #QF  0.73
 23 LEU  HB2    43 PHE  QE      5.14            #peak   746 #SUP  0.85  #QF  0.73
 23 LEU  QD1    46 ARG  HE      4.45            #peak   751 #SUP  0.98  #QF  0.98
 18 TRP  HB3    22 GLU  HB3     4.76            #peak   752 #SUP  0.95  #QF  0.95
 18 TRP  HE3    22 GLU  HB3     4.59            #peak   753 #SUP  0.99  #QF  0.96
 18 TRP  HZ3    22 GLU  HB3     5.23            #peak   753 #SUP  0.99  #QF  0.96
 19 LYS  H      22 GLU  HB3     4.70            #peak   755 #SUP  0.97  #QF  0.97
 18 TRP  HE3    22 GLU  HB2     4.51            #peak   757 #SUP  0.98  #QF  0.97
 21 ALA  QB     24 ARG  H       5.21            #peak   762 #SUP  0.93  #QF  0.93
 19 LYS  H      19 LYS  HG3     4.31            #peak   767 #SUP  1.00
 19 LYS  HA     19 LYS  HD2     4.55            #peak   768 #SUP  0.99  #QF  0.99
 19 LYS  H      19 LYS  HD2     4.82            #peak   769 #SUP  0.98  #QF  0.98
 19 LYS  H      19 LYS  HD3     4.82            #peak   770 #SUP  0.87  #QF  0.87
 18 TRP  HZ3    23 LEU  QD2     4.97            #peak   780 #SUP  0.96  #QF  0.96
 18 TRP  HH2    35 LEU  QD1     4.80            #peak   782 #SUP  0.99  #QF  0.99
 18 TRP  HH2    26 THR  QG2     4.90            #peak   783 #SUP  0.98  #QF  0.98
 15 LEU  HA     15 LEU  QD1     4.46            #peak   788 #SUP  0.99  #QF  0.99
 48 LYS  H      48 LYS  HG2     4.85            #peak   807 #SUP  0.99  #QF  0.99
 48 LYS  H      48 LYS  HG3     4.85            #peak   808 #SUP  0.97  #QF  0.97
 47 LEU  HB2    48 LYS  H       4.59            #peak   813 #SUP  0.99  #QF  0.99
 31 CYS  HB3    32 ASP  H       4.59            #peak   816 #SUP  0.96  #QF  0.96
 32 ASP  HA     33 ILE  HA      4.44            #peak   819 #SUP  0.90  #QF  0.90
 32 ASP  HB2    35 LEU  HG      5.38            #peak   823 #SUP  1.00  #QF  0.93
 32 ASP  HA     33 ILE  HB      4.94            #peak   825 #SUP  0.99  #QF  0.99
 33 ILE  QG2    33 ILE  HG12    3.45            #peak   829 #SUP  0.98  #QF  0.98
 33 ILE  QG2    33 ILE  HG13    3.45            #peak   830 #SUP  0.99  #QF  0.99
 13 TYR  QE     34 GLU  HB2     4.70            #peak   834 #SUP  0.91  #QF  0.91
 35 LEU  HB2    36 LEU  H       4.44            #peak   836 #SUP  1.00
 32 ASP  HB3    35 LEU  HB3     4.56            #peak   837 #SUP  1.00
 32 ASP  HB2    35 LEU  HB3     4.72            #peak   838 #SUP  0.95  #QF  0.95
 35 LEU  QD2    39 CYS  H       4.77            #peak   841 #SUP  0.77  #QF  0.77
 30 SER  HB3    36 LEU  HG      5.50            #peak   843 #SUP  0.99  #QF  0.99
 27 ILE  HG12   39 CYS  HB3     4.84            #peak   848 #SUP  0.98  #QF  0.98
 40 ARG  H      40 ARG  HD3     4.98            #peak   857 #SUP  0.99  #QF  0.99
 38 ALA  QB     41 GLU  HB2     4.71            #peak   858 #SUP  0.99  #QF  0.99
 23 LEU  QD2    42 GLU  HB3     5.12            #peak   861 #SUP  0.88  #QF  0.88
 23 LEU  QD2    42 GLU  HG3     4.72            #peak   869 #SUP  1.00
 43 PHE  HA     46 ARG  H       4.47            #peak   871 #SUP  0.78  #QF  0.78
 27 ILE  QD1    43 PHE  HB3     5.27            #peak   872 #SUP  0.98  #QF  0.98
 44 HIS  HA     44 HIS  HD2     4.41            #peak   873 #SUP  0.93  #QF  0.93
 44 HIS  HB2    45 ARG  HA      5.50            #peak   875 #SUP  0.88  #QF  0.68
 44 HIS  HB3    45 ARG  HA      5.50            #peak   875 #SUP  0.88  #QF  0.68
 20 TYR  QE     24 ARG  HD3     4.48            #peak   880 #SUP  0.79  #QF  0.79
 46 ARG  HA     46 ARG  HD2     4.67            #peak   881 #SUP  0.98  #QF  0.98
 46 ARG  HA     46 ARG  HD3     4.67            #peak   882 #SUP  0.92  #QF  0.92
 23 LEU  QD1    46 ARG  HD3     4.91            #peak   886 #SUP  0.94  #QF  0.94
 47 LEU  HB3    47 LEU  QD1     4.07            #peak   887 #SUP  0.99  #QF  0.99
 28 ASN  HA     28 ASN  HD21    4.11            #peak   891 #SUP  0.98  #QF  0.96
 27 ILE  QG2    28 ASN  HB2     5.28            #peak   892 #SUP  0.99  #QF  0.99
 31 CYS  HA     36 LEU  QD1     3.44            #peak   897 #SUP  0.50  #QF  0.50
 31 CYS  H      31 CYS  HB2     4.00            #peak   901 #SUP  0.99  #QF  0.99
 32 ASP  HB3    35 LEU  HG      5.10            #peak   902 #SUP  1.00  #QF  0.97
 33 ILE  HA     36 LEU  HB2     3.48            #peak   906 #SUP  0.85  #QF  0.85
 33 ILE  QG2    34 GLU  HA      4.18            #peak   907 #SUP  0.98  #QF  0.98
 33 ILE  H      33 ILE  QD1     4.05            #peak   909 #SUP  0.99  #QF  0.99
 13 TYR  QD     35 LEU  HA      4.90            #peak   915 #SUP  0.92  #QF  0.92
 15 LEU  QD2    35 LEU  QD1     5.50            #peak   918 #SUP  0.98  #QF  0.98
 32 ASP  HB2    35 LEU  QD1     4.61            #peak   919 #SUP  1.00
 32 ASP  HB3    35 LEU  QD1     4.16            #peak   920 #SUP  0.99  #QF  0.99
 35 LEU  HA     35 LEU  QD1     3.89            #peak   921 #SUP  0.98  #QF  0.98
 13 TYR  QE     35 LEU  QD1     4.59            #peak   922 #SUP  0.98  #QF  0.98
 18 TRP  HZ2    35 LEU  QD2     4.37            #peak   923 #SUP  0.96  #QF  0.96
 30 SER  HB3    35 LEU  QD2     5.50            #peak   924 #SUP  0.68  #QF  0.68
 13 TYR  HB2    35 LEU  QD2     4.85            #peak   925 #SUP  0.98  #QF  0.91
 13 TYR  HB3    35 LEU  QD2     5.12            #peak   925 #SUP  0.98  #QF  0.91
 36 LEU  HA     39 CYS  H       4.34            #peak   926 #SUP  0.83  #QF  0.83
 36 LEU  HA     36 LEU  QD1     3.99            #peak   930 #SUP  0.98  #QF  0.98
 24 ARG  HA     24 ARG  HG3     3.95            #peak   931 #SUP  0.62  #QF  0.62
 24 ARG  HA     27 ILE  QG2     4.59            #peak   932 #SUP  0.92  #QF  0.92
 36 LEU  HG     37 ALA  H       4.74            #peak   936 #SUP  0.88  #QF  0.88
 33 ILE  HA     36 LEU  QD1     3.14            #peak   937 #SUP  0.88  #QF  0.88
 36 LEU  HB2    36 LEU  QD1     3.15            #peak   938 #SUP  1.00
 36 LEU  HB3    36 LEU  QD1     3.14            #peak   939 #SUP  1.00
 36 LEU  HB3    36 LEU  QD2     3.26            #peak   940 #SUP  1.00
 36 LEU  HB2    36 LEU  QD2     3.45            #peak   941 #SUP  1.00
 27 ILE  HA     36 LEU  QD2     2.86            #peak   942 #SUP  0.86  #QF  0.61
 36 LEU  HA     36 LEU  QD2     3.02            #peak   942 #SUP  0.86  #QF  0.61
 30 SER  HB3    36 LEU  QD2     4.28            #peak   943 #SUP  0.75  #QF  0.75
 37 ALA  H      37 ALA  QB      2.80            #peak   945 #SUP  0.94  #QF  0.94
 36 LEU  HB2    37 ALA  QB      4.01            #peak   947 #SUP  0.96  #QF  0.96
 37 ALA  QB     38 ALA  HA      4.45            #peak   948 #SUP  0.96  #QF  0.96
 15 LEU  HG     38 ALA  QB      4.12            #peak   949 #SUP  0.99  #QF  0.99
 23 LEU  QD1    39 CYS  HA      4.53            #peak   951 #SUP  0.99  #QF  0.99
 39 CYS  HA     43 PHE  H       4.67            #peak   953 #SUP  0.99  #QF  0.99
 40 ARG  H      40 ARG  HD2     4.98            #peak   957 #SUP  0.98  #QF  0.98
 42 GLU  HA     45 ARG  HD3     4.66            #peak   960 #SUP  0.87  #QF  0.87
 42 GLU  HA     45 ARG  HD2     4.66            #peak   961 #SUP  0.92  #QF  0.92
 23 LEU  QD2    42 GLU  HB2     5.12            #peak   962 #SUP  0.95  #QF  0.95
 42 GLU  HG3    46 ARG  HE      5.09            #peak   965 #SUP  0.94  #QF  0.94
 43 PHE  HA     46 ARG  HD2     4.64            #peak   970 #SUP  0.64  #QF  0.64
 23 LEU  QD2    43 PHE  HA      5.50            #peak   971 #SUP  0.64  #QF  0.39
 43 PHE  H      43 PHE  HB3     3.58            #peak   977 #SUP  0.98  #QF  0.98
 40 ARG  HA     43 PHE  HB2     4.11            #peak   978 #SUP  0.94  #QF  0.94
 44 HIS  HA     47 LEU  HB3     4.80            #peak   979 #SUP  0.98  #QF  0.98
 43 PHE  HB3    44 HIS  HA      4.61            #peak   980 #SUP  0.96  #QF  0.96
 45 ARG  HA     47 LEU  H       4.82            #peak   982 #SUP  0.46  #QF  0.46
 46 ARG  H      46 ARG  HG2     4.24            #peak   995 #SUP  1.00
 43 PHE  HA     46 ARG  HD3     4.64            #peak   998 #SUP  0.98  #QF  0.98
 23 LEU  QD1    46 ARG  HD2     4.91            #peak  1000 #SUP  0.83  #QF  0.83
 44 HIS  HA     47 LEU  HG      4.56            #peak  1003 #SUP  0.99  #QF  0.99
 26 THR  HA     29 THR  HB      5.38            #peak  1018 #SUP  0.94  #QF  0.94
 27 ILE  HA     27 ILE  QD1     4.33            #peak  1019 #SUP  1.00
 26 THR  HA     30 SER  HB2     4.42            #peak  1020 #SUP  0.51  #QF  0.51
 27 ILE  HA     36 LEU  HG      4.42            #peak  1023 #SUP  0.61  #QF  0.61
 26 THR  H      27 ILE  HA      5.50            #peak  1025 #SUP  0.99  #QF  0.99
 27 ILE  QD1    39 CYS  HB3     3.97            #peak  1028 #SUP  1.00
 27 ILE  QD1    39 CYS  HB2     3.97            #peak  1029 #SUP  0.99  #QF  0.99
 23 LEU  HA     26 THR  HB      4.27            #peak  1034 #SUP  0.93  #QF  0.93
 18 TRP  HZ3    26 THR  HB      4.27            #peak  1036 #SUP  0.85  #QF  0.85
 24 ARG  HA     24 ARG  HD3     4.21            #peak  1044 #SUP  0.97  #QF  0.97
 24 ARG  H      24 ARG  HD2     5.00            #peak  1045 #SUP  0.92  #QF  0.92
 24 ARG  H      24 ARG  HD3     5.00            #peak  1046 #SUP  0.97  #QF  0.97
 23 LEU  HA     23 LEU  QD1     4.71            #peak  1047 #SUP  0.98  #QF  0.98
 23 LEU  HB3    43 PHE  QD      4.46            #peak  1050 #SUP  0.92  #QF  0.89
 15 LEU  QD2    23 LEU  QD2     4.09            #peak  1052 #SUP  0.95  #QF  0.95
 15 LEU  QD1    23 LEU  QD2     3.48            #peak  1053 #SUP  1.00
 18 TRP  HB3    23 LEU  QD2     4.12            #peak  1054 #SUP  0.99  #QF  0.93
 18 TRP  HB2    23 LEU  QD2     4.51            #peak  1054 #SUP  0.99  #QF  0.93
 15 LEU  QD1    23 LEU  QD1     4.97            #peak  1055 #SUP  0.80  #QF  0.80
 21 ALA  QB     22 GLU  HA      4.50            #peak  1056 #SUP  0.97  #QF  0.97
 22 GLU  HA     26 THR  H       4.73            #peak  1057 #SUP  1.00
 21 ALA  QB     22 GLU  HB2     4.68            #peak  1059 #SUP  0.88  #QF  0.88
 19 LYS  H      22 GLU  HG3     5.38            #peak  1060 #SUP  0.99  #QF  0.99
 19 LYS  H      22 GLU  HG2     5.38            #peak  1061 #SUP  0.91  #QF  0.91
 21 ALA  QB     22 GLU  HG3     4.92            #peak  1062 #SUP  0.98  #QF  0.98
 21 ALA  QB     22 GLU  HG2     4.92            #peak  1063 #SUP  0.99  #QF  0.99
 20 TYR  HA     23 LEU  QD2     5.39            #peak  1064 #SUP  0.72  #QF  0.72
 20 TYR  HA     23 LEU  HB3     4.86            #peak  1065 #SUP  0.97  #QF  0.97
 20 TYR  HA     23 LEU  HG      4.95            #peak  1066 #SUP  0.99  #QF  0.99
 20 TYR  HA     20 TYR  QE      4.81            #peak  1067 #SUP  0.62  #QF  0.62
 20 TYR  HA     22 GLU  H       4.75            #peak  1068 #SUP  0.96  #QF  0.96
 20 TYR  HA     23 LEU  HB2     4.34            #peak  1069 #SUP  0.99  #QF  0.99
 20 TYR  HA     20 TYR  QD      3.80            #peak  1071 #SUP  0.99  #QF  0.99
 20 TYR  HA     23 LEU  H       4.43            #peak  1072 #SUP  0.95  #QF  0.95
 19 LYS  HA     20 TYR  HB2     5.04            #peak  1073 #SUP  0.90  #QF  0.90
 18 TRP  HA     22 GLU  HB2     4.56            #peak  1084 #SUP  0.99  #QF  0.99
 18 TRP  HB2    23 LEU  QD1     5.50            #peak  1085 #SUP  0.99  #QF  0.59
 17 LYS  HB3    17 LYS  QD      3.94            #peak  1091 #SUP  0.96  #QF  0.96
 15 LEU  HA     17 LYS  H       4.61            #peak  1099 #SUP  0.92  #QF  0.92
 35 LEU  HB2    35 LEU  QD1     3.43            #peak  1101 #SUP  1.00
 15 LEU  HB2    15 LEU  QD1     4.12            #peak  1107 #SUP  0.97  #QF  0.97
 15 LEU  QD1    42 GLU  HB3     4.66            #peak  1109 #SUP  1.00
 15 LEU  QD1    42 GLU  HB2     4.66            #peak  1110 #SUP  0.94  #QF  0.94
 13 TYR  HB2    15 LEU  QD1     4.86            #peak  1111 #SUP  1.00  #QF  0.99
 13 TYR  HB3    15 LEU  QD1     5.50            #peak  1111 #SUP  1.00  #QF  0.99
 15 LEU  QD1    39 CYS  HA      3.35            #peak  1112 #SUP  0.99  #QF  0.99
 15 LEU  QD1    38 ALA  HA      4.61            #peak  1113 #SUP  0.99  #QF  0.99
 13 TYR  QD     15 LEU  QD1     5.03            #peak  1114 #SUP  0.97  #QF  0.97
 13 TYR  HA     15 LEU  QD2     4.81            #peak  1118 #SUP  1.00
 15 LEU  QD2    18 TRP  HD1     4.35            #peak  1119 #SUP  0.97  #QF  0.97
 14 ASP  HA     15 LEU  HG      4.39            #peak  1120 #SUP  0.79  #QF  0.79
 11 LYS  QB     11 LYS  QE      4.65            #peak  1131 #SUP  1.00
 10 THR  HB     11 LYS  H       4.26            #peak  1134 #SUP  0.92  #QF  0.92
 42 GLU  HG2    46 ARG  HE      5.09            #peak  1144 #SUP  0.88  #QF  0.88
 43 PHE  QD     47 LEU  QD1     5.31            #peak  1153 #SUP  0.81  #QF  0.76
 29 THR  H      30 SER  HB3     5.09            #peak  1154 #SUP  0.98  #QF  0.98
 27 ILE  QD1    43 PHE  HB2     4.47            #peak  1158 #SUP  0.92  #QF  0.92
 15 LEU  QD1    18 TRP  HE3     5.50            #peak  1159 #SUP  0.87  #QF  0.87
 24 ARG  HG3    43 PHE  QE      5.50            #peak  1161 #SUP  0.87  #QF  0.87
 20 TYR  HB3    21 ALA  HA      4.60            #peak  1162 #SUP  0.82  #QF  0.82
 21 ALA  HA     23 LEU  H       4.89            #peak  1163 #SUP  1.00
 19 LYS  HA     19 LYS  HD3     4.55            #peak  1165 #SUP  1.00
 12 LYS  HB2    13 TYR  QD      5.50            #peak  1169 #SUP  0.88  #QF  0.48
 12 LYS  HB3    13 TYR  QD      5.50            #peak  1169 #SUP  0.88  #QF  0.48
 11 LYS  H      11 LYS  HG3     5.05            #peak  1171 #SUP  1.00
 48 LYS  H      48 LYS  QD      5.06            #peak  1172 #SUP  0.97  #QF  0.95
 48 LYS  QD     49 VAL  H       5.50            #peak  1172 #SUP  0.97  #QF  0.95
 33 ILE  QD1    34 GLU  H       4.73            #peak  1175 #SUP  0.98  #QF  0.98
 34 GLU  HB2    35 LEU  HA      4.95            #peak  1177 #SUP  1.00
 34 GLU  HB2    35 LEU  HG      4.99            #peak  1179 #SUP  0.81  #QF  0.81
 35 LEU  QD1    36 LEU  H       4.72            #peak  1180 #SUP  0.98  #QF  0.98
 23 LEU  QD1    43 PHE  HA      4.16            #peak  1183 #SUP  0.98  #QF  0.98
 50 TYR  HB3    51 HIS  H       4.76            #peak  1195 #SUP  0.98  #QF  0.98
 12 LYS  HA     13 TYR  QD      4.82            #peak  1196 #SUP  0.89  #QF  0.89
 12 LYS  HB2    13 TYR  QE      5.50            #peak  1197 #SUP  0.65  #QF  0.41
 12 LYS  HB3    13 TYR  QE      5.50            #peak  1197 #SUP  0.65  #QF  0.41
 12 LYS  QD     13 TYR  QE      5.50            #peak  1198 #SUP  0.71  #QF  0.71
  3 LEU  H       3 LEU  QB      3.58            #peak    73
  3 LEU  HA      3 LEU  QQD     4.34            #peak   809
  5 SER  HA      6 PRO  QD      2.81            #peak   675
  8 SER  QB      9 GLY  H       4.26            #peak   245
 11 LYS  H      11 LYS  QG      4.22            #peak    50
 11 LYS  HA     11 LYS  QG      3.59            #peak   580
 11 LYS  QG     12 LYS  H       4.41            #peak   535
 12 LYS  H      12 LYS  QB      3.09            #peak    69
 12 LYS  H      12 LYS  QG      3.68            #peak    70
 12 LYS  HA     12 LYS  QG      3.59            #peak  1006
 12 LYS  QB     13 TYR  H       3.39            #peak   185
 12 LYS  QG     13 TYR  H       4.10            #peak   392
 13 TYR  QE     34 GLU  QG      5.02            #peak   912
 14 ASP  H      14 ASP  QB      3.53            #peak   137
 14 ASP  QB     15 LEU  H       4.07            #peak     8
 15 LEU  H      15 LEU  QB      3.51            #peak     9
 15 LEU  QB     16 SER  H       4.10            #peak   381
 15 LEU  QB     16 SER  HA      5.08            #peak   971
 15 LEU  QB     42 GLU  QB      4.27            #peak   793
 15 LEU  QB     42 GLU  QG      4.46            #peak   794
 15 LEU  QD1    42 GLU  QB      4.01            #peak  1109
 15 LEU  QD1    42 GLU  QG      4.75            #peak   867
 16 SER  H      16 SER  QB      2.99            #peak   258
 16 SER  QB     17 LYS  H       4.08            #peak   224
 17 LYS  H      17 LYS  QB      3.40            #peak   509
 17 LYS  H      17 LYS  QG      3.69            #peak   227
 17 LYS  HA     17 LYS  QG      3.41            #peak   594
 17 LYS  QB     17 LYS  QD      3.42            #peak   232
 17 LYS  QG     18 TRP  H       5.04            #peak   375
 19 LYS  H      19 LYS  QB      3.41            #peak    65
 19 LYS  H      19 LYS  QG      3.61            #peak    65
 19 LYS  H      19 LYS  QD      4.23            #peak   769
 19 LYS  HA     19 LYS  QG      3.57            #peak   590
 19 LYS  QB     20 TYR  H       3.94            #peak   363
 19 LYS  QB     21 ALA  H       3.45            #peak   240
 19 LYS  QB     21 ALA  QB      3.64            #peak   684
 19 LYS  QB     22 GLU  H       3.29            #peak   274
 19 LYS  QB     22 GLU  QG      3.56            #peak   169
 20 TYR  QE     24 ARG  QD      3.92            #peak    35
 21 ALA  HA     24 ARG  QB      3.42            #peak   600
 22 GLU  H      22 GLU  QG      3.52            #peak   518
 22 GLU  HA     22 GLU  QG      3.38            #peak   473
 22 GLU  HA     25 ASP  QB      3.44            #peak   471
 23 LEU  H      24 ARG  QB      4.94            #peak   516
 23 LEU  QD1    42 GLU  QG      3.94            #peak   527
 23 LEU  QD1    46 ARG  QD      4.19            #peak   886
 23 LEU  QD2    39 CYS  QB      4.86            #peak  1157
 23 LEU  QD2    42 GLU  QB      4.43            #peak   861
 23 LEU  QD2    42 GLU  QG      3.95            #peak   182
 23 LEU  QD2    46 ARG  QD      5.34            #peak   999
 24 ARG  H      24 ARG  QD      4.36            #peak  1046
 24 ARG  H      25 ASP  QB      4.93            #peak   341
 24 ARG  QB     24 ARG  QD      3.12            #peak    44
 24 ARG  QB     25 ASP  H       3.04            #peak   219
 24 ARG  QB     26 THR  H       5.28            #peak   334
 24 ARG  QB     43 PHE  QE      4.59            #peak   738
 24 ARG  QD     25 ASP  H       5.34            #peak   338
 24 ARG  QD     27 ILE  QG2     5.34            #peak    19
 24 ARG  QD     43 PHE  QE      4.25            #peak    39
 25 ASP  H      25 ASP  QB      2.90            #peak   218
 25 ASP  QB     26 THR  H       3.36            #peak   212
 27 ILE  QG2    40 ARG  QD      4.29            #peak   727
 27 ILE  HG12   39 CYS  QB      4.07            #peak   432
 27 ILE  QD1    39 CYS  QB      3.30            #peak  1029
 27 ILE  QD1    40 ARG  QG      4.02            #peak    13
 30 SER  HA     31 CYS  QB      4.42            #peak   706
 31 CYS  H      31 CYS  QB      3.37            #peak   110
 31 CYS  QB     32 ASP  H       3.83            #peak    44
 32 ASP  HA     33 ILE  QG1     4.74            #peak   827
 33 ILE  HA     33 ILE  QG1     3.24            #peak   204
 33 ILE  QG2    33 ILE  QG1     3.02            #peak   829
 33 ILE  QG2    34 GLU  QG      4.70            #peak  1176
 33 ILE  QG1    34 GLU  H       4.06            #peak   417
 34 GLU  H      34 GLU  QG      3.27            #peak   124
 34 GLU  QG     35 LEU  H       4.04            #peak    31
 36 LEU  HA     39 CYS  QB      3.77            #peak   463
 37 ALA  HA     40 ARG  QB      3.57            #peak   944
 37 ALA  HA     40 ARG  QD      4.19            #peak    22
 38 ALA  H      39 CYS  QB      4.84            #peak   439
 38 ALA  H      40 ARG  QB      5.34            #peak   437
 38 ALA  H      41 GLU  QG      5.17            #peak   438
 38 ALA  HA     41 GLU  QG      4.15            #peak   179
 38 ALA  QB     39 CYS  QB      5.34            #peak   693
 38 ALA  QB     41 GLU  QG      5.34            #peak   693
 39 CYS  H      39 CYS  QB      3.20            #peak   174
 39 CYS  H      40 ARG  QB      4.88            #peak   444
 39 CYS  HA     42 GLU  QB      4.17            #peak   240
 39 CYS  HA     42 GLU  QG      5.09            #peak  1142
 39 CYS  QB     40 ARG  H       3.41            #peak   157
 39 CYS  QB     40 ARG  QB      4.56            #peak   954
 40 ARG  H      40 ARG  QB      3.02            #peak   159
 40 ARG  H      40 ARG  QG      3.63            #peak   160
 40 ARG  H      40 ARG  QD      4.30            #peak   857
 40 ARG  QB     40 ARG  QD      2.93            #peak    20
 40 ARG  QB     41 GLU  H       3.32            #peak   170
 40 ARG  QG     41 GLU  H       5.19            #peak   457
 40 ARG  QD     41 GLU  H       5.34            #peak   458
 41 GLU  H      41 GLU  QG      3.45            #peak   168
 41 GLU  H      42 GLU  QG      5.34            #peak  1143
 41 GLU  HA     41 GLU  QG      3.48            #peak   415
 41 GLU  HA     44 HIS  QB      3.69            #peak   420
 42 GLU  H      42 GLU  QB      3.17            #peak   114
 42 GLU  H      42 GLU  QG      4.12            #peak   117
 42 GLU  HA     45 ARG  QB      3.73            #peak   481
 42 GLU  QB     43 PHE  H       3.64            #peak   163
 42 GLU  QB     43 PHE  HA      4.87            #peak   973
 42 GLU  QB     46 ARG  QD      4.08            #peak  1192
 43 PHE  H      44 HIS  QB      4.81            #peak   503
 43 PHE  HA     46 ARG  QB      4.17            #peak   972
 43 PHE  HA     46 ARG  QG      4.60            #peak   870
 43 PHE  HA     46 ARG  QD      3.92            #peak   998
 43 PHE  HB2    47 LEU  QQD     5.44            #peak   975
 43 PHE  HB3    47 LEU  QQD     4.95            #peak   974
 43 PHE  QD     47 LEU  QQD     4.15            #peak  1153
 43 PHE  QE     47 LEU  QQD     4.40            #peak   552
 44 HIS  H      44 HIS  QB      2.92            #peak   263
 44 HIS  H      45 ARG  QB      4.73            #peak   265
 44 HIS  H      47 LEU  QQD     4.89            #peak   471
 44 HIS  HA     47 LEU  QQD     3.88            #peak   550
 44 HIS  QB     45 ARG  H       3.43            #peak   143
 44 HIS  QB     45 ARG  HA      4.68            #peak   875
 44 HIS  QB     46 ARG  H       5.34            #peak   483
 45 ARG  H      45 ARG  QB      2.94            #peak   144
 45 ARG  H      45 ARG  QG      3.57            #peak   145
 45 ARG  H      45 ARG  QD      5.34            #peak   505
 45 ARG  HA     45 ARG  QG      3.14            #peak   424
 45 ARG  HA     45 ARG  QD      4.41            #peak    23
 45 ARG  QB     45 ARG  QD      3.16            #peak    42
 45 ARG  QB     45 ARG  HE      4.45            #peak   300
 45 ARG  QB     46 ARG  H       3.11            #peak   269
 45 ARG  QD     46 ARG  H       5.34            #peak   533
 46 ARG  H      46 ARG  QB      3.29            #peak   270
 46 ARG  H      46 ARG  QG      3.43            #peak   271
 46 ARG  H      46 ARG  QD      4.46            #peak   482
 46 ARG  H      47 LEU  QQD     5.35            #peak   481
 46 ARG  H      49 VAL  QQG     5.44            #peak   481
 46 ARG  HA     46 ARG  QG      3.56            #peak   503
 46 ARG  HA     49 VAL  QQG     4.00            #peak   658
 46 ARG  QB     46 ARG  QD      3.23            #peak    18
 46 ARG  QB     47 LEU  HA      4.85            #peak  1194
 46 ARG  QG     46 ARG  HE      3.47            #peak   291
 46 ARG  QD     47 LEU  H       5.34            #peak   490
 47 LEU  H      47 LEU  QQD     3.65            #peak   204
 47 LEU  HA     47 LEU  QQD     2.86            #peak   613
 47 LEU  QQD    48 LYS  H       4.92            #peak   610
 48 LYS  H      48 LYS  QG      4.13            #peak   808
 48 LYS  HA     48 LYS  QG      3.67            #peak  1007
 48 LYS  QG     49 VAL  H       5.33            #peak   807
 49 VAL  H      49 VAL  QQG     3.10            #peak   657
 49 VAL  HA     49 VAL  QQG     2.86            #peak   655
 49 VAL  QQG    50 TYR  H       3.90            #peak   671
 49 VAL  QQG    50 TYR  QD      4.43            #peak   654
 49 VAL  QQG    51 HIS  H       4.86            #peak   507
 50 TYR  H      50 TYR  QB      3.38            #peak    60
 50 TYR  QB     51 HIS  H       4.18            #peak    25
 51 HIS  H      51 HIS  QB      3.32            #peak    24
#  11 LYS   PHI    -163.2  -126.7
#  11 LYS   PSI      94.4   188.8
  13 TYR   PHI    -167.6  -123.4
  13 TYR   PSI     136.7   172.1
  14 ASP   PHI    -163.1   -96.1
  14 ASP   PSI     109.8   153.6
  17 LYS   PHI    -164.1  -111.3
  17 LYS   PSI     130.5   163.8
  18 TRP   PHI    -168.2   -79.2
  18 TRP   PSI     108.5   168.0
  20 TYR   PHI     -72.4   -52.1
  20 TYR   PSI     -57.2   -30.0
  21 ALA   PHI     -82.9   -44.8
  21 ALA   PSI     -63.0    -9.1
  22 GLU   PHI     -75.9   -55.9
  22 GLU   PSI     -49.1   -29.1
  23 LEU   PHI     -72.3   -52.4
  23 LEU   PSI     -54.6   -27.3
  24 ARG   PHI     -70.0   -50.0
  24 ARG   PSI     -51.2   -29.2
  25 ASP   PHI     -74.7   -54.7
  25 ASP   PSI     -53.6   -29.0
  26 THR   PHI     -73.5   -53.5
  26 THR   PSI     -53.8   -33.8
  27 ILE   PHI    -121.5   -29.1
  27 ILE   PSI     -60.9   -18.1
  31 CYS   PHI    -158.2  -113.2
  31 CYS   PSI     124.6   164.5
  32 ASP   PHI    -174.2   -65.3
  32 ASP   PSI     115.8   161.0
  35 LEU   PHI     -74.3   -54.3
  35 LEU   PSI     -52.1   -32.1
  36 LEU   PHI     -70.4   -50.4
  36 LEU   PSI     -54.7   -34.7
  37 ALA   PHI     -73.2   -53.2
  37 ALA   PSI     -52.5   -31.2
  38 ALA   PHI     -74.6   -54.6
  38 ALA   PSI     -50.8   -30.8
  39 CYS   PHI     -71.7   -50.5
  39 CYS   PSI     -52.3   -32.3
  40 ARG   PHI     -70.0   -50.0
  40 ARG   PSI     -50.9   -30.9
  41 GLU   PHI     -74.8   -54.8
  41 GLU   PSI     -52.0   -30.5
  42 GLU   PHI     -74.5   -54.5
  42 GLU   PSI     -51.2   -30.1
  43 PHE   PHI     -69.5   -49.5
  43 PHE   PSI     -52.9   -32.9
  44 HIS   PHI     -71.8   -51.9
  44 HIS   PSI     -50.0   -29.9
  45 ARG   PHI     -75.6   -55.6
  45 ARG   PSI     -55.0   -20.3
  46 ARG   PHI     -69.5   -49.5
  46 ARG   PSI     -53.7   -33.7
  47 LEU   PHI     -76.4   -51.2
  47 LEU   PSI     -56.4   -21.6
#  50 TYR   PHI    -173.6   -71.9
#  50 TYR   PSI     112.5   153.9
 23 LEU  H     19 LYS  O   2.00
 23 LEU   N    19 LYS  O   3.00
 24 ARG  H     20 TYR  O   2.00
 24 ARG   N    20 TYR  O   3.00
 25 ASP  H     21 ALA  O   2.00
 25 ASP   N    21 ALA  O   3.00
 26 THR  H     22 GLU  O   2.00
 26 THR   N    22 GLU  O   3.00
 27 ILE  H     23 LEU  O   2.00
 27 ILE   N    23 LEU  O   3.00
 28 ASN  H     24 ARG  O   2.00
 28 ASN   N    24 ARG  O   3.00
 29 THR  H     25 ASP  O   2.00
 29 THR   N    25 ASP  O   3.00
 36 LEU  H     32 ASP  O   2.00
 36 LEU   N    32 ASP  O   3.00
 37 ALA  H     33 ILE  O   2.00
 37 ALA   N    33 ILE  O   3.00
 38 ALA  H     34 GLU  O   2.00
 38 ALA   N    34 GLU  O   3.00
 39 CYS  H     35 LEU  O   2.00
 39 CYS   N    35 LEU  O   3.00
 40 ARG  H     36 LEU  O   2.00
 40 ARG   N    36 LEU  O   3.00
 41 GLU  H     37 ALA  O   2.00
 41 GLU   N    37 ALA  O   3.00
 42 GLU  H     38 ALA  O   2.00
 42 GLU   N    38 ALA  O   3.00
 43 PHE  H     39 CYS  O   2.00
 43 PHE   N    39 CYS  O   3.00
 44 HIS  H     40 ARG  O   2.00
 44 HIS   N    40 ARG  O   3.00
 45 ARG  H     41 GLU  O   2.00
 45 ARG   N    41 GLU  O   3.00
 46 ARG  H     42 GLU  O   2.00
 46 ARG   N    42 GLU  O   3.00
 48 LYS  H     44 HIS  O   2.00
 48 LYS   N    44 HIS  O   3.00
 49 VAL  H     45 ARG  O   2.00
 49 VAL   N    45 ARG  O   3.00

assign (resid   19 and name O    ) (resid   23 and name HN   )   1.80   0.30   0.50
assign (resid   19 and name O    ) (resid   23 and name N    )   2.80   0.40   0.50
assign (resid   20 and name O    ) (resid   24 and name HN   )   1.80   0.30   0.50
assign (resid   20 and name O    ) (resid   24 and name N    )   2.80   0.40   0.50
assign (resid   21 and name O    ) (resid   25 and name HN   )   1.80   0.30   0.50
assign (resid   21 and name O    ) (resid   25 and name N    )   2.80   0.40   0.50
assign (resid   22 and name O    ) (resid   26 and name HN   )   1.80   0.30   0.50
assign (resid   22 and name O    ) (resid   26 and name N    )   2.80   0.40   0.50
assign (resid   23 and name O    ) (resid   27 and name HN   )   1.80   0.30   0.50
assign (resid   23 and name O    ) (resid   27 and name N    )   2.80   0.40   0.50
assign (resid   24 and name O    ) (resid   28 and name HN   )   1.80   0.30   0.50
assign (resid   24 and name O    ) (resid   28 and name N    )   2.80   0.40   0.50
assign (resid   25 and name O    ) (resid   29 and name HN   )   1.80   0.30   0.50
assign (resid   25 and name O    ) (resid   29 and name N    )   2.80   0.40   0.50
assign (resid   32 and name O    ) (resid   36 and name HN   )   1.80   0.30   0.50
assign (resid   32 and name O    ) (resid   36 and name N    )   2.80   0.40   0.50
assign (resid   33 and name O    ) (resid   37 and name HN   )   1.80   0.30   0.50
assign (resid   33 and name O    ) (resid   37 and name N    )   2.80   0.40   0.50
assign (resid   34 and name O    ) (resid   38 and name HN   )   1.80   0.30   0.50
assign (resid   34 and name O    ) (resid   38 and name N    )   2.80   0.40   0.50
assign (resid   35 and name O    ) (resid   39 and name HN   )   1.80   0.30   0.50
assign (resid   35 and name O    ) (resid   39 and name N    )   2.80   0.40   0.50
assign (resid   36 and name O    ) (resid   40 and name HN   )   1.80   0.30   0.50
assign (resid   36 and name O    ) (resid   40 and name N    )   2.80   0.40   0.50
assign (resid   37 and name O    ) (resid   41 and name HN   )   1.80   0.30   0.50
assign (resid   37 and name O    ) (resid   41 and name N    )   2.80   0.40   0.50
assign (resid   38 and name O    ) (resid   42 and name HN   )   1.80   0.30   0.50
assign (resid   38 and name O    ) (resid   42 and name N    )   2.80   0.40   0.50
assign (resid   39 and name O    ) (resid   43 and name HN   )   1.80   0.30   0.50
assign (resid   39 and name O    ) (resid   43 and name N    )   2.80   0.40   0.50
assign (resid   40 and name O    ) (resid   44 and name HN   )   1.80   0.30   0.50
assign (resid   40 and name O    ) (resid   44 and name N    )   2.80   0.40   0.50
assign (resid   41 and name O    ) (resid   45 and name HN   )   1.80   0.30   0.50
assign (resid   41 and name O    ) (resid   45 and name N    )   2.80   0.40   0.50
assign (resid   42 and name O    ) (resid   46 and name HN   )   1.80   0.30   0.50
assign (resid   42 and name O    ) (resid   46 and name N    )   2.80   0.40   0.50
assign (resid   44 and name O    ) (resid   48 and name HN   )   1.80   0.30   0.50
assign (resid   44 and name O    ) (resid   48 and name N    )   2.80   0.40   0.50

assign (resid   42 and name OE2  ) (resid   46 and name HE   )   1.80   0.30   0.50  
assign (resid   42 and name OE2  ) (resid   46 and name NE   )   2.80   0.40   0.50   
assign (resid   16 and name O    ) (resid   46 and name HH1* )   1.80   0.30   0.50 
assign (resid   16 and name O    ) (resid   46 and name NH1  )   2.80   0.40   0.50


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   9           H        GLY   9   7.864 -16.326   5.107
    2    HA2  GLY   9           2HA      GLY   9   9.511 -15.203   2.990
    3    HA3  GLY   9           1HA      GLY   9   8.013 -15.955   2.450
    4    H    THR  10           H        THR  10   9.146 -13.065   2.781
    5    HA   THR  10           HA       THR  10   6.607 -11.834   3.259
    6    HB   THR  10           HB       THR  10   7.289 -12.269   5.600
    7    HG1  THR  10           1HG      THR  10   6.197 -10.476   5.697
    8   HG21  THR  10          3HG2      THR  10   9.592 -10.386   5.065
    9   HG22  THR  10          1HG2      THR  10   9.773 -12.140   5.031
   10   HG23  THR  10          2HG2      THR  10   9.283 -11.333   6.521
   11    H    LYS  11           H        LYS  11   6.526  -9.903   2.245
   12    HA   LYS  11           HA       LYS  11   8.912  -8.303   1.838
   13    HB2  LYS  11           2HB      LYS  11   8.940 -10.067   0.014
   14    HB3  LYS  11           1HB      LYS  11   7.454  -9.338  -0.598
   15    HG2  LYS  11           2HG      LYS  11   8.693  -7.121  -0.650
   16    HG3  LYS  11           1HG      LYS  11  10.170  -8.029  -0.327
   17    HD2  LYS  11           2HD      LYS  11   9.725  -9.411  -2.352
   18    HD3  LYS  11           1HD      LYS  11   8.317  -8.407  -2.697
   19    HE2  LYS  11           2HE      LYS  11  11.179  -7.426  -2.501
   20    HE3  LYS  11           1HE      LYS  11  10.264  -7.637  -3.993
   21    HZ1  LYS  11           3HZ      LYS  11  10.199  -5.487  -2.120
   22    HZ2  LYS  11           1HZ      LYS  11   8.649  -6.116  -2.397
   23    HZ3  LYS  11           2HZ      LYS  11   9.583  -5.560  -3.702
   24    H    LYS  12           H        LYS  12   8.049  -6.454   2.583
   25    HA   LYS  12           HA       LYS  12   5.328  -5.681   1.845
   26    HB2  LYS  12           2HB      LYS  12   7.369  -4.307   3.615
   27    HB3  LYS  12           1HB      LYS  12   5.693  -3.806   3.401
   28    HG2  LYS  12           2HG      LYS  12   5.400  -5.104   5.280
   29    HG3  LYS  12           1HG      LYS  12   5.258  -6.378   4.070
   30    HD2  LYS  12           2HD      LYS  12   6.857  -7.331   5.448
   31    HD3  LYS  12           1HD      LYS  12   7.912  -6.453   4.342
   32    HE2  LYS  12           2HE      LYS  12   7.147  -5.775   7.168
   33    HE3  LYS  12           1HE      LYS  12   8.742  -5.771   6.416
   34    HZ1  LYS  12           3HZ      LYS  12   6.766  -3.933   5.319
   35    HZ2  LYS  12           1HZ      LYS  12   8.434  -3.725   5.548
   36    HZ3  LYS  12           2HZ      LYS  12   7.371  -3.565   6.863
   37    H    TYR  13           H        TYR  13   5.694  -2.885   1.870
   38    HA   TYR  13           HA       TYR  13   7.528  -2.271  -0.326
   39    HB2  TYR  13           2HB      TYR  13   4.634  -1.492  -0.607
   40    HB3  TYR  13           1HB      TYR  13   5.894  -1.527  -1.840
   41    HD1  TYR  13           1HD      TYR  13   3.776  -3.667   0.347
   42    HD2  TYR  13           2HD      TYR  13   6.361  -3.508  -3.080
   43    HE1  TYR  13           1HE      TYR  13   3.132  -5.988  -0.246
   44    HE2  TYR  13           2HE      TYR  13   5.716  -5.828  -3.673
   45    HH   TYR  13           HH       TYR  13   3.974  -7.859  -1.517
   46    H    ASP  14           H        ASP  14   8.017  -0.069  -0.505
   47    HA   ASP  14           HA       ASP  14   7.347   1.501   1.886
   48    HB2  ASP  14           2HB      ASP  14   9.714   1.301   1.363
   49    HB3  ASP  14           1HB      ASP  14   9.434   1.909  -0.267
   50    H    LEU  15           H        LEU  15   5.559   2.684   1.686
   51    HA   LEU  15           HA       LEU  15   5.029   4.058  -0.882
   52    HB2  LEU  15           2HB      LEU  15   2.987   3.723   1.301
   53    HB3  LEU  15           1HB      LEU  15   2.737   3.946  -0.429
   54    HG   LEU  15           HG       LEU  15   3.928   1.467   0.854
   55   HD11  LEU  15          1HD1      LEU  15   1.205   1.966  -0.386
   56   HD12  LEU  15          2HD1      LEU  15   1.525   1.720   1.331
   57   HD13  LEU  15          3HD1      LEU  15   1.798   0.407   0.186
   58   HD21  LEU  15          3HD2      LEU  15   3.164   2.139  -2.005
   59   HD22  LEU  15          1HD2      LEU  15   3.597   0.525  -1.447
   60   HD23  LEU  15          2HD2      LEU  15   4.790   1.822  -1.402
   61    H    SER  16           H        SER  16   6.915   5.010   1.083
   62    HA   SER  16           HA       SER  16   6.172   6.836   2.935
   63    HB2  SER  16           2HB      SER  16   8.518   6.365   2.095
   64    HB3  SER  16           1HB      SER  16   8.196   7.510   0.796
   65    HG   SER  16           HG       SER  16   8.577   7.926   3.516
   66    H    LYS  17           H        LYS  17   6.096   7.347  -0.578
   67    HA   LYS  17           HA       LYS  17   4.138   9.504  -0.165
   68    HB2  LYS  17           2HB      LYS  17   6.811   9.745  -1.493
   69    HB3  LYS  17           1HB      LYS  17   5.455  10.666  -2.145
   70    HG2  LYS  17           2HG      LYS  17   5.200  11.933  -0.201
   71    HG3  LYS  17           1HG      LYS  17   5.973  10.717   0.816
   72    HD2  LYS  17           2HD      LYS  17   7.465  12.636   0.520
   73    HD3  LYS  17           1HD      LYS  17   8.145  11.211  -0.266
   74    HE2  LYS  17           2HE      LYS  17   7.546  11.979  -2.429
   75    HE3  LYS  17           1HE      LYS  17   6.435  13.187  -1.780
   76    HZ1  LYS  17           3HZ      LYS  17   8.133  14.592  -1.974
   77    HZ2  LYS  17           1HZ      LYS  17   9.265  13.349  -2.198
   78    HZ3  LYS  17           2HZ      LYS  17   8.815  13.812  -0.627
   79    H    TRP  18           H        TRP  18   2.462   9.323  -1.511
   80    HA   TRP  18           HA       TRP  18   2.801   7.975  -4.103
   81    HB2  TRP  18           2HB      TRP  18   1.132   7.052  -1.811
   82    HB3  TRP  18           1HB      TRP  18   0.413   6.946  -3.416
   83    HD1  TRP  18           HD       TRP  18   3.766   5.978  -1.722
   84    HE1  TRP  18           1HE      TRP  18   4.557   3.749  -2.743
   85    HE3  TRP  18           3HE      TRP  18   0.065   5.216  -5.158
   86    HZ2  TRP  18           2HZ      TRP  18   3.729   1.884  -4.748
   87    HZ3  TRP  18           3HZ      TRP  18   0.090   3.205  -6.606
   88    HH2  TRP  18           HH       TRP  18   1.915   1.538  -6.406
   89    H    LYS  19           H        LYS  19   0.769   8.237  -5.447
   90    HA   LYS  19           HA       LYS  19  -0.336  10.946  -5.001
   91    HB2  LYS  19           2HB      LYS  19   0.094   9.363  -7.545
   92    HB3  LYS  19           1HB      LYS  19  -0.769  10.898  -7.474
   93    HG2  LYS  19           2HG      LYS  19   1.339  11.712  -7.937
   94    HG3  LYS  19           1HG      LYS  19   1.469  11.646  -6.180
   95    HD2  LYS  19           2HD      LYS  19   2.409   9.309  -6.431
   96    HD3  LYS  19           1HD      LYS  19   2.466   9.592  -8.170
   97    HE2  LYS  19           2HE      LYS  19   4.005  10.998  -5.991
   98    HE3  LYS  19           1HE      LYS  19   4.628  10.194  -7.432
   99    HZ1  LYS  19           3HZ      LYS  19   2.934  12.630  -7.483
  100    HZ2  LYS  19           1HZ      LYS  19   3.715  11.903  -8.803
  101    HZ3  LYS  19           2HZ      LYS  19   4.630  12.646  -7.579
  102    H    TYR  20           H        TYR  20  -2.518  11.296  -5.101
  103    HA   TYR  20           HA       TYR  20  -4.285   9.317  -4.290
  104    HB2  TYR  20           2HB      TYR  20  -4.772  11.714  -4.093
  105    HB3  TYR  20           1HB      TYR  20  -4.915  11.835  -5.847
  106    HD1  TYR  20           1HD      TYR  20  -6.804  10.815  -7.039
  107    HD2  TYR  20           2HD      TYR  20  -6.486  10.606  -2.760
  108    HE1  TYR  20           1HE      TYR  20  -9.178  10.112  -6.897
  109    HE2  TYR  20           2HE      TYR  20  -8.860   9.902  -2.619
  110    HH   TYR  20           HH       TYR  20 -10.576   8.715  -5.099
  111    H    ALA  21           H        ALA  21  -3.564  10.460  -7.569
  112    HA   ALA  21           HA       ALA  21  -5.529   8.899  -8.891
  113    HB1  ALA  21           1HB      ALA  21  -2.883   9.850 -10.007
  114    HB2  ALA  21           2HB      ALA  21  -4.326  10.857  -9.890
  115    HB3  ALA  21           3HB      ALA  21  -4.330   9.426 -10.920
  116    H    GLU  22           H        GLU  22  -2.179   8.288  -7.964
  117    HA   GLU  22           HA       GLU  22  -1.934   5.807  -9.360
  118    HB2  GLU  22           2HB      GLU  22  -0.385   7.147  -7.153
  119    HB3  GLU  22           1HB      GLU  22  -0.001   5.504  -7.663
  120    HG2  GLU  22           2HG      GLU  22   1.294   7.399  -8.818
  121    HG3  GLU  22           1HG      GLU  22   0.548   6.197  -9.865
  122    H    LEU  23           H        LEU  23  -2.648   6.656  -5.976
  123    HA   LEU  23           HA       LEU  23  -2.849   4.019  -5.001
  124    HB2  LEU  23           2HB      LEU  23  -4.273   6.513  -4.045
  125    HB3  LEU  23           1HB      LEU  23  -4.100   5.017  -3.130
  126    HG   LEU  23           HG       LEU  23  -1.687   6.475  -4.206
  127   HD11  LEU  23          1HD1      LEU  23  -1.489   7.610  -2.039
  128   HD12  LEU  23          2HD1      LEU  23  -3.010   6.893  -1.509
  129   HD13  LEU  23          3HD1      LEU  23  -2.999   8.065  -2.826
  130   HD21  LEU  23          3HD2      LEU  23  -1.205   4.254  -3.436
  131   HD22  LEU  23          1HD2      LEU  23  -2.207   4.463  -1.999
  132   HD23  LEU  23          2HD2      LEU  23  -0.686   5.340  -2.148
  133    H    ARG  24           H        ARG  24  -5.299   6.228  -6.318
  134    HA   ARG  24           HA       ARG  24  -7.481   4.424  -5.962
  135    HB2  ARG  24           2HB      ARG  24  -7.627   6.944  -6.260
  136    HB3  ARG  24           1HB      ARG  24  -7.318   6.671  -7.975
  137    HG2  ARG  24           2HG      ARG  24  -9.641   6.631  -7.963
  138    HG3  ARG  24           1HG      ARG  24  -9.295   4.918  -7.728
  139    HD2  ARG  24           2HD      ARG  24  -9.567   5.161  -5.310
  140    HD3  ARG  24           1HD      ARG  24  -9.805   6.897  -5.486
  141    HE   ARG  24           HE       ARG  24 -11.681   5.299  -7.005
  142   HH11  ARG  24          1HH2      ARG  24 -10.911   6.779  -3.973
  143   HH12  ARG  24          2HH2      ARG  24 -12.558   6.883  -3.448
  144   HH21  ARG  24          1HH1      ARG  24 -13.843   5.433  -6.324
  145   HH22  ARG  24          2HH1      ARG  24 -14.218   6.121  -4.780
  146    H    ASP  25           H        ASP  25  -5.237   5.093  -8.603
  147    HA   ASP  25           HA       ASP  25  -6.589   3.501 -10.548
  148    HB2  ASP  25           2HB      ASP  25  -3.793   4.612 -10.340
  149    HB3  ASP  25           1HB      ASP  25  -4.305   3.613 -11.696
  150    H    THR  26           H        THR  26  -3.765   2.931  -8.451
  151    HA   THR  26           HA       THR  26  -3.087   0.376  -9.303
  152    HB   THR  26           HB       THR  26  -3.013   1.357  -6.441
  153    HG1  THR  26           1HG      THR  26  -1.768   2.216  -8.674
  154   HG21  THR  26          3HG2      THR  26  -1.391  -0.688  -7.980
  155   HG22  THR  26          1HG2      THR  26  -2.526  -1.021  -6.672
  156   HG23  THR  26          2HG2      THR  26  -1.029  -0.149  -6.341
  157    H    ILE  27           H        ILE  27  -5.615   1.400  -7.062
  158    HA   ILE  27           HA       ILE  27  -6.351  -1.305  -6.358
  159    HB   ILE  27           HB       ILE  27  -7.765   1.329  -5.882
  160   HG12  ILE  27          2HG1      ILE  27  -6.160  -0.377  -3.960
  161   HG13  ILE  27          1HG1      ILE  27  -5.470   0.987  -4.839
  162   HG21  ILE  27          1HG2      ILE  27  -9.410  -0.372  -5.696
  163   HG22  ILE  27          2HG2      ILE  27  -8.859  -0.107  -4.041
  164   HG23  ILE  27          3HG2      ILE  27  -8.276  -1.500  -4.952
  165   HD11  ILE  27          3HD1      ILE  27  -6.358   1.475  -2.478
  166   HD12  ILE  27          1HD1      ILE  27  -7.969   1.270  -3.163
  167   HD13  ILE  27          2HD1      ILE  27  -6.910   2.545  -3.766
  168    H    ASN  28           H        ASN  28  -7.171   0.990  -8.816
  169    HA   ASN  28           HA       ASN  28  -9.543  -0.574  -9.609
  170    HB2  ASN  28           2HB      ASN  28  -8.567   2.189 -10.325
  171    HB3  ASN  28           1HB      ASN  28  -9.858   1.387 -11.215
  172   HD21  ASN  28          1HD2      ASN  28  -8.990   1.981  -7.752
  173   HD22  ASN  28          2HD2      ASN  28 -10.576   2.355  -7.278
  174    H    THR  29           H        THR  29  -6.428  -0.929 -10.071
  175    HA   THR  29           HA       THR  29  -6.753  -1.792 -12.874
  176    HB   THR  29           HB       THR  29  -4.438  -1.010 -13.348
  177    HG1  THR  29           1HG      THR  29  -3.650   0.579 -11.816
  178   HG21  THR  29          3HG2      THR  29  -6.425   1.086 -12.430
  179   HG22  THR  29          1HG2      THR  29  -6.316   0.374 -14.039
  180   HG23  THR  29          2HG2      THR  29  -5.022   1.416 -13.447
  181    H    SER  30           H        SER  30  -4.676  -1.910  -9.981
  182    HA   SER  30           HA       SER  30  -3.661  -4.537 -10.772
  183    HB2  SER  30           2HB      SER  30  -2.328  -2.573  -9.643
  184    HB3  SER  30           1HB      SER  30  -3.020  -3.216  -8.156
  185    HG   SER  30           HG       SER  30  -1.443  -4.580 -10.086
  186    H    CYS  31           H        CYS  31  -3.453  -6.102  -8.781
  187    HA   CYS  31           HA       CYS  31  -5.726  -6.080  -6.987
  188    HB2  CYS  31           2HB      CYS  31  -6.587  -6.991  -9.206
  189    HB3  CYS  31           1HB      CYS  31  -5.516  -8.368  -8.945
  190    HG   CYS  31           HG       CYS  31  -8.181  -8.180  -7.734
  191    H    ASP  32           H        ASP  32  -5.025  -6.870  -5.122
  192    HA   ASP  32           HA       ASP  32  -3.616  -9.310  -4.845
  193    HB2  ASP  32           2HB      ASP  32  -1.870  -7.495  -5.718
  194    HB3  ASP  32           1HB      ASP  32  -1.845  -7.051  -4.014
  195    H    ILE  33           H        ILE  33  -3.211  -9.845  -2.620
  196    HA   ILE  33           HA       ILE  33  -5.051  -8.510  -0.818
  197    HB   ILE  33           HB       ILE  33  -3.178 -10.790  -0.173
  198   HG12  ILE  33          2HG1      ILE  33  -4.394 -11.469  -2.146
  199   HG13  ILE  33          1HG1      ILE  33  -5.163 -12.243  -0.761
  200   HG21  ILE  33          1HG2      ILE  33  -5.077 -11.340   1.400
  201   HG22  ILE  33          2HG2      ILE  33  -5.802  -9.792   0.966
  202   HG23  ILE  33          3HG2      ILE  33  -4.234  -9.837   1.772
  203   HD11  ILE  33          3HD1      ILE  33  -6.725 -10.171  -0.734
  204   HD12  ILE  33          1HD1      ILE  33  -6.982 -11.382  -1.991
  205   HD13  ILE  33          2HD1      ILE  33  -6.131  -9.883  -2.369
  206    H    GLU  34           H        GLU  34  -1.814  -8.164  -1.661
  207    HA   GLU  34           HA       GLU  34  -1.012  -7.144   0.980
  208    HB2  GLU  34           2HB      GLU  34   0.734  -7.342  -1.470
  209    HB3  GLU  34           1HB      GLU  34   1.225  -7.276   0.223
  210    HG2  GLU  34           2HG      GLU  34   0.069  -9.475   0.581
  211    HG3  GLU  34           1HG      GLU  34  -0.223  -9.553  -1.156
  212    H    LEU  35           H        LEU  35  -0.691  -6.099  -2.431
  213    HA   LEU  35           HA       LEU  35  -0.034  -3.444  -1.925
  214    HB2  LEU  35           2HB      LEU  35  -1.420  -4.793  -4.230
  215    HB3  LEU  35           1HB      LEU  35  -1.174  -3.050  -4.227
  216    HG   LEU  35           HG       LEU  35   1.043  -5.086  -3.844
  217   HD11  LEU  35          1HD1      LEU  35   0.495  -3.402  -6.298
  218   HD12  LEU  35          2HD1      LEU  35  -0.097  -5.056  -6.131
  219   HD13  LEU  35          3HD1      LEU  35   1.638  -4.735  -6.132
  220   HD21  LEU  35          3HD2      LEU  35   0.874  -2.103  -3.831
  221   HD22  LEU  35          1HD2      LEU  35   2.259  -2.813  -4.660
  222   HD23  LEU  35          2HD2      LEU  35   1.973  -3.171  -2.958
  223    H    LEU  36           H        LEU  36  -3.276  -4.802  -2.563
  224    HA   LEU  36           HA       LEU  36  -4.732  -2.438  -2.268
  225    HB2  LEU  36           2HB      LEU  36  -5.559  -5.258  -1.534
  226    HB3  LEU  36           1HB      LEU  36  -6.658  -3.897  -1.753
  227    HG   LEU  36           HG       LEU  36  -4.792  -4.994  -3.880
  228   HD11  LEU  36          1HD1      LEU  36  -7.813  -5.109  -3.829
  229   HD12  LEU  36          2HD1      LEU  36  -6.818  -6.408  -3.170
  230   HD13  LEU  36          3HD1      LEU  36  -6.706  -5.993  -4.879
  231   HD21  LEU  36          3HD2      LEU  36  -6.657  -2.648  -3.724
  232   HD22  LEU  36          1HD2      LEU  36  -6.496  -3.495  -5.262
  233   HD23  LEU  36          2HD2      LEU  36  -5.079  -2.772  -4.502
  234    H    ALA  37           H        ALA  37  -3.901  -4.878   0.191
  235    HA   ALA  37           HA       ALA  37  -5.156  -3.616   2.366
  236    HB1  ALA  37           1HB      ALA  37  -3.561  -4.945   3.759
  237    HB2  ALA  37           2HB      ALA  37  -2.723  -5.414   2.280
  238    HB3  ALA  37           3HB      ALA  37  -4.395  -5.909   2.541
  239    H    ALA  38           H        ALA  38  -2.000  -3.153   0.884
  240    HA   ALA  38           HA       ALA  38  -1.004  -1.413   2.944
  241    HB1  ALA  38           1HB      ALA  38   0.919  -1.204   1.624
  242    HB2  ALA  38           2HB      ALA  38   0.034  -1.470   0.121
  243    HB3  ALA  38           3HB      ALA  38   0.333  -2.817   1.219
  244    H    CYS  39           H        CYS  39  -2.433  -0.956  -0.269
  245    HA   CYS  39           HA       CYS  39  -2.165   1.855  -0.377
  246    HB2  CYS  39           2HB      CYS  39  -2.725   0.294  -2.297
  247    HB3  CYS  39           1HB      CYS  39  -4.370   0.240  -1.664
  248    HG   CYS  39           HG       CYS  39  -4.256   2.209  -3.386
  249    H    ARG  40           H        ARG  40  -4.904  -0.200   0.604
  250    HA   ARG  40           HA       ARG  40  -6.735   1.803   1.219
  251    HB2  ARG  40           2HB      ARG  40  -6.314  -0.934   2.424
  252    HB3  ARG  40           1HB      ARG  40  -7.680   0.101   2.843
  253    HG2  ARG  40           2HG      ARG  40  -8.437   0.141   0.544
  254    HG3  ARG  40           1HG      ARG  40  -6.991  -0.713   0.007
  255    HD2  ARG  40           2HD      ARG  40  -8.957  -2.225   0.214
  256    HD3  ARG  40           1HD      ARG  40  -7.636  -2.690   1.281
  257    HE   ARG  40           HE       ARG  40  -9.398  -0.955   2.665
  258   HH11  ARG  40          1HH2      ARG  40  -9.171  -4.145   1.342
  259   HH12  ARG  40          2HH2      ARG  40 -10.271  -4.845   2.481
  260   HH21  ARG  40          1HH1      ARG  40 -10.842  -1.867   4.163
  261   HH22  ARG  40          2HH1      ARG  40 -11.217  -3.555   4.079
  262    H    GLU  41           H        GLU  41  -4.162   0.410   3.219
  263    HA   GLU  41           HA       GLU  41  -4.785   1.594   5.663
  264    HB2  GLU  41           2HB      GLU  41  -2.181   0.773   4.395
  265    HB3  GLU  41           1HB      GLU  41  -2.214   1.521   5.992
  266    HG2  GLU  41           2HG      GLU  41  -3.984  -0.833   5.337
  267    HG3  GLU  41           1HG      GLU  41  -2.321  -1.065   5.872
  268    H    GLU  42           H        GLU  42  -2.627   2.856   3.107
  269    HA   GLU  42           HA       GLU  42  -2.271   5.372   4.444
  270    HB2  GLU  42           2HB      GLU  42  -1.213   6.054   2.270
  271    HB3  GLU  42           1HB      GLU  42  -0.516   4.601   2.987
  272    HG2  GLU  42           2HG      GLU  42  -1.879   3.193   1.511
  273    HG3  GLU  42           1HG      GLU  42  -2.629   4.627   0.813
  274    H    PHE  43           H        PHE  43  -4.409   4.135   1.942
  275    HA   PHE  43           HA       PHE  43  -5.409   6.552   0.941
  276    HB2  PHE  43           2HB      PHE  43  -5.848   4.157   0.115
  277    HB3  PHE  43           1HB      PHE  43  -7.112   4.097   1.343
  278    HD1  PHE  43           1HD      PHE  43  -5.968   5.820  -1.731
  279    HD2  PHE  43           2HD      PHE  43  -9.158   5.347   1.108
  280    HE1  PHE  43           1HE      PHE  43  -7.496   7.060  -3.241
  281    HE2  PHE  43           2HE      PHE  43 -10.685   6.588  -0.403
  282    HZ   PHE  43           HZ       PHE  43  -9.853   7.445  -2.576
  283    H    HIS  44           H        HIS  44  -6.144   4.782   3.878
  284    HA   HIS  44           HA       HIS  44  -8.530   6.111   4.593
  285    HB2  HIS  44           2HB      HIS  44  -6.396   4.702   6.196
  286    HB3  HIS  44           1HB      HIS  44  -7.808   5.432   6.963
  287    HD2  HIS  44           2HD      HIS  44  -8.532   3.787   3.527
  288    HE1  HIS  44           1HE      HIS  44  -9.867   1.097   6.494
  289    HE2  HIS  44           2HE      HIS  44  -9.871   1.597   4.004
  290    H    ARG  45           H        ARG  45  -5.135   6.933   5.008
  291    HA   ARG  45           HA       ARG  45  -5.547   9.098   6.821
  292    HB2  ARG  45           2HB      ARG  45  -3.237   8.810   4.899
  293    HB3  ARG  45           1HB      ARG  45  -3.252   9.615   6.468
  294    HG2  ARG  45           2HG      ARG  45  -3.737   7.402   7.539
  295    HG3  ARG  45           1HG      ARG  45  -3.541   6.642   5.959
  296    HD2  ARG  45           2HD      ARG  45  -1.241   7.725   5.859
  297    HD3  ARG  45           1HD      ARG  45  -1.457   8.144   7.556
  298    HE   ARG  45           HE       ARG  45  -1.966   5.440   7.431
  299   HH11  ARG  45          1HH2      ARG  45   0.611   7.565   6.526
  300   HH12  ARG  45          2HH2      ARG  45   1.856   6.389   6.783
  301   HH21  ARG  45          1HH1      ARG  45  -0.339   3.892   7.768
  302   HH22  ARG  45          2HH1      ARG  45   1.319   4.308   7.485
  303    H    ARG  46           H        ARG  46  -5.656   8.758   3.348
  304    HA   ARG  46           HA       ARG  46  -5.421  11.493   2.651
  305    HB2  ARG  46           2HB      ARG  46  -7.015   9.410   1.149
  306    HB3  ARG  46           1HB      ARG  46  -6.240  10.852   0.495
  307    HG2  ARG  46           2HG      ARG  46  -4.717   8.595   1.828
  308    HG3  ARG  46           1HG      ARG  46  -4.966   8.707   0.087
  309    HD2  ARG  46           2HD      ARG  46  -3.950  11.055   0.250
  310    HD3  ARG  46           1HD      ARG  46  -3.437  10.603   1.873
  311    HE   ARG  46           HE       ARG  46  -2.469   8.558   0.418
  312   HH11  ARG  46          1HH2      ARG  46  -2.425  11.987  -0.045
  313   HH12  ARG  46          2HH2      ARG  46  -0.915  11.992  -0.893
  314   HH21  ARG  46          1HH1      ARG  46  -0.488   8.557  -0.693
  315   HH22  ARG  46          2HH1      ARG  46   0.182  10.050  -1.260
  316    H    LEU  47           H        LEU  47  -8.130   9.499   3.673
  317    HA   LEU  47           HA       LEU  47 -10.240  11.209   2.959
  318    HB2  LEU  47           2HB      LEU  47 -10.198   9.506   5.449
  319    HB3  LEU  47           1HB      LEU  47 -11.586   9.945   4.454
  320    HG   LEU  47           HG       LEU  47  -9.292   8.128   3.664
  321   HD11  LEU  47          1HD1      LEU  47 -11.094   6.444   3.476
  322   HD12  LEU  47          2HD1      LEU  47 -12.266   7.645   4.022
  323   HD13  LEU  47          3HD1      LEU  47 -10.995   7.094   5.113
  324   HD21  LEU  47          3HD2      LEU  47  -9.834   9.303   1.679
  325   HD22  LEU  47          1HD2      LEU  47 -11.551   9.360   2.079
  326   HD23  LEU  47          2HD2      LEU  47 -10.810   7.838   1.584
  327    H    LYS  48           H        LYS  48  -8.353  11.008   5.966
  328    HA   LYS  48           HA       LYS  48  -9.700  13.303   7.110
  329    HB2  LYS  48           2HB      LYS  48  -8.684  11.260   8.358
  330    HB3  LYS  48           1HB      LYS  48  -7.148  12.103   8.161
  331    HG2  LYS  48           2HG      LYS  48  -7.824  12.989  10.194
  332    HG3  LYS  48           1HG      LYS  48  -8.549  14.165   9.099
  333    HD2  LYS  48           2HD      LYS  48 -10.660  12.772   9.141
  334    HD3  LYS  48           1HD      LYS  48  -9.918  11.805  10.416
  335    HE2  LYS  48           2HE      LYS  48  -9.606  13.907  11.748
  336    HE3  LYS  48           1HE      LYS  48 -10.512  14.776  10.509
  337    HZ1  LYS  48           3HZ      LYS  48 -11.616  12.374  11.830
  338    HZ2  LYS  48           1HZ      LYS  48 -12.442  13.590  10.984
  339    HZ3  LYS  48           2HZ      LYS  48 -11.788  13.918  12.517
  340    H    VAL  49           H        VAL  49  -6.425  12.571   5.918
  341    HA   VAL  49           HA       VAL  49  -5.702  15.403   6.043
  342    HB   VAL  49           HB       VAL  49  -4.120  12.940   5.269
  343   HG11  VAL  49          1HG1      VAL  49  -3.394  15.872   5.403
  344   HG12  VAL  49          2HG1      VAL  49  -3.164  14.756   4.057
  345   HG13  VAL  49          3HG1      VAL  49  -2.180  14.598   5.513
  346   HG21  VAL  49          3HG2      VAL  49  -4.729  13.162   7.678
  347   HG22  VAL  49          1HG2      VAL  49  -3.979  14.758   7.697
  348   HG23  VAL  49          2HG2      VAL  49  -2.994  13.323   7.411
  349    H    TYR  50           H        TYR  50  -5.675  16.729   4.332
  350    HA   TYR  50           HA       TYR  50  -5.646  15.622   1.614
  351    HB2  TYR  50           2HB      TYR  50  -7.550  17.097   0.965
  352    HB3  TYR  50           1HB      TYR  50  -8.017  15.818   2.086
  353    HD1  TYR  50           2HD      TYR  50  -8.275  16.340   4.535
  354    HD2  TYR  50           1HD      TYR  50  -7.719  19.402   1.573
  355    HE1  TYR  50           2HE      TYR  50  -9.100  18.042   6.139
  356    HE2  TYR  50           1HE      TYR  50  -8.543  21.103   3.177
  357    HH   TYR  50           HH       TYR  50  -9.534  21.429   5.162
  358    H    HIS  51           H        HIS  51  -4.146  16.679   0.505
  359    HA   HIS  51           HA       HIS  51  -2.762  18.934   1.419
  360    HB2  HIS  51           2HB      HIS  51  -3.043  18.204  -1.494
  361    HB3  HIS  51           1HB      HIS  51  -1.665  18.947  -0.683
  362    HD2  HIS  51           2HD      HIS  51  -3.257  15.383  -1.134
  363    HE1  HIS  51           1HE      HIS  51   0.392  14.938   0.941
  364    HE2  HIS  51           2HE      HIS  51  -1.507  13.690  -0.192
  Start of MODEL    2
    1    H1   GLY   9           H        GLY   9   3.530 -10.988   8.789
    2    HA2  GLY   9           2HA      GLY   9   3.117 -10.474   6.549
    3    HA3  GLY   9           1HA      GLY   9   3.991  -8.960   6.756
    4    H    THR  10           H        THR  10   4.628 -10.059   4.514
    5    HA   THR  10           HA       THR  10   7.314 -11.168   4.950
    6    HB   THR  10           HB       THR  10   6.873 -12.782   3.035
    7    HG1  THR  10           1HG      THR  10   4.221 -12.878   3.652
    8   HG21  THR  10          3HG2      THR  10   7.028 -13.500   5.389
    9   HG22  THR  10          1HG2      THR  10   5.822 -14.445   4.519
   10   HG23  THR  10          2HG2      THR  10   5.312 -13.155   5.608
   11    H    LYS  11           H        LYS  11   8.377  -9.406   4.182
   12    HA   LYS  11           HA       LYS  11   9.182  -7.861   2.686
   13    HB2  LYS  11           2HB      LYS  11   9.532 -10.053   1.431
   14    HB3  LYS  11           1HB      LYS  11   8.064  -9.660   0.536
   15    HG2  LYS  11           2HG      LYS  11   9.128  -7.423  -0.021
   16    HG3  LYS  11           1HG      LYS  11  10.630  -8.059   0.651
   17    HD2  LYS  11           2HD      LYS  11  10.666  -9.858  -0.972
   18    HD3  LYS  11           1HD      LYS  11   9.071  -9.404  -1.572
   19    HE2  LYS  11           2HE      LYS  11   9.895  -7.344  -2.473
   20    HE3  LYS  11           1HE      LYS  11  11.434  -7.516  -1.630
   21    HZ1  LYS  11           3HZ      LYS  11  11.336  -8.142  -4.087
   22    HZ2  LYS  11           1HZ      LYS  11  10.527  -9.541  -3.575
   23    HZ3  LYS  11           2HZ      LYS  11  12.104  -9.224  -3.025
   24    H    LYS  12           H        LYS  12   7.944  -6.070   3.011
   25    HA   LYS  12           HA       LYS  12   5.401  -5.843   1.527
   26    HB2  LYS  12           2HB      LYS  12   5.117  -3.783   3.013
   27    HB3  LYS  12           1HB      LYS  12   5.048  -5.350   3.822
   28    HG2  LYS  12           2HG      LYS  12   7.736  -4.065   3.582
   29    HG3  LYS  12           1HG      LYS  12   6.603  -3.344   4.723
   30    HD2  LYS  12           2HD      LYS  12   6.992  -6.325   4.740
   31    HD3  LYS  12           1HD      LYS  12   8.196  -5.293   5.510
   32    HE2  LYS  12           2HE      LYS  12   6.635  -4.424   7.059
   33    HE3  LYS  12           1HE      LYS  12   5.256  -4.970   6.106
   34    HZ1  LYS  12           3HZ      LYS  12   5.303  -6.936   7.100
   35    HZ2  LYS  12           1HZ      LYS  12   6.438  -6.304   8.189
   36    HZ3  LYS  12           2HZ      LYS  12   6.965  -7.136   6.805
   37    H    TYR  13           H        TYR  13   5.165  -3.138   1.323
   38    HA   TYR  13           HA       TYR  13   7.469  -2.337  -0.363
   39    HB2  TYR  13           2HB      TYR  13   4.626  -1.514  -0.922
   40    HB3  TYR  13           1HB      TYR  13   6.018  -1.475  -2.004
   41    HD1  TYR  13           2HD      TYR  13   7.158  -3.783  -2.501
   42    HD2  TYR  13           1HD      TYR  13   3.156  -3.339  -1.005
   43    HE1  TYR  13           2HE      TYR  13   6.604  -6.064  -3.305
   44    HE2  TYR  13           1HE      TYR  13   2.602  -5.619  -1.808
   45    HH   TYR  13           HH       TYR  13   4.253  -7.846  -2.296
   46    H    ASP  14           H        ASP  14   7.935  -0.100  -0.447
   47    HA   ASP  14           HA       ASP  14   7.096   1.347   1.969
   48    HB2  ASP  14           2HB      ASP  14   9.316   1.872  -0.022
   49    HB3  ASP  14           1HB      ASP  14   8.981   2.866   1.394
   50    H    LEU  15           H        LEU  15   5.313   2.536   1.710
   51    HA   LEU  15           HA       LEU  15   4.875   3.947  -0.845
   52    HB2  LEU  15           2HB      LEU  15   2.841   3.750   1.361
   53    HB3  LEU  15           1HB      LEU  15   2.585   3.948  -0.371
   54    HG   LEU  15           HG       LEU  15   3.641   1.448   0.987
   55   HD11  LEU  15          1HD1      LEU  15   0.968   2.214  -0.202
   56   HD12  LEU  15          2HD1      LEU  15   1.304   1.597   1.417
   57   HD13  LEU  15          3HD1      LEU  15   1.451   0.531   0.019
   58   HD21  LEU  15          3HD2      LEU  15   3.342   0.470  -1.313
   59   HD22  LEU  15          1HD2      LEU  15   4.617   1.685  -1.229
   60   HD23  LEU  15          2HD2      LEU  15   3.046   2.100  -1.916
   61    H    SER  16           H        SER  16   6.819   4.856   1.091
   62    HA   SER  16           HA       SER  16   6.168   6.754   2.905
   63    HB2  SER  16           2HB      SER  16   8.244   7.119   0.734
   64    HB3  SER  16           1HB      SER  16   8.197   7.968   2.276
   65    HG   SER  16           HG       SER  16   8.128   5.163   2.237
   66    H    LYS  17           H        LYS  17   6.022   7.142  -0.612
   67    HA   LYS  17           HA       LYS  17   4.181   9.398  -0.250
   68    HB2  LYS  17           2HB      LYS  17   6.789   9.510  -1.765
   69    HB3  LYS  17           1HB      LYS  17   5.456  10.606  -2.123
   70    HG2  LYS  17           2HG      LYS  17   6.658  10.266   0.641
   71    HG3  LYS  17           1HG      LYS  17   7.142  11.527  -0.487
   72    HD2  LYS  17           2HD      LYS  17   4.501  11.962  -0.566
   73    HD3  LYS  17           1HD      LYS  17   4.580  11.222   1.033
   74    HE2  LYS  17           2HE      LYS  17   6.235  13.594   0.117
   75    HE3  LYS  17           1HE      LYS  17   4.822  13.679   1.168
   76    HZ1  LYS  17           3HZ      LYS  17   7.521  12.859   1.772
   77    HZ2  LYS  17           1HZ      LYS  17   6.332  11.817   2.388
   78    HZ3  LYS  17           2HZ      LYS  17   6.312  13.466   2.800
   79    H    TRP  18           H        TRP  18   2.506   9.257  -1.602
   80    HA   TRP  18           HA       TRP  18   2.811   7.863  -4.171
   81    HB2  TRP  18           2HB      TRP  18   1.123   6.992  -1.869
   82    HB3  TRP  18           1HB      TRP  18   0.425   6.857  -3.481
   83    HD1  TRP  18           HD       TRP  18   3.701   5.869  -1.669
   84    HE1  TRP  18           1HE      TRP  18   4.520   3.636  -2.660
   85    HE3  TRP  18           3HE      TRP  18   0.158   5.155  -5.276
   86    HZ2  TRP  18           2HZ      TRP  18   3.768   1.787  -4.709
   87    HZ3  TRP  18           3HZ      TRP  18   0.232   3.151  -6.731
   88    HH2  TRP  18           HH       TRP  18   2.030   1.466  -6.452
   89    H    LYS  19           H        LYS  19   0.774   8.138  -5.511
   90    HA   LYS  19           HA       LYS  19  -0.203  10.901  -5.165
   91    HB2  LYS  19           2HB      LYS  19  -0.538   9.268  -7.666
   92    HB3  LYS  19           1HB      LYS  19  -0.457  11.019  -7.489
   93    HG2  LYS  19           2HG      LYS  19   1.840   9.077  -7.077
   94    HG3  LYS  19           1HG      LYS  19   1.635  10.159  -8.453
   95    HD2  LYS  19           2HD      LYS  19   2.041  10.990  -5.562
   96    HD3  LYS  19           1HD      LYS  19   3.208  11.149  -6.871
   97    HE2  LYS  19           2HE      LYS  19   1.265  12.502  -8.040
   98    HE3  LYS  19           1HE      LYS  19   0.690  12.707  -6.386
   99    HZ1  LYS  19           3HZ      LYS  19   3.497  13.257  -7.128
  100    HZ2  LYS  19           1HZ      LYS  19   2.640  13.791  -5.766
  101    HZ3  LYS  19           2HZ      LYS  19   2.288  14.440  -7.296
  102    H    TYR  20           H        TYR  20  -2.350  11.375  -5.058
  103    HA   TYR  20           HA       TYR  20  -4.161   9.556  -4.009
  104    HB2  TYR  20           2HB      TYR  20  -4.422  12.036  -3.976
  105    HB3  TYR  20           1HB      TYR  20  -4.854  11.978  -5.685
  106    HD1  TYR  20           2HD      TYR  20  -6.945  10.901  -6.427
  107    HD2  TYR  20           1HD      TYR  20  -5.939  11.227  -2.263
  108    HE1  TYR  20           2HE      TYR  20  -9.286  10.354  -5.819
  109    HE2  TYR  20           1HE      TYR  20  -8.281  10.680  -1.655
  110    HH   TYR  20           HH       TYR  20 -10.507   9.415  -3.877
  111    H    ALA  21           H        ALA  21  -3.371  10.250  -7.349
  112    HA   ALA  21           HA       ALA  21  -5.606   8.766  -8.428
  113    HB1  ALA  21           1HB      ALA  21  -4.298   9.051 -10.592
  114    HB2  ALA  21           2HB      ALA  21  -3.128   9.978  -9.654
  115    HB3  ALA  21           3HB      ALA  21  -4.792  10.543  -9.789
  116    H    GLU  22           H        GLU  22  -2.103   8.248  -8.086
  117    HA   GLU  22           HA       GLU  22  -1.933   5.751  -9.333
  118    HB2  GLU  22           2HB      GLU  22  -0.347   6.999  -7.088
  119    HB3  GLU  22           1HB      GLU  22   0.054   5.418  -7.756
  120    HG2  GLU  22           2HG      GLU  22  -0.291   7.849  -9.514
  121    HG3  GLU  22           1HG      GLU  22   1.260   7.439  -8.784
  122    H    LEU  23           H        LEU  23  -2.617   6.562  -5.941
  123    HA   LEU  23           HA       LEU  23  -2.754   3.938  -4.946
  124    HB2  LEU  23           2HB      LEU  23  -4.264   6.402  -4.045
  125    HB3  LEU  23           1HB      LEU  23  -4.081   4.920  -3.108
  126    HG   LEU  23           HG       LEU  23  -1.705   6.471  -4.147
  127   HD11  LEU  23          1HD1      LEU  23  -1.553   7.524  -1.933
  128   HD12  LEU  23          2HD1      LEU  23  -3.044   6.722  -1.436
  129   HD13  LEU  23          3HD1      LEU  23  -3.081   7.947  -2.705
  130   HD21  LEU  23          3HD2      LEU  23  -1.059   4.287  -3.472
  131   HD22  LEU  23          1HD2      LEU  23  -2.156   4.298  -2.092
  132   HD23  LEU  23          2HD2      LEU  23  -0.702   5.295  -2.071
  133    H    ARG  24           H        ARG  24  -5.346   6.069  -6.153
  134    HA   ARG  24           HA       ARG  24  -7.395   4.100  -5.887
  135    HB2  ARG  24           2HB      ARG  24  -7.716   6.620  -6.012
  136    HB3  ARG  24           1HB      ARG  24  -7.425   6.481  -7.745
  137    HG2  ARG  24           2HG      ARG  24  -9.733   6.268  -7.717
  138    HG3  ARG  24           1HG      ARG  24  -9.273   4.574  -7.564
  139    HD2  ARG  24           2HD      ARG  24  -9.318   5.018  -5.005
  140    HD3  ARG  24           1HD      ARG  24 -10.232   6.464  -5.419
  141    HE   ARG  24           HE       ARG  24 -11.441   4.323  -6.745
  142   HH11  ARG  24          1HH2      ARG  24 -10.765   5.381  -3.522
  143   HH12  ARG  24          2HH2      ARG  24 -12.156   4.615  -2.829
  144   HH21  ARG  24          1HH1      ARG  24 -13.267   3.315  -5.845
  145   HH22  ARG  24          2HH1      ARG  24 -13.572   3.446  -4.146
  146    H    ASP  25           H        ASP  25  -5.118   4.953  -8.401
  147    HA   ASP  25           HA       ASP  25  -6.421   3.532 -10.515
  148    HB2  ASP  25           2HB      ASP  25  -4.756   5.351 -10.877
  149    HB3  ASP  25           1HB      ASP  25  -3.499   4.277 -10.263
  150    H    THR  26           H        THR  26  -3.622   2.783  -8.434
  151    HA   THR  26           HA       THR  26  -3.001   0.268  -9.436
  152    HB   THR  26           HB       THR  26  -2.900   0.973  -6.502
  153    HG1  THR  26           1HG      THR  26  -1.655   2.540  -7.078
  154   HG21  THR  26          3HG2      THR  26  -0.938  -0.465  -6.522
  155   HG22  THR  26          1HG2      THR  26  -1.060  -0.660  -8.271
  156   HG23  THR  26          2HG2      THR  26  -2.300  -1.343  -7.219
  157    H    ILE  27           H        ILE  27  -5.529   1.231  -7.182
  158    HA   ILE  27           HA       ILE  27  -6.291  -1.468  -6.520
  159    HB   ILE  27           HB       ILE  27  -7.751   1.158  -6.130
  160   HG12  ILE  27          2HG1      ILE  27  -6.251  -0.496  -4.088
  161   HG13  ILE  27          1HG1      ILE  27  -5.475   0.800  -4.998
  162   HG21  ILE  27          1HG2      ILE  27  -9.384  -0.557  -5.984
  163   HG22  ILE  27          2HG2      ILE  27  -8.897  -0.270  -4.314
  164   HG23  ILE  27          3HG2      ILE  27  -8.268  -1.667  -5.189
  165   HD11  ILE  27          3HD1      ILE  27  -6.462   1.433  -2.710
  166   HD12  ILE  27          1HD1      ILE  27  -8.042   1.244  -3.468
  167   HD13  ILE  27          2HD1      ILE  27  -6.911   2.454  -4.077
  168    H    ASN  28           H        ASN  28  -7.344   0.998  -8.810
  169    HA   ASN  28           HA       ASN  28  -9.549  -0.676  -9.752
  170    HB2  ASN  28           2HB      ASN  28  -8.596   2.096 -10.481
  171    HB3  ASN  28           1HB      ASN  28  -9.903   1.274 -11.332
  172   HD21  ASN  28          1HD2      ASN  28  -9.012   1.681  -7.848
  173   HD22  ASN  28          2HD2      ASN  28 -10.569   2.155  -7.365
  174    H    THR  29           H        THR  29  -6.666  -1.436 -10.083
  175    HA   THR  29           HA       THR  29  -6.847  -2.149 -12.901
  176    HB   THR  29           HB       THR  29  -4.524  -1.350 -13.359
  177    HG1  THR  29           1HG      THR  29  -4.325  -1.099 -10.878
  178   HG21  THR  29          3HG2      THR  29  -6.303   0.935 -12.501
  179   HG22  THR  29          1HG2      THR  29  -6.666  -0.060 -13.911
  180   HG23  THR  29          2HG2      THR  29  -5.177   0.883 -13.856
  181    H    SER  30           H        SER  30  -4.569  -2.114 -10.148
  182    HA   SER  30           HA       SER  30  -3.607  -4.769 -10.834
  183    HB2  SER  30           2HB      SER  30  -2.274  -2.764  -9.792
  184    HB3  SER  30           1HB      SER  30  -2.933  -3.361  -8.270
  185    HG   SER  30           HG       SER  30  -1.111  -4.521 -10.035
  186    H    CYS  31           H        CYS  31  -3.313  -6.246  -8.766
  187    HA   CYS  31           HA       CYS  31  -5.563  -6.224  -6.948
  188    HB2  CYS  31           2HB      CYS  31  -6.582  -8.268  -7.669
  189    HB3  CYS  31           1HB      CYS  31  -6.466  -7.227  -9.088
  190    HG   CYS  31           HG       CYS  31  -5.448  -9.860  -9.251
  191    H    ASP  32           H        ASP  32  -4.818  -6.933  -5.066
  192    HA   ASP  32           HA       ASP  32  -3.322  -9.319  -4.738
  193    HB2  ASP  32           2HB      ASP  32  -1.656  -7.462  -5.676
  194    HB3  ASP  32           1HB      ASP  32  -1.630  -6.973  -3.986
  195    H    ILE  33           H        ILE  33  -3.015  -9.851  -2.535
  196    HA   ILE  33           HA       ILE  33  -4.846  -8.512  -0.750
  197    HB   ILE  33           HB       ILE  33  -2.907 -10.775  -0.205
  198   HG12  ILE  33          2HG1      ILE  33  -5.876 -10.920  -0.791
  199   HG13  ILE  33          1HG1      ILE  33  -4.643 -11.144  -2.034
  200   HG21  ILE  33          1HG2      ILE  33  -4.708 -11.212   1.605
  201   HG22  ILE  33          2HG2      ILE  33  -5.200  -9.543   1.326
  202   HG23  ILE  33          3HG2      ILE  33  -3.568  -9.900   1.890
  203   HD11  ILE  33          3HD1      ILE  33  -3.650 -12.977  -0.663
  204   HD12  ILE  33          1HD1      ILE  33  -5.306 -13.324  -1.160
  205   HD13  ILE  33          2HD1      ILE  33  -4.972 -12.794   0.489
  206    H    GLU  34           H        GLU  34  -1.678  -7.967  -1.647
  207    HA   GLU  34           HA       GLU  34  -0.897  -6.872   0.978
  208    HB2  GLU  34           2HB      GLU  34   0.829  -7.115  -1.487
  209    HB3  GLU  34           1HB      GLU  34   1.348  -6.882   0.182
  210    HG2  GLU  34           2HG      GLU  34  -0.031  -9.340  -0.934
  211    HG3  GLU  34           1HG      GLU  34   1.663  -9.223  -0.463
  212    H    LEU  35           H        LEU  35  -0.592  -5.927  -2.461
  213    HA   LEU  35           HA       LEU  35  -0.079  -3.227  -2.040
  214    HB2  LEU  35           2HB      LEU  35  -1.416  -4.681  -4.318
  215    HB3  LEU  35           1HB      LEU  35  -1.123  -2.945  -4.365
  216    HG   LEU  35           HG       LEU  35   1.032  -5.020  -3.864
  217   HD11  LEU  35          1HD1      LEU  35   1.706  -4.696  -6.163
  218   HD12  LEU  35          2HD1      LEU  35   0.485  -3.445  -6.395
  219   HD13  LEU  35          3HD1      LEU  35  -0.006  -5.123  -6.159
  220   HD21  LEU  35          3HD2      LEU  35   2.340  -2.833  -4.724
  221   HD22  LEU  35          1HD2      LEU  35   1.959  -3.077  -3.020
  222   HD23  LEU  35          2HD2      LEU  35   0.941  -2.031  -4.011
  223    H    LEU  36           H        LEU  36  -3.234  -4.774  -2.680
  224    HA   LEU  36           HA       LEU  36  -4.810  -2.474  -2.478
  225    HB2  LEU  36           2HB      LEU  36  -5.519  -5.307  -1.671
  226    HB3  LEU  36           1HB      LEU  36  -6.672  -4.005  -1.967
  227    HG   LEU  36           HG       LEU  36  -4.711  -5.112  -4.001
  228   HD11  LEU  36          1HD1      LEU  36  -7.672  -5.506  -3.536
  229   HD12  LEU  36          2HD1      LEU  36  -6.421  -6.739  -3.702
  230   HD13  LEU  36          3HD1      LEU  36  -6.929  -5.802  -5.107
  231   HD21  LEU  36          3HD2      LEU  36  -6.416  -3.707  -5.482
  232   HD22  LEU  36          1HD2      LEU  36  -5.034  -2.924  -4.716
  233   HD23  LEU  36          2HD2      LEU  36  -6.633  -2.808  -3.981
  234    H    ALA  37           H        ALA  37  -3.942  -4.831   0.049
  235    HA   ALA  37           HA       ALA  37  -5.255  -3.509   2.168
  236    HB1  ALA  37           1HB      ALA  37  -4.584  -5.768   2.521
  237    HB2  ALA  37           2HB      ALA  37  -3.590  -4.796   3.604
  238    HB3  ALA  37           3HB      ALA  37  -2.910  -5.411   2.097
  239    H    ALA  38           H        ALA  38  -2.062  -3.137   0.738
  240    HA   ALA  38           HA       ALA  38  -1.085  -1.348   2.766
  241    HB1  ALA  38           1HB      ALA  38   0.278  -2.825   1.131
  242    HB2  ALA  38           2HB      ALA  38   0.869  -1.199   1.476
  243    HB3  ALA  38           3HB      ALA  38   0.013  -1.525  -0.031
  244    H    CYS  39           H        CYS  39  -2.778  -1.030  -0.282
  245    HA   CYS  39           HA       CYS  39  -2.336   1.776  -0.607
  246    HB2  CYS  39           2HB      CYS  39  -3.059   0.054  -2.383
  247    HB3  CYS  39           1HB      CYS  39  -4.684   0.263  -1.731
  248    HG   CYS  39           HG       CYS  39  -3.559   2.980  -2.278
  249    H    ARG  40           H        ARG  40  -5.156  -0.113   0.496
  250    HA   ARG  40           HA       ARG  40  -6.854   1.999   1.108
  251    HB2  ARG  40           2HB      ARG  40  -6.576  -0.818   2.020
  252    HB3  ARG  40           1HB      ARG  40  -7.551   0.244   3.036
  253    HG2  ARG  40           2HG      ARG  40  -8.987  -0.822   1.379
  254    HG3  ARG  40           1HG      ARG  40  -8.871   0.900   1.018
  255    HD2  ARG  40           2HD      ARG  40  -7.072   0.391  -0.635
  256    HD3  ARG  40           1HD      ARG  40  -7.307  -1.325  -0.321
  257    HE   ARG  40           HE       ARG  40  -9.053   0.408  -1.860
  258   HH11  ARG  40          1HH2      ARG  40  -8.683  -2.523  -0.059
  259   HH12  ARG  40          2HH2      ARG  40 -10.005  -3.329  -0.837
  260   HH21  ARG  40          1HH1      ARG  40 -10.787  -0.643  -2.885
  261   HH22  ARG  40          2HH1      ARG  40 -11.195  -2.265  -2.436
  262    H    GLU  41           H        GLU  41  -4.169   0.673   2.961
  263    HA   GLU  41           HA       GLU  41  -4.645   1.841   5.445
  264    HB2  GLU  41           2HB      GLU  41  -2.119   1.128   3.973
  265    HB3  GLU  41           1HB      GLU  41  -2.053   1.893   5.559
  266    HG2  GLU  41           2HG      GLU  41  -3.755  -0.549   5.072
  267    HG3  GLU  41           1HG      GLU  41  -2.048  -0.689   5.485
  268    H    GLU  42           H        GLU  42  -2.792   3.183   2.702
  269    HA   GLU  42           HA       GLU  42  -2.414   5.722   3.986
  270    HB2  GLU  42           2HB      GLU  42  -2.209   5.386   1.015
  271    HB3  GLU  42           1HB      GLU  42  -1.188   6.317   2.110
  272    HG2  GLU  42           2HG      GLU  42  -1.260   3.311   1.773
  273    HG3  GLU  42           1HG      GLU  42   0.083   4.395   1.419
  274    H    PHE  43           H        PHE  43  -4.599   4.468   1.493
  275    HA   PHE  43           HA       PHE  43  -5.845   6.779   0.655
  276    HB2  PHE  43           2HB      PHE  43  -6.255   4.350  -0.082
  277    HB3  PHE  43           1HB      PHE  43  -7.401   4.268   1.256
  278    HD1  PHE  43           2HD      PHE  43  -9.380   5.782   1.308
  279    HD2  PHE  43           1HD      PHE  43  -6.735   5.613  -2.072
  280    HE1  PHE  43           2HE      PHE  43 -11.085   6.925  -0.082
  281    HE2  PHE  43           1HE      PHE  43  -8.441   6.756  -3.463
  282    HZ   PHE  43           HZ       PHE  43 -10.616   7.412  -2.468
  283    H    HIS  44           H        HIS  44  -6.252   5.047   3.682
  284    HA   HIS  44           HA       HIS  44  -8.595   6.453   4.530
  285    HB2  HIS  44           2HB      HIS  44  -6.540   4.776   5.970
  286    HB3  HIS  44           1HB      HIS  44  -7.879   5.551   6.815
  287    HD2  HIS  44           2HD      HIS  44  -8.578   4.044   3.267
  288    HE1  HIS  44           1HE      HIS  44 -10.414   1.537   6.123
  289    HE2  HIS  44           2HE      HIS  44 -10.175   2.013   3.641
  290    H    ARG  45           H        ARG  45  -5.136   6.998   4.825
  291    HA   ARG  45           HA       ARG  45  -5.271   9.001   6.841
  292    HB2  ARG  45           2HB      ARG  45  -3.194   8.319   4.760
  293    HB3  ARG  45           1HB      ARG  45  -2.979   9.624   5.926
  294    HG2  ARG  45           2HG      ARG  45  -3.262   8.051   7.782
  295    HG3  ARG  45           1HG      ARG  45  -3.561   6.735   6.646
  296    HD2  ARG  45           2HD      ARG  45  -1.331   6.814   5.814
  297    HD3  ARG  45           1HD      ARG  45  -1.018   8.367   6.583
  298    HE   ARG  45           HE       ARG  45  -1.551   6.783   8.706
  299   HH11  ARG  45          1HH2      ARG  45   0.461   6.413   5.915
  300   HH12  ARG  45          2HH2      ARG  45   1.629   5.419   6.717
  301   HH21  ARG  45          1HH1      ARG  45  -0.022   5.479   9.767
  302   HH22  ARG  45          2HH1      ARG  45   1.356   4.890   8.899
  303    H    ARG  46           H        ARG  46  -5.763   9.029   3.393
  304    HA   ARG  46           HA       ARG  46  -5.399  11.831   2.993
  305    HB2  ARG  46           2HB      ARG  46  -7.229  10.132   1.315
  306    HB3  ARG  46           1HB      ARG  46  -6.200  11.475   0.819
  307    HG2  ARG  46           2HG      ARG  46  -5.264   8.740   1.730
  308    HG3  ARG  46           1HG      ARG  46  -5.199   9.369   0.086
  309    HD2  ARG  46           2HD      ARG  46  -3.762  11.258   0.984
  310    HD3  ARG  46           1HD      ARG  46  -3.670  10.365   2.499
  311    HE   ARG  46           HE       ARG  46  -2.851   8.493   0.776
  312   HH11  ARG  46          1HH2      ARG  46  -2.089  11.861   1.028
  313   HH12  ARG  46          2HH2      ARG  46  -0.492  11.688   0.380
  314   HH21  ARG  46          1HH1      ARG  46  -0.759   8.261  -0.073
  315   HH22  ARG  46          2HH1      ARG  46   0.261   9.652  -0.243
  316    H    LEU  47           H        LEU  47  -8.158   9.800   3.831
  317    HA   LEU  47           HA       LEU  47 -10.161  11.787   3.544
  318    HB2  LEU  47           2HB      LEU  47 -10.309   9.532   5.536
  319    HB3  LEU  47           1HB      LEU  47 -11.612  10.266   4.601
  320    HG   LEU  47           HG       LEU  47  -9.374   8.519   3.543
  321   HD11  LEU  47          1HD1      LEU  47 -12.390   8.193   3.574
  322   HD12  LEU  47          2HD1      LEU  47 -11.257   7.333   4.618
  323   HD13  LEU  47          3HD1      LEU  47 -11.240   7.052   2.877
  324   HD21  LEU  47          3HD2      LEU  47 -11.460  10.195   2.132
  325   HD22  LEU  47          1HD2      LEU  47 -10.681   8.816   1.354
  326   HD23  LEU  47          2HD2      LEU  47  -9.714  10.195   1.878
  327    H    LYS  48           H        LYS  48  -7.958  10.945   6.142
  328    HA   LYS  48           HA       LYS  48  -9.152  12.228   8.302
  329    HB2  LYS  48           2HB      LYS  48  -7.015  10.826   8.270
  330    HB3  LYS  48           1HB      LYS  48  -6.181  12.298   7.766
  331    HG2  LYS  48           2HG      LYS  48  -6.936  13.462   9.774
  332    HG3  LYS  48           1HG      LYS  48  -7.882  12.057  10.265
  333    HD2  LYS  48           2HD      LYS  48  -5.685  10.742  10.206
  334    HD3  LYS  48           1HD      LYS  48  -4.873  12.306  10.099
  335    HE2  LYS  48           2HE      LYS  48  -6.180  12.988  12.177
  336    HE3  LYS  48           1HE      LYS  48  -6.643  11.292  12.334
  337    HZ1  LYS  48           3HZ      LYS  48  -3.918  12.448  12.416
  338    HZ2  LYS  48           1HZ      LYS  48  -4.200  10.787  12.224
  339    HZ3  LYS  48           2HZ      LYS  48  -4.722  11.578  13.633
  340    H    VAL  49           H        VAL  49  -7.357  13.565   5.594
  341    HA   VAL  49           HA       VAL  49  -7.168  16.211   6.720
  342    HB   VAL  49           HB       VAL  49  -6.851  15.379   3.828
  343   HG11  VAL  49          1HG1      VAL  49  -6.065  17.786   5.471
  344   HG12  VAL  49          2HG1      VAL  49  -6.894  17.734   3.916
  345   HG13  VAL  49          3HG1      VAL  49  -5.175  17.360   4.009
  346   HG21  VAL  49          3HG2      VAL  49  -4.383  15.312   4.480
  347   HG22  VAL  49          1HG2      VAL  49  -5.368  13.982   5.092
  348   HG23  VAL  49          2HG2      VAL  49  -4.920  15.314   6.160
  349    H    TYR  50           H        TYR  50  -9.756  14.510   5.757
  350    HA   TYR  50           HA       TYR  50 -11.239  16.946   5.006
  351    HB2  TYR  50           2HB      TYR  50 -11.432  14.278   3.585
  352    HB3  TYR  50           1HB      TYR  50 -12.500  15.656   3.312
  353    HD1  TYR  50           2HD      TYR  50 -11.359  17.917   2.695
  354    HD2  TYR  50           1HD      TYR  50  -9.431  14.092   2.367
  355    HE1  TYR  50           2HE      TYR  50  -9.716  18.880   1.106
  356    HE2  TYR  50           1HE      TYR  50  -7.788  15.055   0.779
  357    HH   TYR  50           HH       TYR  50  -7.950  18.493  -0.171
  358    H    HIS  51           H        HIS  51 -11.470  16.395   7.480
  359    HA   HIS  51           HA       HIS  51 -13.339  14.295   8.116
  360    HB2  HIS  51           2HB      HIS  51 -13.345  15.395  10.376
  361    HB3  HIS  51           1HB      HIS  51 -11.743  14.932   9.803
  362    HD2  HIS  51           2HD      HIS  51 -10.296  17.245   8.586
  363    HE1  HIS  51           1HE      HIS  51 -12.467  20.042  10.884
  364    HE2  HIS  51           2HE      HIS  51 -10.426  19.719   9.409
  Start of MODEL    3
    1    H1   GLY   9           H        GLY   9  10.199 -15.341  -0.659
    2    HA2  GLY   9           2HA      GLY   9  12.232 -13.766   0.334
    3    HA3  GLY   9           1HA      GLY   9  12.403 -13.679  -1.416
    4    H    THR  10           H        THR  10   9.960 -13.337   1.154
    5    HA   THR  10           HA       THR  10   8.197 -11.775  -0.500
    6    HB   THR  10           HB       THR  10   7.050 -11.353   1.744
    7    HG1  THR  10           1HG      THR  10   8.550 -11.692   3.239
    8   HG21  THR  10          3HG2      THR  10   7.572 -14.228   0.937
    9   HG22  THR  10          1HG2      THR  10   6.405 -13.155   0.164
   10   HG23  THR  10          2HG2      THR  10   6.178 -13.639   1.844
   11    H    LYS  11           H        LYS  11   9.239  -9.969  -1.233
   12    HA   LYS  11           HA       LYS  11  10.580  -8.187   0.653
   13    HB2  LYS  11           2HB      LYS  11  10.266  -8.258  -2.342
   14    HB3  LYS  11           1HB      LYS  11  10.882  -6.822  -1.524
   15    HG2  LYS  11           2HG      LYS  11  12.630  -8.238  -0.439
   16    HG3  LYS  11           1HG      LYS  11  12.051  -9.615  -1.378
   17    HD2  LYS  11           2HD      LYS  11  12.663  -8.584  -3.446
   18    HD3  LYS  11           1HD      LYS  11  12.936  -7.026  -2.667
   19    HE2  LYS  11           2HE      LYS  11  15.059  -8.262  -3.174
   20    HE3  LYS  11           1HE      LYS  11  14.851  -7.907  -1.458
   21    HZ1  LYS  11           3HZ      LYS  11  15.489 -10.144  -1.570
   22    HZ2  LYS  11           1HZ      LYS  11  14.434 -10.481  -2.855
   23    HZ3  LYS  11           2HZ      LYS  11  13.812 -10.185  -1.302
   24    H    LYS  12           H        LYS  12   9.051  -7.216   1.914
   25    HA   LYS  12           HA       LYS  12   6.498  -6.397   1.219
   26    HB2  LYS  12           2HB      LYS  12   6.888  -4.599   3.035
   27    HB3  LYS  12           1HB      LYS  12   7.020  -6.291   3.510
   28    HG2  LYS  12           2HG      LYS  12   9.537  -5.093   2.507
   29    HG3  LYS  12           1HG      LYS  12   8.943  -4.401   4.015
   30    HD2  LYS  12           2HD      LYS  12   9.048  -6.461   5.150
   31    HD3  LYS  12           1HD      LYS  12   9.085  -7.392   3.654
   32    HE2  LYS  12           2HE      LYS  12  11.298  -5.513   4.521
   33    HE3  LYS  12           1HE      LYS  12  11.313  -7.253   4.818
   34    HZ1  LYS  12           3HZ      LYS  12  10.681  -6.871   2.136
   35    HZ2  LYS  12           1HZ      LYS  12  12.102  -7.533   2.784
   36    HZ3  LYS  12           2HZ      LYS  12  12.009  -5.865   2.471
   37    H    TYR  13           H        TYR  13   6.084  -3.780   1.518
   38    HA   TYR  13           HA       TYR  13   7.661  -2.455  -0.610
   39    HB2  TYR  13           2HB      TYR  13   4.680  -2.131  -0.233
   40    HB3  TYR  13           1HB      TYR  13   5.671  -1.539  -1.568
   41    HD1  TYR  13           2HD      TYR  13   7.081  -3.412  -2.820
   42    HD2  TYR  13           1HD      TYR  13   3.530  -4.145  -0.518
   43    HE1  TYR  13           2HE      TYR  13   6.735  -5.548  -4.033
   44    HE2  TYR  13           1HE      TYR  13   3.184  -6.281  -1.731
   45    HH   TYR  13           HH       TYR  13   3.971  -7.671  -3.262
   46    H    ASP  14           H        ASP  14   7.168  -0.025  -0.613
   47    HA   ASP  14           HA       ASP  14   6.718   1.012   2.109
   48    HB2  ASP  14           2HB      ASP  14   9.128   0.817   1.919
   49    HB3  ASP  14           1HB      ASP  14   9.105   1.633   0.357
   50    H    LEU  15           H        LEU  15   4.991   2.268   1.836
   51    HA   LEU  15           HA       LEU  15   4.674   3.819  -0.636
   52    HB2  LEU  15           2HB      LEU  15   2.699   3.783   1.632
   53    HB3  LEU  15           1HB      LEU  15   2.408   4.008  -0.093
   54    HG   LEU  15           HG       LEU  15   3.263   1.432   1.262
   55   HD11  LEU  15          1HD1      LEU  15   0.690   2.417   0.021
   56   HD12  LEU  15          2HD1      LEU  15   0.938   1.753   1.636
   57   HD13  LEU  15          3HD1      LEU  15   1.026   0.697   0.226
   58   HD21  LEU  15          3HD2      LEU  15   4.313   1.540  -0.911
   59   HD22  LEU  15          1HD2      LEU  15   2.832   2.145  -1.652
   60   HD23  LEU  15          2HD2      LEU  15   2.907   0.486  -1.061
   61    H    SER  16           H        SER  16   6.772   4.613   1.103
   62    HA   SER  16           HA       SER  16   6.377   6.528   2.987
   63    HB2  SER  16           2HB      SER  16   8.346   6.432   0.713
   64    HB3  SER  16           1HB      SER  16   8.372   7.744   1.887
   65    HG   SER  16           HG       SER  16   9.703   5.850   2.381
   66    H    LYS  17           H        LYS  17   5.793   6.851  -0.468
   67    HA   LYS  17           HA       LYS  17   4.143   9.192   0.015
   68    HB2  LYS  17           2HB      LYS  17   5.349  10.543  -1.718
   69    HB3  LYS  17           1HB      LYS  17   6.269  10.297  -0.236
   70    HG2  LYS  17           2HG      LYS  17   6.835   8.090  -1.970
   71    HG3  LYS  17           1HG      LYS  17   6.998   9.566  -2.919
   72    HD2  LYS  17           2HD      LYS  17   8.506  10.508  -1.215
   73    HD3  LYS  17           1HD      LYS  17   8.333   9.045  -0.245
   74    HE2  LYS  17           2HE      LYS  17   9.328   8.993  -3.101
   75    HE3  LYS  17           1HE      LYS  17  10.414   9.153  -1.721
   76    HZ1  LYS  17           3HZ      LYS  17   8.992   7.094  -0.912
   77    HZ2  LYS  17           1HZ      LYS  17  10.373   6.911  -1.879
   78    HZ3  LYS  17           2HZ      LYS  17   8.828   6.863  -2.588
   79    H    TRP  18           H        TRP  18   2.432   9.140  -1.299
   80    HA   TRP  18           HA       TRP  18   2.645   7.867  -3.938
   81    HB2  TRP  18           2HB      TRP  18   0.978   6.917  -1.645
   82    HB3  TRP  18           1HB      TRP  18   0.281   6.835  -3.261
   83    HD1  TRP  18           HD       TRP  18   3.525   5.765  -1.448
   84    HE1  TRP  18           1HE      TRP  18   4.353   3.569  -2.515
   85    HE3  TRP  18           3HE      TRP  18   0.053   5.223  -5.153
   86    HZ2  TRP  18           2HZ      TRP  18   3.635   1.814  -4.655
   87    HZ3  TRP  18           3HZ      TRP  18   0.147   3.281  -6.689
   88    HH2  TRP  18           HH       TRP  18   1.931   1.575  -6.446
   89    H    LYS  19           H        LYS  19   0.579   8.220  -5.198
   90    HA   LYS  19           HA       LYS  19  -0.451  10.934  -4.621
   91    HB2  LYS  19           2HB      LYS  19  -0.225   9.464  -7.259
   92    HB3  LYS  19           1HB      LYS  19  -0.891  11.083  -7.045
   93    HG2  LYS  19           2HG      LYS  19   1.272  11.697  -7.535
   94    HG3  LYS  19           1HG      LYS  19   1.482  11.439  -5.805
   95    HD2  LYS  19           2HD      LYS  19   2.038   8.996  -6.412
   96    HD3  LYS  19           1HD      LYS  19   2.191   9.573  -8.071
   97    HE2  LYS  19           2HE      LYS  19   4.379   9.578  -6.920
   98    HE3  LYS  19           1HE      LYS  19   3.884  11.212  -7.360
   99    HZ1  LYS  19           3HZ      LYS  19   3.671  11.809  -5.230
  100    HZ2  LYS  19           1HZ      LYS  19   4.659  10.470  -4.903
  101    HZ3  LYS  19           2HZ      LYS  19   2.972  10.332  -4.765
  102    H    TYR  20           H        TYR  20  -2.616  11.306  -4.546
  103    HA   TYR  20           HA       TYR  20  -4.395   9.304  -3.832
  104    HB2  TYR  20           2HB      TYR  20  -4.804  11.707  -3.454
  105    HB3  TYR  20           1HB      TYR  20  -5.057  11.931  -5.186
  106    HD1  TYR  20           2HD      TYR  20  -7.002  10.888  -6.321
  107    HD2  TYR  20           1HD      TYR  20  -6.475  10.659  -2.064
  108    HE1  TYR  20           2HE      TYR  20  -9.373  10.205  -6.065
  109    HE2  TYR  20           1HE      TYR  20  -8.845   9.974  -1.807
  110    HH   TYR  20           HH       TYR  20 -10.762   9.565  -2.840
  111    H    ALA  21           H        ALA  21  -3.460  10.416  -7.010
  112    HA   ALA  21           HA       ALA  21  -5.604   9.081  -8.399
  113    HB1  ALA  21           1HB      ALA  21  -4.313   9.649 -10.428
  114    HB2  ALA  21           2HB      ALA  21  -2.978  10.198  -9.415
  115    HB3  ALA  21           3HB      ALA  21  -4.522  11.049  -9.377
  116    H    GLU  22           H        GLU  22  -2.281   8.342  -7.507
  117    HA   GLU  22           HA       GLU  22  -2.108   5.952  -9.092
  118    HB2  GLU  22           2HB      GLU  22  -0.448   7.069  -6.831
  119    HB3  GLU  22           1HB      GLU  22  -0.089   5.522  -7.600
  120    HG2  GLU  22           2HG      GLU  22  -0.412   8.096  -9.159
  121    HG3  GLU  22           1HG      GLU  22   1.147   7.524  -8.564
  122    H    LEU  23           H        LEU  23  -2.869   6.698  -5.719
  123    HA   LEU  23           HA       LEU  23  -2.969   4.032  -4.776
  124    HB2  LEU  23           2HB      LEU  23  -4.461   6.478  -3.799
  125    HB3  LEU  23           1HB      LEU  23  -4.274   4.971  -2.904
  126    HG   LEU  23           HG       LEU  23  -1.916   6.577  -3.907
  127   HD11  LEU  23          1HD1      LEU  23  -1.770   7.272  -1.437
  128   HD12  LEU  23          2HD1      LEU  23  -3.455   6.766  -1.314
  129   HD13  LEU  23          3HD1      LEU  23  -3.002   8.070  -2.412
  130   HD21  LEU  23          3HD2      LEU  23  -0.883   5.288  -1.900
  131   HD22  LEU  23          1HD2      LEU  23  -1.214   4.381  -3.373
  132   HD23  LEU  23          2HD2      LEU  23  -2.316   4.267  -2.001
  133    H    ARG  24           H        ARG  24  -5.513   6.202  -5.993
  134    HA   ARG  24           HA       ARG  24  -7.610   4.284  -5.724
  135    HB2  ARG  24           2HB      ARG  24  -7.828   6.831  -5.901
  136    HB3  ARG  24           1HB      ARG  24  -7.603   6.617  -7.636
  137    HG2  ARG  24           2HG      ARG  24  -9.915   6.481  -7.518
  138    HG3  ARG  24           1HG      ARG  24  -9.502   4.780  -7.315
  139    HD2  ARG  24           2HD      ARG  24  -9.457   5.279  -4.787
  140    HD3  ARG  24           1HD      ARG  24 -10.278   6.783  -5.193
  141    HE   ARG  24           HE       ARG  24 -11.811   4.928  -6.436
  142   HH11  ARG  24          1HH2      ARG  24 -10.491   5.197  -3.248
  143   HH12  ARG  24          2HH2      ARG  24 -11.791   4.339  -2.487
  144   HH21  ARG  24          1HH1      ARG  24 -13.519   3.803  -5.447
  145   HH22  ARG  24          2HH1      ARG  24 -13.505   3.550  -3.734
  146    H    ASP  25           H        ASP  25  -5.330   5.096  -8.265
  147    HA   ASP  25           HA       ASP  25  -6.663   3.608 -10.324
  148    HB2  ASP  25           2HB      ASP  25  -3.914   4.811 -10.045
  149    HB3  ASP  25           1HB      ASP  25  -4.369   3.849 -11.448
  150    H    THR  26           H        THR  26  -3.845   3.003  -8.232
  151    HA   THR  26           HA       THR  26  -3.060   0.537  -9.233
  152    HB   THR  26           HB       THR  26  -3.041   1.502  -6.364
  153    HG1  THR  26           1HG      THR  26  -1.571   2.745  -7.164
  154   HG21  THR  26          3HG2      THR  26  -1.694  -0.826  -7.744
  155   HG22  THR  26          1HG2      THR  26  -2.732  -0.868  -6.319
  156   HG23  THR  26          2HG2      THR  26  -1.119  -0.164  -6.214
  157    H    ILE  27           H        ILE  27  -5.610   1.293  -6.896
  158    HA   ILE  27           HA       ILE  27  -6.255  -1.451  -6.355
  159    HB   ILE  27           HB       ILE  27  -7.809   1.104  -5.874
  160   HG12  ILE  27          2HG1      ILE  27  -6.285  -0.642  -3.921
  161   HG13  ILE  27          1HG1      ILE  27  -5.574   0.771  -4.702
  162   HG21  ILE  27          1HG2      ILE  27  -8.979  -0.433  -4.170
  163   HG22  ILE  27          2HG2      ILE  27  -8.298  -1.775  -5.091
  164   HG23  ILE  27          3HG2      ILE  27  -9.413  -0.650  -5.867
  165   HD11  ILE  27          3HD1      ILE  27  -8.192   0.960  -3.212
  166   HD12  ILE  27          1HD1      ILE  27  -7.079   2.259  -3.644
  167   HD13  ILE  27          2HD1      ILE  27  -6.648   1.114  -2.374
  168    H    ASN  28           H        ASN  28  -7.374   1.000  -8.618
  169    HA   ASN  28           HA       ASN  28  -9.521  -0.737  -9.594
  170    HB2  ASN  28           2HB      ASN  28  -8.677   2.082 -10.280
  171    HB3  ASN  28           1HB      ASN  28  -9.963   1.225 -11.126
  172   HD21  ASN  28          1HD2      ASN  28  -9.038   1.646  -7.651
  173   HD22  ASN  28          2HD2      ASN  28 -10.608   2.048  -7.143
  174    H    THR  29           H        THR  29  -6.646  -1.432  -9.930
  175    HA   THR  29           HA       THR  29  -6.782  -2.058 -12.768
  176    HB   THR  29           HB       THR  29  -4.454  -1.197 -13.163
  177    HG1  THR  29           1HG      THR  29  -3.894   0.523 -11.632
  178   HG21  THR  29          3HG2      THR  29  -6.345   1.014 -12.354
  179   HG22  THR  29          1HG2      THR  29  -6.621   0.017 -13.780
  180   HG23  THR  29          2HG2      THR  29  -5.172   1.016 -13.669
  181    H    SER  30           H        SER  30  -4.523  -2.041  -9.997
  182    HA   SER  30           HA       SER  30  -3.482  -4.645 -10.751
  183    HB2  SER  30           2HB      SER  30  -2.223  -2.640  -9.621
  184    HB3  SER  30           1HB      SER  30  -2.890  -3.304  -8.131
  185    HG   SER  30           HG       SER  30  -1.768  -5.125  -9.892
  186    H    CYS  31           H        CYS  31  -3.175  -6.175  -8.716
  187    HA   CYS  31           HA       CYS  31  -5.470  -6.280  -6.954
  188    HB2  CYS  31           2HB      CYS  31  -6.519  -7.260  -8.877
  189    HB3  CYS  31           1HB      CYS  31  -5.122  -8.290  -9.185
  190    HG   CYS  31           HG       CYS  31  -6.275  -8.804  -6.421
  191    H    ASP  32           H        ASP  32  -4.748  -7.014  -5.073
  192    HA   ASP  32           HA       ASP  32  -3.203  -9.369  -4.764
  193    HB2  ASP  32           2HB      ASP  32  -1.545  -7.483  -5.623
  194    HB3  ASP  32           1HB      ASP  32  -1.589  -6.990  -3.933
  195    H    ILE  33           H        ILE  33  -2.863  -9.909  -2.550
  196    HA   ILE  33           HA       ILE  33  -4.784  -8.663  -0.776
  197    HB   ILE  33           HB       ILE  33  -2.820 -10.910  -0.263
  198   HG12  ILE  33          2HG1      ILE  33  -4.685 -11.118  -2.114
  199   HG13  ILE  33          1HG1      ILE  33  -4.460 -12.425  -0.955
  200   HG21  ILE  33          1HG2      ILE  33  -5.111  -9.728   1.297
  201   HG22  ILE  33          2HG2      ILE  33  -3.490 -10.146   1.854
  202   HG23  ILE  33          3HG2      ILE  33  -4.659 -11.420   1.511
  203   HD11  ILE  33          3HD1      ILE  33  -6.395 -10.192  -0.366
  204   HD12  ILE  33          1HD1      ILE  33  -6.368 -11.831   0.280
  205   HD13  ILE  33          2HD1      ILE  33  -6.876 -11.548  -1.385
  206    H    GLU  34           H        GLU  34  -1.651  -7.979  -1.620
  207    HA   GLU  34           HA       GLU  34  -0.938  -6.948   1.057
  208    HB2  GLU  34           2HB      GLU  34   0.835  -7.247  -1.377
  209    HB3  GLU  34           1HB      GLU  34   1.343  -6.860   0.266
  210    HG2  GLU  34           2HG      GLU  34   0.522  -9.046   1.047
  211    HG3  GLU  34           1HG      GLU  34  -0.009  -9.436  -0.589
  212    H    LEU  35           H        LEU  35  -0.563  -5.970  -2.366
  213    HA   LEU  35           HA       LEU  35  -0.059  -3.271  -1.912
  214    HB2  LEU  35           2HB      LEU  35  -1.347  -4.716  -4.223
  215    HB3  LEU  35           1HB      LEU  35  -1.095  -2.974  -4.250
  216    HG   LEU  35           HG       LEU  35   1.101  -5.006  -3.749
  217   HD11  LEU  35          1HD1      LEU  35   0.044  -5.038  -6.070
  218   HD12  LEU  35          2HD1      LEU  35   1.774  -4.702  -6.026
  219   HD13  LEU  35          3HD1      LEU  35   0.626  -3.382  -6.260
  220   HD21  LEU  35          3HD2      LEU  35   0.944  -2.021  -3.828
  221   HD22  LEU  35          1HD2      LEU  35   2.361  -2.765  -4.570
  222   HD23  LEU  35          2HD2      LEU  35   1.995  -3.066  -2.873
  223    H    LEU  36           H        LEU  36  -3.200  -4.842  -2.546
  224    HA   LEU  36           HA       LEU  36  -4.798  -2.557  -2.393
  225    HB2  LEU  36           2HB      LEU  36  -5.465  -5.389  -1.552
  226    HB3  LEU  36           1HB      LEU  36  -6.643  -4.108  -1.835
  227    HG   LEU  36           HG       LEU  36  -4.682  -5.159  -3.898
  228   HD11  LEU  36          1HD1      LEU  36  -6.533  -6.302  -4.889
  229   HD12  LEU  36          2HD1      LEU  36  -7.690  -5.490  -3.836
  230   HD13  LEU  36          3HD1      LEU  36  -6.589  -6.698  -3.172
  231   HD21  LEU  36          3HD2      LEU  36  -5.115  -2.990  -4.613
  232   HD22  LEU  36          1HD2      LEU  36  -6.704  -2.941  -3.848
  233   HD23  LEU  36          2HD2      LEU  36  -6.474  -3.836  -5.351
  234    H    ALA  37           H        ALA  37  -3.859  -4.824   0.188
  235    HA   ALA  37           HA       ALA  37  -5.216  -3.447   2.265
  236    HB1  ALA  37           1HB      ALA  37  -4.557  -5.749   2.586
  237    HB2  ALA  37           2HB      ALA  37  -3.700  -4.762   3.769
  238    HB3  ALA  37           3HB      ALA  37  -2.860  -5.344   2.333
  239    H    ALA  38           H        ALA  38  -2.051  -3.120   0.805
  240    HA   ALA  38           HA       ALA  38  -0.995  -1.361   2.820
  241    HB1  ALA  38           1HB      ALA  38   0.930  -1.256   1.501
  242    HB2  ALA  38           2HB      ALA  38   0.035  -1.492  -0.001
  243    HB3  ALA  38           3HB      ALA  38   0.282  -2.847   1.102
  244    H    CYS  39           H        CYS  39  -2.575  -0.972  -0.313
  245    HA   CYS  39           HA       CYS  39  -2.203   1.860  -0.463
  246    HB2  CYS  39           2HB      CYS  39  -2.599   0.584  -2.487
  247    HB3  CYS  39           1HB      CYS  39  -4.150   0.017  -1.868
  248    HG   CYS  39           HG       CYS  39  -5.101   2.060  -2.888
  249    H    ARG  40           H        ARG  40  -4.969  -0.208   0.418
  250    HA   ARG  40           HA       ARG  40  -6.877   1.721   0.925
  251    HB2  ARG  40           2HB      ARG  40  -6.317  -0.904   2.306
  252    HB3  ARG  40           1HB      ARG  40  -7.719   0.090   2.701
  253    HG2  ARG  40           2HG      ARG  40  -8.622  -0.116   0.516
  254    HG3  ARG  40           1HG      ARG  40  -7.100  -0.718  -0.143
  255    HD2  ARG  40           2HD      ARG  40  -8.956  -2.451   0.306
  256    HD3  ARG  40           1HD      ARG  40  -7.342  -2.820   0.906
  257    HE   ARG  40           HE       ARG  40  -9.098  -1.462   2.793
  258   HH11  ARG  40          1HH2      ARG  40  -7.841  -4.433   1.541
  259   HH12  ARG  40          2HH2      ARG  40  -8.196  -5.346   2.970
  260   HH21  ARG  40          1HH1      ARG  40  -9.564  -2.651   4.671
  261   HH22  ARG  40          2HH1      ARG  40  -9.171  -4.336   4.741
  262    H    GLU  41           H        GLU  41  -4.085   0.833   2.842
  263    HA   GLU  41           HA       GLU  41  -4.841   2.134   5.250
  264    HB2  GLU  41           2HB      GLU  41  -2.194   1.294   4.078
  265    HB3  GLU  41           1HB      GLU  41  -2.288   2.155   5.615
  266    HG2  GLU  41           2HG      GLU  41  -3.878  -0.354   5.048
  267    HG3  GLU  41           1HG      GLU  41  -2.275  -0.388   5.779
  268    H    GLU  42           H        GLU  42  -3.130   3.207   2.350
  269    HA   GLU  42           HA       GLU  42  -2.489   5.803   3.399
  270    HB2  GLU  42           2HB      GLU  42  -2.413   4.557   0.657
  271    HB3  GLU  42           1HB      GLU  42  -2.103   6.277   0.885
  272    HG2  GLU  42           2HG      GLU  42  -0.651   4.180   2.497
  273    HG3  GLU  42           1HG      GLU  42  -0.062   4.711   0.924
  274    H    PHE  43           H        PHE  43  -4.974   4.511   1.214
  275    HA   PHE  43           HA       PHE  43  -6.237   6.826   0.421
  276    HB2  PHE  43           2HB      PHE  43  -6.806   4.446  -0.242
  277    HB3  PHE  43           1HB      PHE  43  -7.719   4.333   1.263
  278    HD1  PHE  43           2HD      PHE  43  -7.433   6.196  -1.943
  279    HD2  PHE  43           1HD      PHE  43  -9.865   5.354   1.496
  280    HE1  PHE  43           2HE      PHE  43  -9.353   7.337  -3.021
  281    HE2  PHE  43           1HE      PHE  43 -11.784   6.495   0.418
  282    HZ   PHE  43           HZ       PHE  43 -11.528   7.487  -1.841
  283    H    HIS  44           H        HIS  44  -6.492   5.139   3.509
  284    HA   HIS  44           HA       HIS  44  -8.658   6.644   4.553
  285    HB2  HIS  44           2HB      HIS  44  -6.422   5.200   5.998
  286    HB3  HIS  44           1HB      HIS  44  -7.913   5.782   6.743
  287    HD2  HIS  44           2HD      HIS  44  -8.803   4.381   3.338
  288    HE1  HIS  44           1HE      HIS  44  -9.271   1.157   6.022
  289    HE2  HIS  44           2HE      HIS  44  -9.748   1.970   3.664
  290    H    ARG  45           H        ARG  45  -5.178   7.156   4.485
  291    HA   ARG  45           HA       ARG  45  -5.095   9.272   6.378
  292    HB2  ARG  45           2HB      ARG  45  -3.227   8.677   4.069
  293    HB3  ARG  45           1HB      ARG  45  -2.880   9.752   5.423
  294    HG2  ARG  45           2HG      ARG  45  -3.308   7.778   6.962
  295    HG3  ARG  45           1HG      ARG  45  -3.339   6.761   5.522
  296    HD2  ARG  45           2HD      ARG  45  -1.091   6.610   5.717
  297    HD3  ARG  45           1HD      ARG  45  -1.018   8.299   5.225
  298    HE   ARG  45           HE       ARG  45  -1.485   7.868   8.063
  299   HH11  ARG  45          1HH2      ARG  45   0.786   8.326   5.492
  300   HH12  ARG  45          2HH2      ARG  45   2.051   8.899   6.527
  301   HH21  ARG  45          1HH1      ARG  45   0.170   8.620   9.427
  302   HH22  ARG  45          2HH1      ARG  45   1.703   9.065   8.754
  303    H    ARG  46           H        ARG  46  -5.705   9.143   2.915
  304    HA   ARG  46           HA       ARG  46  -5.466  11.924   2.404
  305    HB2  ARG  46           2HB      ARG  46  -7.309  10.088   0.888
  306    HB3  ARG  46           1HB      ARG  46  -6.385  11.465   0.287
  307    HG2  ARG  46           2HG      ARG  46  -5.281   8.797   1.204
  308    HG3  ARG  46           1HG      ARG  46  -5.267   9.441  -0.436
  309    HD2  ARG  46           2HD      ARG  46  -3.912  11.394   0.482
  310    HD3  ARG  46           1HD      ARG  46  -3.736  10.460   1.965
  311    HE   ARG  46           HE       ARG  46  -2.856   8.681   0.191
  312   HH11  ARG  46          1HH2      ARG  46  -2.299  12.093   0.431
  313   HH12  ARG  46          2HH2      ARG  46  -0.724  12.022  -0.284
  314   HH21  ARG  46          1HH1      ARG  46  -0.789   8.588  -0.743
  315   HH22  ARG  46          2HH1      ARG  46   0.131  10.041  -0.949
  316    H    LEU  47           H        LEU  47  -8.228   9.865   3.271
  317    HA   LEU  47           HA       LEU  47 -10.287  11.711   3.008
  318    HB2  LEU  47           2HB      LEU  47  -9.828   9.285   4.668
  319    HB3  LEU  47           1HB      LEU  47 -11.128  10.355   5.187
  320    HG   LEU  47           HG       LEU  47 -12.055  10.274   2.859
  321   HD11  LEU  47          1HD1      LEU  47  -9.876   9.656   1.777
  322   HD12  LEU  47          2HD1      LEU  47 -11.213   8.608   1.303
  323   HD13  LEU  47          3HD1      LEU  47 -10.030   8.049   2.485
  324   HD21  LEU  47          3HD2      LEU  47 -11.682   7.635   4.308
  325   HD22  LEU  47          1HD2      LEU  47 -12.882   7.919   3.048
  326   HD23  LEU  47          2HD2      LEU  47 -12.977   8.802   4.570
  327    H    LYS  48           H        LYS  48  -8.417  11.003   5.962
  328    HA   LYS  48           HA       LYS  48  -9.288  13.587   7.084
  329    HB2  LYS  48           2HB      LYS  48  -7.778  11.408   8.528
  330    HB3  LYS  48           1HB      LYS  48  -8.726  12.723   9.223
  331    HG2  LYS  48           2HG      LYS  48  -9.849  10.456   7.547
  332    HG3  LYS  48           1HG      LYS  48  -9.961  10.577   9.303
  333    HD2  LYS  48           2HD      LYS  48 -11.063  12.876   8.889
  334    HD3  LYS  48           1HD      LYS  48 -11.256  12.338   7.220
  335    HE2  LYS  48           2HE      LYS  48 -13.278  11.806   8.492
  336    HE3  LYS  48           1HE      LYS  48 -12.452  10.315   8.037
  337    HZ1  LYS  48           3HZ      LYS  48 -11.497  11.328  10.520
  338    HZ2  LYS  48           1HZ      LYS  48 -12.134   9.799  10.157
  339    HZ3  LYS  48           2HZ      LYS  48 -13.177  11.076  10.568
  340    H    VAL  49           H        VAL  49  -7.956  15.220   6.620
  341    HA   VAL  49           HA       VAL  49  -5.144  15.009   7.287
  342    HB   VAL  49           HB       VAL  49  -5.189  14.197   4.956
  343   HG11  VAL  49          1HG1      VAL  49  -5.975  15.616   3.162
  344   HG12  VAL  49          2HG1      VAL  49  -6.288  16.940   4.283
  345   HG13  VAL  49          3HG1      VAL  49  -7.274  15.479   4.347
  346   HG21  VAL  49          3HG2      VAL  49  -3.397  15.531   4.219
  347   HG22  VAL  49          1HG2      VAL  49  -3.382  15.801   5.961
  348   HG23  VAL  49          2HG2      VAL  49  -4.094  17.006   4.889
  349    H    TYR  50           H        TYR  50  -7.991  16.639   7.140
  350    HA   TYR  50           HA       TYR  50  -8.642  18.793   7.595
  351    HB2  TYR  50           2HB      TYR  50  -7.150  18.433   9.548
  352    HB3  TYR  50           1HB      TYR  50  -5.805  19.082   8.609
  353    HD1  TYR  50           2HD      TYR  50  -9.049  19.884  10.195
  354    HD2  TYR  50           1HD      TYR  50  -5.624  21.444   8.123
  355    HE1  TYR  50           2HE      TYR  50  -9.733  22.190  10.800
  356    HE2  TYR  50           1HE      TYR  50  -6.309  23.749   8.728
  357    HH   TYR  50           HH       TYR  50  -9.396  24.406  10.265
  358    H    HIS  51           H        HIS  51  -8.994  20.330   6.141
  359    HA   HIS  51           HA       HIS  51  -6.839  21.784   4.895
  360    HB2  HIS  51           2HB      HIS  51  -6.811  19.861   3.426
  361    HB3  HIS  51           1HB      HIS  51  -8.560  19.936   3.227
  362    HD2  HIS  51           2HD      HIS  51  -9.405  22.484   1.909
  363    HE1  HIS  51           1HE      HIS  51  -5.693  22.896  -0.060
  364    HE2  HIS  51           2HE      HIS  51  -8.097  23.713   0.012
  Start of MODEL    4
    1    H1   GLY   9           H        GLY   9   9.669 -15.116   1.096
    2    HA2  GLY   9           2HA      GLY   9   8.708 -13.783  -0.553
    3    HA3  GLY   9           1HA      GLY   9   7.140 -14.485  -0.170
    4    H    THR  10           H        THR  10   7.803 -13.835   2.765
    5    HA   THR  10           HA       THR  10   6.226 -11.612   3.115
    6    HB   THR  10           HB       THR  10   8.553 -11.974   4.959
    7    HG1  THR  10           1HG      THR  10   7.365 -14.025   4.004
    8   HG21  THR  10          3HG2      THR  10   6.673 -10.385   5.406
    9   HG22  THR  10          1HG2      THR  10   6.835 -11.634   6.642
   10   HG23  THR  10          2HG2      THR  10   5.567 -11.759   5.422
   11    H    LYS  11           H        LYS  11   6.601  -9.928   1.732
   12    HA   LYS  11           HA       LYS  11   8.833  -8.184   2.416
   13    HB2  LYS  11           2HB      LYS  11   9.672  -9.664   0.572
   14    HB3  LYS  11           1HB      LYS  11   8.390  -9.021  -0.457
   15    HG2  LYS  11           2HG      LYS  11   9.264  -6.729  -0.093
   16    HG3  LYS  11           1HG      LYS  11  10.570  -7.394   0.889
   17    HD2  LYS  11           2HD      LYS  11  10.147  -8.452  -1.893
   18    HD3  LYS  11           1HD      LYS  11  10.966  -6.908  -1.678
   19    HE2  LYS  11           2HE      LYS  11  12.614  -7.959  -0.194
   20    HE3  LYS  11           1HE      LYS  11  11.781  -9.507  -0.342
   21    HZ1  LYS  11           3HZ      LYS  11  12.258  -8.523  -2.913
   22    HZ2  LYS  11           1HZ      LYS  11  12.919  -9.901  -2.179
   23    HZ3  LYS  11           2HZ      LYS  11  13.714  -8.406  -2.043
   24    H    LYS  12           H        LYS  12   7.552  -6.529   3.050
   25    HA   LYS  12           HA       LYS  12   5.158  -5.789   1.633
   26    HB2  LYS  12           2HB      LYS  12   6.700  -4.582   3.926
   27    HB3  LYS  12           1HB      LYS  12   5.310  -3.766   3.211
   28    HG2  LYS  12           2HG      LYS  12   4.588  -5.111   5.127
   29    HG3  LYS  12           1HG      LYS  12   3.929  -5.785   3.636
   30    HD2  LYS  12           2HD      LYS  12   5.452  -7.585   3.629
   31    HD3  LYS  12           1HD      LYS  12   6.549  -6.779   4.752
   32    HE2  LYS  12           2HE      LYS  12   3.742  -7.595   5.526
   33    HE3  LYS  12           1HE      LYS  12   5.133  -8.655   5.745
   34    HZ1  LYS  12           3HZ      LYS  12   6.039  -6.384   6.808
   35    HZ2  LYS  12           1HZ      LYS  12   5.279  -7.606   7.705
   36    HZ3  LYS  12           2HZ      LYS  12   4.388  -6.255   7.187
   37    H    TYR  13           H        TYR  13   5.177  -3.077   1.522
   38    HA   TYR  13           HA       TYR  13   7.412  -2.378  -0.287
   39    HB2  TYR  13           2HB      TYR  13   4.557  -1.549  -0.801
   40    HB3  TYR  13           1HB      TYR  13   5.936  -1.467  -1.898
   41    HD1  TYR  13           2HD      TYR  13   6.894  -3.542  -2.875
   42    HD2  TYR  13           1HD      TYR  13   3.328  -3.599  -0.481
   43    HE1  TYR  13           2HE      TYR  13   6.367  -5.814  -3.717
   44    HE2  TYR  13           1HE      TYR  13   2.802  -5.873  -1.322
   45    HH   TYR  13           HH       TYR  13   3.357  -7.465  -2.783
   46    H    ASP  14           H        ASP  14   7.859  -0.122  -0.445
   47    HA   ASP  14           HA       ASP  14   7.134   1.341   1.997
   48    HB2  ASP  14           2HB      ASP  14   9.511   1.175   1.504
   49    HB3  ASP  14           1HB      ASP  14   9.253   1.859  -0.098
   50    H    LEU  15           H        LEU  15   5.345   2.528   1.822
   51    HA   LEU  15           HA       LEU  15   4.813   3.962  -0.708
   52    HB2  LEU  15           2HB      LEU  15   2.817   3.658   1.521
   53    HB3  LEU  15           1HB      LEU  15   2.529   3.903  -0.201
   54    HG   LEU  15           HG       LEU  15   3.675   1.386   1.048
   55   HD11  LEU  15          1HD1      LEU  15   1.464   0.454   0.135
   56   HD12  LEU  15          2HD1      LEU  15   0.941   2.133  -0.003
   57   HD13  LEU  15          3HD1      LEU  15   1.356   1.464   1.576
   58   HD21  LEU  15          3HD2      LEU  15   3.307   0.474  -1.266
   59   HD22  LEU  15          1HD2      LEU  15   4.554   1.719  -1.197
   60   HD23  LEU  15          2HD2      LEU  15   2.946   2.113  -1.805
   61    H    SER  16           H        SER  16   6.768   4.878   1.192
   62    HA   SER  16           HA       SER  16   6.128   6.698   3.083
   63    HB2  SER  16           2HB      SER  16   8.157   7.789   2.646
   64    HB3  SER  16           1HB      SER  16   8.422   6.171   2.002
   65    HG   SER  16           HG       SER  16   7.906   6.979  -0.054
   66    H    LYS  17           H        LYS  17   5.858   7.209  -0.415
   67    HA   LYS  17           HA       LYS  17   3.925   9.357   0.082
   68    HB2  LYS  17           2HB      LYS  17   6.493   9.671  -1.474
   69    HB3  LYS  17           1HB      LYS  17   5.102  10.719  -1.743
   70    HG2  LYS  17           2HG      LYS  17   6.400  10.295   0.967
   71    HG3  LYS  17           1HG      LYS  17   6.777  11.642  -0.103
   72    HD2  LYS  17           2HD      LYS  17   4.117  11.934  -0.078
   73    HD3  LYS  17           1HD      LYS  17   4.286  11.111   1.471
   74    HE2  LYS  17           2HE      LYS  17   5.760  13.627   0.642
   75    HE3  LYS  17           1HE      LYS  17   4.406  13.550   1.770
   76    HZ1  LYS  17           3HZ      LYS  17   5.827  13.089   3.383
   77    HZ2  LYS  17           1HZ      LYS  17   7.126  13.152   2.296
   78    HZ3  LYS  17           2HZ      LYS  17   6.323  11.680   2.572
   79    H    TRP  18           H        TRP  18   2.238   9.196  -1.247
   80    HA   TRP  18           HA       TRP  18   2.562   7.927  -3.881
   81    HB2  TRP  18           2HB      TRP  18   0.920   6.916  -1.602
   82    HB3  TRP  18           1HB      TRP  18   0.220   6.816  -3.215
   83    HD1  TRP  18           HD       TRP  18   3.561   5.895  -1.477
   84    HE1  TRP  18           1HE      TRP  18   4.433   3.713  -2.533
   85    HE3  TRP  18           3HE      TRP  18  -0.033   5.132  -5.025
   86    HZ2  TRP  18           2HZ      TRP  18   3.704   1.883  -4.606
   87    HZ3  TRP  18           3HZ      TRP  18   0.079   3.162  -6.525
   88    HH2  TRP  18           HH       TRP  18   1.941   1.536  -6.318
   89    H    LYS  19           H        LYS  19   0.504   8.191  -5.187
   90    HA   LYS  19           HA       LYS  19  -0.617  10.877  -4.661
   91    HB2  LYS  19           2HB      LYS  19  -0.656   9.422  -7.302
   92    HB3  LYS  19           1HB      LYS  19  -0.869  11.146  -6.999
   93    HG2  LYS  19           2HG      LYS  19   1.686   9.572  -6.562
   94    HG3  LYS  19           1HG      LYS  19   1.385  10.712  -7.873
   95    HD2  LYS  19           2HD      LYS  19   0.896  12.437  -6.016
   96    HD3  LYS  19           1HD      LYS  19   1.668  11.286  -4.923
   97    HE2  LYS  19           2HE      LYS  19   2.880  12.726  -7.282
   98    HE3  LYS  19           1HE      LYS  19   3.430  12.713  -5.607
   99    HZ1  LYS  19           3HZ      LYS  19   4.245  10.572  -5.803
  100    HZ2  LYS  19           1HZ      LYS  19   4.645  11.252  -7.303
  101    HZ3  LYS  19           2HZ      LYS  19   3.305  10.217  -7.174
  102    H    TYR  20           H        TYR  20  -2.800  11.209  -4.643
  103    HA   TYR  20           HA       TYR  20  -4.527   9.202  -3.822
  104    HB2  TYR  20           2HB      TYR  20  -5.050  11.569  -3.539
  105    HB3  TYR  20           1HB      TYR  20  -5.195  11.766  -5.285
  106    HD1  TYR  20           2HD      TYR  20  -6.722  10.276  -2.271
  107    HD2  TYR  20           1HD      TYR  20  -7.120  10.921  -6.500
  108    HE1  TYR  20           2HE      TYR  20  -9.094   9.561  -2.157
  109    HE2  TYR  20           1HE      TYR  20  -9.493  10.206  -6.386
  110    HH   TYR  20           HH       TYR  20 -10.887   8.939  -3.391
  111    H    ALA  21           H        ALA  21  -3.650  10.211  -7.059
  112    HA   ALA  21           HA       ALA  21  -5.726   8.724  -8.383
  113    HB1  ALA  21           1HB      ALA  21  -4.401   9.207 -10.432
  114    HB2  ALA  21           2HB      ALA  21  -3.139   9.908  -9.418
  115    HB3  ALA  21           3HB      ALA  21  -4.736  10.656  -9.483
  116    H    GLU  22           H        GLU  22  -2.275   8.214  -7.722
  117    HA   GLU  22           HA       GLU  22  -2.007   5.766  -9.099
  118    HB2  GLU  22           2HB      GLU  22  -0.511   6.959  -6.763
  119    HB3  GLU  22           1HB      GLU  22  -0.058   5.422  -7.497
  120    HG2  GLU  22           2HG      GLU  22  -0.394   7.956  -9.112
  121    HG3  GLU  22           1HG      GLU  22   1.148   7.483  -8.402
  122    H    LEU  23           H        LEU  23  -2.793   6.485  -5.708
  123    HA   LEU  23           HA       LEU  23  -2.946   3.818  -4.809
  124    HB2  LEU  23           2HB      LEU  23  -4.470   6.237  -3.813
  125    HB3  LEU  23           1HB      LEU  23  -4.235   4.732  -2.929
  126    HG   LEU  23           HG       LEU  23  -1.901   6.356  -3.949
  127   HD11  LEU  23          1HD1      LEU  23  -3.047   7.897  -2.534
  128   HD12  LEU  23          2HD1      LEU  23  -1.783   7.184  -1.532
  129   HD13  LEU  23          3HD1      LEU  23  -3.452   6.638  -1.370
  130   HD21  LEU  23          3HD2      LEU  23  -2.296   4.183  -1.878
  131   HD22  LEU  23          1HD2      LEU  23  -0.838   5.171  -1.935
  132   HD23  LEU  23          2HD2      LEU  23  -1.261   4.144  -3.305
  133    H    ARG  24           H        ARG  24  -5.421   6.010  -6.105
  134    HA   ARG  24           HA       ARG  24  -7.570   4.149  -5.855
  135    HB2  ARG  24           2HB      ARG  24  -7.756   6.678  -6.079
  136    HB3  ARG  24           1HB      ARG  24  -7.420   6.458  -7.796
  137    HG2  ARG  24           2HG      ARG  24  -9.732   6.350  -7.845
  138    HG3  ARG  24           1HG      ARG  24  -9.366   4.645  -7.590
  139    HD2  ARG  24           2HD      ARG  24  -9.583   5.022  -5.122
  140    HD3  ARG  24           1HD      ARG  24 -10.084   6.675  -5.457
  141    HE   ARG  24           HE       ARG  24 -11.722   4.346  -5.662
  142   HH11  ARG  24          1HH2      ARG  24 -11.016   7.407  -7.115
  143   HH12  ARG  24          2HH2      ARG  24 -12.609   7.621  -7.764
  144   HH21  ARG  24          1HH1      ARG  24 -13.810   4.619  -6.510
  145   HH22  ARG  24          2HH1      ARG  24 -14.190   6.043  -7.421
  146    H    ASP  25           H        ASP  25  -5.359   5.029  -8.475
  147    HA   ASP  25           HA       ASP  25  -6.606   3.449 -10.481
  148    HB2  ASP  25           2HB      ASP  25  -3.860   4.650 -10.173
  149    HB3  ASP  25           1HB      ASP  25  -4.280   3.650 -11.561
  150    H    THR  26           H        THR  26  -3.801   2.872  -8.359
  151    HA   THR  26           HA       THR  26  -3.050   0.366  -9.287
  152    HB   THR  26           HB       THR  26  -3.010   1.409  -6.445
  153    HG1  THR  26           1HG      THR  26  -1.871   2.541  -8.211
  154   HG21  THR  26          3HG2      THR  26  -2.701  -0.952  -6.327
  155   HG22  THR  26          1HG2      THR  26  -1.079  -0.261  -6.286
  156   HG23  THR  26          2HG2      THR  26  -1.701  -0.966  -7.778
  157    H    ILE  27           H        ILE  27  -5.562   1.228  -6.944
  158    HA   ILE  27           HA       ILE  27  -6.261  -1.500  -6.364
  159    HB   ILE  27           HB       ILE  27  -7.731   1.094  -5.843
  160   HG12  ILE  27          2HG1      ILE  27  -6.186  -0.668  -3.927
  161   HG13  ILE  27          1HG1      ILE  27  -5.459   0.711  -4.752
  162   HG21  ILE  27          1HG2      ILE  27  -8.278  -1.773  -5.086
  163   HG22  ILE  27          2HG2      ILE  27  -9.395  -0.570  -5.728
  164   HG23  ILE  27          3HG2      ILE  27  -8.833  -0.449  -4.061
  165   HD11  ILE  27          3HD1      ILE  27  -7.999   0.960  -3.132
  166   HD12  ILE  27          1HD1      ILE  27  -6.939   2.252  -3.695
  167   HD13  ILE  27          2HD1      ILE  27  -6.403   1.167  -2.413
  168    H    ASN  28           H        ASN  28  -7.212   0.891  -8.712
  169    HA   ASN  28           HA       ASN  28  -9.513  -0.715  -9.579
  170    HB2  ASN  28           2HB      ASN  28  -8.513   2.039 -10.307
  171    HB3  ASN  28           1HB      ASN  28  -9.811   1.238 -11.190
  172   HD21  ASN  28          1HD2      ASN  28  -8.954   1.771  -7.713
  173   HD22  ASN  28          2HD2      ASN  28 -10.531   2.197  -7.250
  174    H    THR  29           H        THR  29  -6.370  -1.031 -10.010
  175    HA   THR  29           HA       THR  29  -6.672  -1.956 -12.795
  176    HB   THR  29           HB       THR  29  -4.379  -1.123 -13.290
  177    HG1  THR  29           1HG      THR  29  -4.275  -0.812 -10.730
  178   HG21  THR  29          3HG2      THR  29  -5.025   1.281 -13.446
  179   HG22  THR  29          1HG2      THR  29  -6.414   0.943 -12.413
  180   HG23  THR  29          2HG2      THR  29  -6.296   0.194 -14.006
  181    H    SER  30           H        SER  30  -4.493  -1.923  -9.968
  182    HA   SER  30           HA       SER  30  -3.453  -4.553 -10.685
  183    HB2  SER  30           2HB      SER  30  -2.170  -2.514  -9.608
  184    HB3  SER  30           1HB      SER  30  -2.804  -3.173  -8.103
  185    HG   SER  30           HG       SER  30  -1.875  -5.187  -8.724
  186    H    CYS  31           H        CYS  31  -3.196  -6.091  -8.703
  187    HA   CYS  31           HA       CYS  31  -5.409  -6.074  -6.839
  188    HB2  CYS  31           2HB      CYS  31  -6.518  -6.972  -8.830
  189    HB3  CYS  31           1HB      CYS  31  -5.259  -8.196  -8.993
  190    HG   CYS  31           HG       CYS  31  -6.108  -9.358  -6.859
  191    H    ASP  32           H        ASP  32  -4.646  -6.856  -4.997
  192    HA   ASP  32           HA       ASP  32  -3.224  -9.291  -4.757
  193    HB2  ASP  32           2HB      ASP  32  -1.498  -7.523  -5.706
  194    HB3  ASP  32           1HB      ASP  32  -1.442  -6.996  -4.026
  195    H    ILE  33           H        ILE  33  -3.208  -9.985  -2.659
  196    HA   ILE  33           HA       ILE  33  -4.854  -8.642  -0.783
  197    HB   ILE  33           HB       ILE  33  -2.849 -10.807  -0.141
  198   HG12  ILE  33          2HG1      ILE  33  -4.050 -11.576  -2.092
  199   HG13  ILE  33          1HG1      ILE  33  -4.756 -12.377  -0.689
  200   HG21  ILE  33          1HG2      ILE  33  -4.697 -11.444   1.463
  201   HG22  ILE  33          2HG2      ILE  33  -5.510  -9.943   1.020
  202   HG23  ILE  33          3HG2      ILE  33  -3.933  -9.892   1.807
  203   HD11  ILE  33          3HD1      ILE  33  -5.877 -10.090  -2.304
  204   HD12  ILE  33          1HD1      ILE  33  -6.435 -10.399  -0.659
  205   HD13  ILE  33          2HD1      ILE  33  -6.635 -11.630  -1.906
  206    H    GLU  34           H        GLU  34  -1.669  -8.112  -1.694
  207    HA   GLU  34           HA       GLU  34  -0.884  -7.006   0.922
  208    HB2  GLU  34           2HB      GLU  34   0.838  -7.217  -1.547
  209    HB3  GLU  34           1HB      GLU  34   1.354  -7.029   0.129
  210    HG2  GLU  34           2HG      GLU  34   0.004  -9.455  -1.088
  211    HG3  GLU  34           1HG      GLU  34   1.671  -9.348  -0.522
  212    H    LEU  35           H        LEU  35  -0.564  -6.035  -2.508
  213    HA   LEU  35           HA       LEU  35  -0.078  -3.331  -2.047
  214    HB2  LEU  35           2HB      LEU  35  -1.412  -4.713  -4.381
  215    HB3  LEU  35           1HB      LEU  35  -1.001  -3.001  -4.382
  216    HG   LEU  35           HG       LEU  35   0.978  -5.255  -3.931
  217   HD11  LEU  35          1HD1      LEU  35   0.772  -3.441  -6.340
  218   HD12  LEU  35          2HD1      LEU  35  -0.052  -4.999  -6.270
  219   HD13  LEU  35          3HD1      LEU  35   1.708  -4.925  -6.172
  220   HD21  LEU  35          3HD2      LEU  35   1.136  -2.266  -3.855
  221   HD22  LEU  35          1HD2      LEU  35   2.491  -3.132  -4.578
  222   HD23  LEU  35          2HD2      LEU  35   2.026  -3.461  -2.912
  223    H    LEU  36           H        LEU  36  -3.207  -4.921  -2.715
  224    HA   LEU  36           HA       LEU  36  -4.815  -2.641  -2.572
  225    HB2  LEU  36           2HB      LEU  36  -5.479  -5.473  -1.721
  226    HB3  LEU  36           1HB      LEU  36  -6.658  -4.194  -2.008
  227    HG   LEU  36           HG       LEU  36  -4.718  -5.305  -4.058
  228   HD11  LEU  36          1HD1      LEU  36  -6.425  -6.919  -3.764
  229   HD12  LEU  36          2HD1      LEU  36  -6.976  -5.958  -5.136
  230   HD13  LEU  36          3HD1      LEU  36  -7.667  -5.689  -3.537
  231   HD21  LEU  36          3HD2      LEU  36  -5.023  -3.125  -4.795
  232   HD22  LEU  36          1HD2      LEU  36  -6.605  -2.976  -4.029
  233   HD23  LEU  36          2HD2      LEU  36  -6.432  -3.891  -5.527
  234    H    ALA  37           H        ALA  37  -3.901  -4.907   0.019
  235    HA   ALA  37           HA       ALA  37  -5.259  -3.515   2.086
  236    HB1  ALA  37           1HB      ALA  37  -4.398  -5.904   2.166
  237    HB2  ALA  37           2HB      ALA  37  -4.071  -4.930   3.600
  238    HB3  ALA  37           3HB      ALA  37  -2.791  -5.225   2.424
  239    H    ALA  38           H        ALA  38  -2.041  -3.262   0.693
  240    HA   ALA  38           HA       ALA  38  -1.045  -1.438   2.682
  241    HB1  ALA  38           1HB      ALA  38   0.098  -1.711  -0.086
  242    HB2  ALA  38           2HB      ALA  38   0.290  -3.006   1.096
  243    HB3  ALA  38           3HB      ALA  38   0.935  -1.400   1.436
  244    H    CYS  39           H        CYS  39  -2.667  -1.173  -0.409
  245    HA   CYS  39           HA       CYS  39  -2.158   1.613  -0.803
  246    HB2  CYS  39           2HB      CYS  39  -2.798  -0.030  -2.604
  247    HB3  CYS  39           1HB      CYS  39  -4.434  -0.018  -1.942
  248    HG   CYS  39           HG       CYS  39  -4.837   2.164  -3.038
  249    H    ARG  40           H        ARG  40  -5.033  -0.198   0.283
  250    HA   ARG  40           HA       ARG  40  -6.733   1.935   0.770
  251    HB2  ARG  40           2HB      ARG  40  -6.446  -0.790   1.992
  252    HB3  ARG  40           1HB      ARG  40  -7.609   0.350   2.670
  253    HG2  ARG  40           2HG      ARG  40  -8.861   0.452   0.681
  254    HG3  ARG  40           1HG      ARG  40  -7.535  -0.172  -0.299
  255    HD2  ARG  40           2HD      ARG  40  -7.966  -2.361   0.268
  256    HD3  ARG  40           1HD      ARG  40  -8.558  -1.942   1.874
  257    HE   ARG  40           HE       ARG  40 -10.273  -1.092  -0.311
  258   HH11  ARG  40          1HH2      ARG  40  -9.426  -3.557   1.964
  259   HH12  ARG  40          2HH2      ARG  40 -10.982  -4.316   1.933
  260   HH21  ARG  40          1HH1      ARG  40 -12.318  -2.079  -0.357
  261   HH22  ARG  40          2HH1      ARG  40 -12.621  -3.479   0.619
  262    H    GLU  41           H        GLU  41  -4.037   0.765   2.687
  263    HA   GLU  41           HA       GLU  41  -4.598   2.063   5.113
  264    HB2  GLU  41           2HB      GLU  41  -2.023   1.245   3.772
  265    HB3  GLU  41           1HB      GLU  41  -2.028   2.061   5.336
  266    HG2  GLU  41           2HG      GLU  41  -3.720  -0.387   4.834
  267    HG3  GLU  41           1HG      GLU  41  -2.041  -0.519   5.350
  268    H    GLU  42           H        GLU  42  -2.756   3.187   2.278
  269    HA   GLU  42           HA       GLU  42  -2.169   5.757   3.353
  270    HB2  GLU  42           2HB      GLU  42  -2.213   4.692   0.525
  271    HB3  GLU  42           1HB      GLU  42  -1.707   6.332   0.930
  272    HG2  GLU  42           2HG      GLU  42  -0.491   3.862   2.184
  273    HG3  GLU  42           1HG      GLU  42   0.182   4.656   0.763
  274    H    PHE  43           H        PHE  43  -4.724   4.519   1.235
  275    HA   PHE  43           HA       PHE  43  -5.969   6.850   0.457
  276    HB2  PHE  43           2HB      PHE  43  -6.584   4.432  -0.115
  277    HB3  PHE  43           1HB      PHE  43  -7.517   4.431   1.381
  278    HD1  PHE  43           2HD      PHE  43  -7.123   6.102  -1.916
  279    HD2  PHE  43           1HD      PHE  43  -9.612   5.570   1.543
  280    HE1  PHE  43           2HE      PHE  43  -8.982   7.265  -3.075
  281    HE2  PHE  43           1HE      PHE  43 -11.471   6.732   0.386
  282    HZ   PHE  43           HZ       PHE  43 -11.156   7.581  -1.924
  283    H    HIS  44           H        HIS  44  -6.407   5.078   3.508
  284    HA   HIS  44           HA       HIS  44  -8.430   6.693   4.597
  285    HB2  HIS  44           2HB      HIS  44  -6.262   5.053   5.919
  286    HB3  HIS  44           1HB      HIS  44  -7.570   5.834   6.808
  287    HD2  HIS  44           2HD      HIS  44  -8.712   4.397   3.413
  288    HE1  HIS  44           1HE      HIS  44  -9.843   1.593   6.359
  289    HE2  HIS  44           2HE      HIS  44 -10.096   2.241   3.917
  290    H    ARG  45           H        ARG  45  -4.907   7.025   4.660
  291    HA   ARG  45           HA       ARG  45  -4.729   9.111   6.534
  292    HB2  ARG  45           2HB      ARG  45  -2.946   8.609   4.139
  293    HB3  ARG  45           1HB      ARG  45  -2.533   9.562   5.565
  294    HG2  ARG  45           2HG      ARG  45  -3.032   7.453   6.934
  295    HG3  ARG  45           1HG      ARG  45  -3.024   6.584   5.398
  296    HD2  ARG  45           2HD      ARG  45  -0.801   6.405   6.224
  297    HD3  ARG  45           1HD      ARG  45  -0.735   7.647   4.978
  298    HE   ARG  45           HE       ARG  45  -0.270   9.220   6.633
  299   HH11  ARG  45          1HH2      ARG  45  -1.382   6.238   7.990
  300   HH12  ARG  45          2HH2      ARG  45  -1.011   6.682   9.623
  301   HH21  ARG  45          1HH1      ARG  45   0.220   9.809   8.772
  302   HH22  ARG  45          2HH1      ARG  45  -0.104   8.705  10.065
  303    H    ARG  46           H        ARG  46  -5.542   9.123   3.123
  304    HA   ARG  46           HA       ARG  46  -5.232  11.931   2.718
  305    HB2  ARG  46           2HB      ARG  46  -7.167  10.248   1.152
  306    HB3  ARG  46           1HB      ARG  46  -6.151  11.579   0.598
  307    HG2  ARG  46           2HG      ARG  46  -5.215   8.818   1.421
  308    HG3  ARG  46           1HG      ARG  46  -5.211   9.483  -0.210
  309    HD2  ARG  46           2HD      ARG  46  -3.678  11.304   0.628
  310    HD3  ARG  46           1HD      ARG  46  -3.565  10.430   2.152
  311    HE   ARG  46           HE       ARG  46  -2.860   8.515   0.412
  312   HH11  ARG  46          1HH2      ARG  46  -1.970  11.851   0.674
  313   HH12  ARG  46          2HH2      ARG  46  -0.384  11.622   0.016
  314   HH21  ARG  46          1HH1      ARG  46  -0.781   8.209  -0.450
  315   HH22  ARG  46          2HH1      ARG  46   0.289   9.561  -0.620
  316    H    LEU  47           H        LEU  47  -8.097   9.885   3.308
  317    HA   LEU  47           HA       LEU  47 -10.049  11.853   3.307
  318    HB2  LEU  47           2HB      LEU  47  -9.751   9.218   4.695
  319    HB3  LEU  47           1HB      LEU  47 -11.080  10.272   5.177
  320    HG   LEU  47           HG       LEU  47 -11.831  10.406   2.830
  321   HD11  LEU  47          1HD1      LEU  47 -10.777   8.850   1.174
  322   HD12  LEU  47          2HD1      LEU  47  -9.512   8.511   2.355
  323   HD13  LEU  47          3HD1      LEU  47  -9.693  10.138   1.698
  324   HD21  LEU  47          3HD2      LEU  47 -11.384   7.532   3.694
  325   HD22  LEU  47          1HD2      LEU  47 -12.672   8.130   2.649
  326   HD23  LEU  47          2HD2      LEU  47 -12.640   8.582   4.353
  327    H    LYS  48           H        LYS  48  -7.783  10.954   5.856
  328    HA   LYS  48           HA       LYS  48  -8.869  12.350   8.007
  329    HB2  LYS  48           2HB      LYS  48  -6.921  10.829   8.159
  330    HB3  LYS  48           1HB      LYS  48  -5.934  12.038   7.339
  331    HG2  LYS  48           2HG      LYS  48  -6.045  13.543   9.139
  332    HG3  LYS  48           1HG      LYS  48  -7.481  12.775   9.819
  333    HD2  LYS  48           2HD      LYS  48  -4.959  11.164   9.603
  334    HD3  LYS  48           1HD      LYS  48  -5.092  12.358  10.894
  335    HE2  LYS  48           2HE      LYS  48  -7.304  10.368  10.403
  336    HE3  LYS  48           1HE      LYS  48  -5.904   9.943  11.386
  337    HZ1  LYS  48           3HZ      LYS  48  -7.807  12.172  11.848
  338    HZ2  LYS  48           1HZ      LYS  48  -6.362  11.973  12.713
  339    HZ3  LYS  48           2HZ      LYS  48  -7.582  10.795  12.817
  340    H    VAL  49           H        VAL  49  -6.401  13.508   5.697
  341    HA   VAL  49           HA       VAL  49  -6.651  16.229   6.649
  342    HB   VAL  49           HB       VAL  49  -5.242  15.390   4.123
  343   HG11  VAL  49          1HG1      VAL  49  -5.507  17.822   4.873
  344   HG12  VAL  49          2HG1      VAL  49  -3.854  17.278   4.584
  345   HG13  VAL  49          3HG1      VAL  49  -4.464  17.412   6.233
  346   HG21  VAL  49          3HG2      VAL  49  -3.247  14.952   5.565
  347   HG22  VAL  49          1HG2      VAL  49  -4.546  13.789   5.830
  348   HG23  VAL  49          2HG2      VAL  49  -4.283  15.093   6.986
  349    H    TYR  50           H        TYR  50  -9.133  15.331   5.826
  350    HA   TYR  50           HA       TYR  50  -9.751  17.271   3.770
  351    HB2  TYR  50           2HB      TYR  50  -9.225  14.674   2.922
  352    HB3  TYR  50           1HB      TYR  50 -10.984  14.719   3.032
  353    HD1  TYR  50           2HD      TYR  50  -8.021  16.420   1.556
  354    HD2  TYR  50           1HD      TYR  50 -12.292  15.962   1.470
  355    HE1  TYR  50           2HE      TYR  50  -8.117  17.712  -0.559
  356    HE2  TYR  50           1HE      TYR  50 -12.388  17.253  -0.645
  357    HH   TYR  50           HH       TYR  50  -9.628  17.952  -2.498
  358    H    HIS  51           H        HIS  51 -10.361  16.624   6.620
  359    HA   HIS  51           HA       HIS  51 -13.043  15.713   6.831
  360    HB2  HIS  51           2HB      HIS  51 -11.374  15.815   8.711
  361    HB3  HIS  51           1HB      HIS  51 -11.591  17.565   8.731
  362    HD2  HIS  51           2HD      HIS  51 -15.009  16.286   7.997
  363    HE1  HIS  51           1HE      HIS  51 -14.786  16.225  12.212
  364    HE2  HIS  51           2HE      HIS  51 -16.359  16.083  10.224
  Start of MODEL    5
    1    H1   GLY   9           H        GLY   9  11.742 -12.671   5.386
    2    HA2  GLY   9           2HA      GLY   9   9.090 -13.361   6.207
    3    HA3  GLY   9           1HA      GLY   9  10.073 -12.851   7.575
    4    H    THR  10           H        THR  10   7.771 -11.476   6.611
    5    HA   THR  10           HA       THR  10   7.038  -9.384   6.046
    6    HB   THR  10           HB       THR  10   9.676  -8.128   6.530
    7    HG1  THR  10           1HG      THR  10   9.627  -8.683   8.713
    8   HG21  THR  10          3HG2      THR  10   8.300  -6.744   8.035
    9   HG22  THR  10          1HG2      THR  10   6.927  -7.820   7.769
   10   HG23  THR  10          2HG2      THR  10   7.564  -6.856   6.436
   11    H    LYS  11           H        LYS  11   6.613  -8.919   4.003
   12    HA   LYS  11           HA       LYS  11   8.809  -8.126   2.228
   13    HB2  LYS  11           2HB      LYS  11   8.100  -9.569   0.455
   14    HB3  LYS  11           1HB      LYS  11   8.328 -10.559   1.896
   15    HG2  LYS  11           2HG      LYS  11   5.728  -9.946   2.233
   16    HG3  LYS  11           1HG      LYS  11   5.804  -9.836   0.476
   17    HD2  LYS  11           2HD      LYS  11   6.930 -12.111   0.490
   18    HD3  LYS  11           1HD      LYS  11   6.515 -12.216   2.202
   19    HE2  LYS  11           2HE      LYS  11   4.521 -11.777  -0.043
   20    HE3  LYS  11           1HE      LYS  11   4.810 -13.318   0.766
   21    HZ1  LYS  11           3HZ      LYS  11   3.330 -12.683   2.270
   22    HZ2  LYS  11           1HZ      LYS  11   3.225 -11.122   1.614
   23    HZ3  LYS  11           2HZ      LYS  11   4.412 -11.476   2.776
   24    H    LYS  12           H        LYS  12   7.046  -6.439   3.482
   25    HA   LYS  12           HA       LYS  12   4.788  -5.844   1.788
   26    HB2  LYS  12           2HB      LYS  12   6.072  -4.458   4.140
   27    HB3  LYS  12           1HB      LYS  12   4.748  -3.723   3.235
   28    HG2  LYS  12           2HG      LYS  12   3.972  -5.022   5.232
   29    HG3  LYS  12           1HG      LYS  12   3.300  -5.616   3.713
   30    HD2  LYS  12           2HD      LYS  12   4.732  -7.497   3.675
   31    HD3  LYS  12           1HD      LYS  12   5.835  -6.791   4.859
   32    HE2  LYS  12           2HE      LYS  12   4.448  -8.541   5.898
   33    HE3  LYS  12           1HE      LYS  12   4.079  -6.961   6.590
   34    HZ1  LYS  12           3HZ      LYS  12   2.365  -8.737   5.220
   35    HZ2  LYS  12           1HZ      LYS  12   2.441  -7.267   4.377
   36    HZ3  LYS  12           2HZ      LYS  12   1.982  -7.284   6.013
   37    H    TYR  13           H        TYR  13   4.781  -3.155   1.486
   38    HA   TYR  13           HA       TYR  13   7.139  -2.596  -0.222
   39    HB2  TYR  13           2HB      TYR  13   4.294  -1.722  -0.765
   40    HB3  TYR  13           1HB      TYR  13   5.692  -1.518  -1.821
   41    HD1  TYR  13           2HD      TYR  13   6.720  -3.462  -2.946
   42    HD2  TYR  13           1HD      TYR  13   3.183  -3.864  -0.543
   43    HE1  TYR  13           2HE      TYR  13   6.305  -5.701  -3.931
   44    HE2  TYR  13           1HE      TYR  13   2.768  -6.102  -1.527
   45    HH   TYR  13           HH       TYR  13   3.599  -7.723  -2.818
   46    H    ASP  14           H        ASP  14   7.763  -0.398  -0.400
   47    HA   ASP  14           HA       ASP  14   7.069   1.187   1.975
   48    HB2  ASP  14           2HB      ASP  14   9.271   1.575  -0.066
   49    HB3  ASP  14           1HB      ASP  14   9.065   2.496   1.424
   50    H    LEU  15           H        LEU  15   5.375   2.492   1.699
   51    HA   LEU  15           HA       LEU  15   4.959   3.808  -0.903
   52    HB2  LEU  15           2HB      LEU  15   3.078   3.941   1.446
   53    HB3  LEU  15           1HB      LEU  15   2.717   4.131  -0.270
   54    HG   LEU  15           HG       LEU  15   3.546   1.565   1.119
   55   HD11  LEU  15          1HD1      LEU  15   1.250   0.871   0.211
   56   HD12  LEU  15          2HD1      LEU  15   0.958   2.588  -0.071
   57   HD13  LEU  15          3HD1      LEU  15   1.244   1.999   1.567
   58   HD21  LEU  15          3HD2      LEU  15   3.027   0.589  -1.181
   59   HD22  LEU  15          1HD2      LEU  15   4.511   1.536  -1.081
   60   HD23  LEU  15          2HD2      LEU  15   3.061   2.241  -1.794
   61    H    SER  16           H        SER  16   7.135   4.686   0.635
   62    HA   SER  16           HA       SER  16   6.996   6.669   2.433
   63    HB2  SER  16           2HB      SER  16   8.826   7.842   1.168
   64    HB3  SER  16           1HB      SER  16   9.104   6.121   1.423
   65    HG   SER  16           HG       SER  16   8.261   5.788  -0.699
   66    H    LYS  17           H        LYS  17   5.934   6.948  -0.922
   67    HA   LYS  17           HA       LYS  17   4.219   9.162  -0.253
   68    HB2  LYS  17           2HB      LYS  17   5.224  10.774  -1.817
   69    HB3  LYS  17           1HB      LYS  17   6.339  10.366  -0.517
   70    HG2  LYS  17           2HG      LYS  17   7.820   9.996  -2.218
   71    HG3  LYS  17           1HG      LYS  17   6.993   8.447  -2.349
   72    HD2  LYS  17           2HD      LYS  17   6.832   9.168  -4.546
   73    HD3  LYS  17           1HD      LYS  17   5.339   9.846  -3.904
   74    HE2  LYS  17           2HE      LYS  17   7.972  11.341  -4.091
   75    HE3  LYS  17           1HE      LYS  17   6.641  11.503  -5.235
   76    HZ1  LYS  17           3HZ      LYS  17   6.274  13.223  -3.764
   77    HZ2  LYS  17           1HZ      LYS  17   6.762  12.326  -2.410
   78    HZ3  LYS  17           2HZ      LYS  17   5.262  12.006  -3.143
   79    H    TRP  18           H        TRP  18   2.465   9.068  -1.502
   80    HA   TRP  18           HA       TRP  18   2.664   7.913  -4.205
   81    HB2  TRP  18           2HB      TRP  18   1.006   6.909  -1.918
   82    HB3  TRP  18           1HB      TRP  18   0.352   6.807  -3.550
   83    HD1  TRP  18           HD       TRP  18   3.628   5.874  -1.710
   84    HE1  TRP  18           1HE      TRP  18   4.525   3.686  -2.733
   85    HE3  TRP  18           3HE      TRP  18   0.149   5.123  -5.369
   86    HZ2  TRP  18           2HZ      TRP  18   3.853   1.855  -4.825
   87    HZ3  TRP  18           3HZ      TRP  18   0.299   3.149  -6.861
   88    HH2  TRP  18           HH       TRP  18   2.145   1.515  -6.593
   89    H    LYS  19           H        LYS  19   0.570   8.264  -5.420
   90    HA   LYS  19           HA       LYS  19  -0.438  10.973  -4.803
   91    HB2  LYS  19           2HB      LYS  19  -0.307   9.436  -7.408
   92    HB3  LYS  19           1HB      LYS  19  -1.087  11.004  -7.222
   93    HG2  LYS  19           2HG      LYS  19   1.000  11.743  -7.860
   94    HG3  LYS  19           1HG      LYS  19   1.294  11.615  -6.128
   95    HD2  LYS  19           2HD      LYS  19   2.026   9.191  -6.605
   96    HD3  LYS  19           1HD      LYS  19   2.073   9.669  -8.302
   97    HE2  LYS  19           2HE      LYS  19   3.582  11.579  -7.633
   98    HE3  LYS  19           1HE      LYS  19   3.660  10.872  -6.020
   99    HZ1  LYS  19           3HZ      LYS  19   4.209   9.126  -8.299
  100    HZ2  LYS  19           1HZ      LYS  19   4.882   9.119  -6.740
  101    HZ3  LYS  19           2HZ      LYS  19   5.399  10.267  -7.882
  102    H    TYR  20           H        TYR  20  -2.601  11.387  -4.673
  103    HA   TYR  20           HA       TYR  20  -4.355   9.450  -3.753
  104    HB2  TYR  20           2HB      TYR  20  -4.603  11.987  -3.647
  105    HB3  TYR  20           1HB      TYR  20  -5.247  11.893  -5.287
  106    HD1  TYR  20           1HD      TYR  20  -7.254  10.372  -5.724
  107    HD2  TYR  20           2HD      TYR  20  -5.965  11.473  -1.777
  108    HE1  TYR  20           1HE      TYR  20  -9.473   9.732  -4.821
  109    HE2  TYR  20           2HE      TYR  20  -8.185  10.833  -0.874
  110    HH   TYR  20           HH       TYR  20 -10.402  10.462  -1.545
  111    H    ALA  21           H        ALA  21  -3.577  10.366  -7.035
  112    HA   ALA  21           HA       ALA  21  -5.796   8.947  -8.221
  113    HB1  ALA  21           1HB      ALA  21  -3.280  10.157  -9.385
  114    HB2  ALA  21           2HB      ALA  21  -4.910  10.829  -9.428
  115    HB3  ALA  21           3HB      ALA  21  -4.530   9.377 -10.354
  116    H    GLU  22           H        GLU  22  -2.316   8.381  -7.797
  117    HA   GLU  22           HA       GLU  22  -2.174   5.937  -9.194
  118    HB2  GLU  22           2HB      GLU  22  -0.517   7.100  -6.956
  119    HB3  GLU  22           1HB      GLU  22  -0.137   5.553  -7.712
  120    HG2  GLU  22           2HG      GLU  22  -0.531   8.085  -9.316
  121    HG3  GLU  22           1HG      GLU  22   1.045   7.597  -8.693
  122    H    LEU  23           H        LEU  23  -2.773   6.652  -5.767
  123    HA   LEU  23           HA       LEU  23  -2.844   4.031  -4.796
  124    HB2  LEU  23           2HB      LEU  23  -4.421   6.456  -3.911
  125    HB3  LEU  23           1HB      LEU  23  -4.286   4.960  -2.988
  126    HG   LEU  23           HG       LEU  23  -1.919   6.634  -3.868
  127   HD11  LEU  23          1HD1      LEU  23  -3.498   6.567  -1.293
  128   HD12  LEU  23          2HD1      LEU  23  -3.089   7.966  -2.282
  129   HD13  LEU  23          3HD1      LEU  23  -1.833   7.146  -1.354
  130   HD21  LEU  23          3HD2      LEU  23  -1.066   4.494  -3.477
  131   HD22  LEU  23          1HD2      LEU  23  -2.280   4.121  -2.253
  132   HD23  LEU  23          2HD2      LEU  23  -0.943   5.205  -1.870
  133    H    ARG  24           H        ARG  24  -5.513   6.047  -6.025
  134    HA   ARG  24           HA       ARG  24  -7.482   3.999  -5.774
  135    HB2  ARG  24           2HB      ARG  24  -7.878   6.519  -5.931
  136    HB3  ARG  24           1HB      ARG  24  -7.607   6.349  -7.665
  137    HG2  ARG  24           2HG      ARG  24  -9.905   6.051  -7.601
  138    HG3  ARG  24           1HG      ARG  24  -9.383   4.380  -7.402
  139    HD2  ARG  24           2HD      ARG  24  -9.424   4.860  -4.868
  140    HD3  ARG  24           1HD      ARG  24 -10.339   6.305  -5.284
  141    HE   ARG  24           HE       ARG  24 -11.339   3.633  -5.239
  142   HH11  ARG  24          1HH2      ARG  24 -11.484   6.644  -6.938
  143   HH12  ARG  24          2HH2      ARG  24 -13.099   6.400  -7.515
  144   HH21  ARG  24          1HH1      ARG  24 -13.458   3.306  -5.992
  145   HH22  ARG  24          2HH1      ARG  24 -14.216   4.510  -6.979
  146    H    ASP  25           H        ASP  25  -5.371   5.084  -8.388
  147    HA   ASP  25           HA       ASP  25  -6.548   3.557 -10.462
  148    HB2  ASP  25           2HB      ASP  25  -4.914   5.458 -10.747
  149    HB3  ASP  25           1HB      ASP  25  -3.640   4.352 -10.239
  150    H    THR  26           H        THR  26  -3.738   2.906  -8.365
  151    HA   THR  26           HA       THR  26  -3.004   0.426  -9.377
  152    HB   THR  26           HB       THR  26  -2.959   1.168  -6.447
  153    HG1  THR  26           1HG      THR  26  -1.495   2.581  -6.920
  154   HG21  THR  26          3HG2      THR  26  -1.096  -0.515  -8.144
  155   HG22  THR  26          1HG2      THR  26  -2.341  -1.166  -7.078
  156   HG23  THR  26          2HG2      THR  26  -0.986  -0.262  -6.402
  157    H    ILE  27           H        ILE  27  -5.519   1.234  -7.021
  158    HA   ILE  27           HA       ILE  27  -6.188  -1.489  -6.429
  159    HB   ILE  27           HB       ILE  27  -7.744   1.076  -6.017
  160   HG12  ILE  27          2HG1      ILE  27  -6.209  -0.602  -4.015
  161   HG13  ILE  27          1HG1      ILE  27  -5.504   0.789  -4.838
  162   HG21  ILE  27          1HG2      ILE  27  -8.216  -1.782  -5.159
  163   HG22  ILE  27          2HG2      ILE  27  -9.342  -0.676  -5.948
  164   HG23  ILE  27          3HG2      ILE  27  -8.894  -0.424  -4.260
  165   HD11  ILE  27          3HD1      ILE  27  -6.629   1.139  -2.500
  166   HD12  ILE  27          1HD1      ILE  27  -8.139   1.069  -3.411
  167   HD13  ILE  27          2HD1      ILE  27  -6.941   2.308  -3.783
  168    H    ASN  28           H        ASN  28  -7.275   0.902  -8.762
  169    HA   ASN  28           HA       ASN  28  -9.441  -0.831  -9.692
  170    HB2  ASN  28           2HB      ASN  28  -8.538   1.946 -10.460
  171    HB3  ASN  28           1HB      ASN  28  -9.816   1.081 -11.313
  172   HD21  ASN  28          1HD2      ASN  28  -8.941   1.769  -7.869
  173   HD22  ASN  28          2HD2      ASN  28 -10.530   2.133  -7.396
  174    H    THR  29           H        THR  29  -6.297  -1.067 -10.052
  175    HA   THR  29           HA       THR  29  -6.496  -1.947 -12.865
  176    HB   THR  29           HB       THR  29  -4.121  -1.158 -13.168
  177    HG1  THR  29           1HG      THR  29  -3.788   0.686 -11.560
  178   HG21  THR  29          3HG2      THR  29  -5.167   1.421 -12.760
  179   HG22  THR  29          1HG2      THR  29  -6.570   0.407 -13.097
  180   HG23  THR  29          2HG2      THR  29  -5.238   0.480 -14.250
  181    H    SER  30           H        SER  30  -4.354  -1.993 -10.005
  182    HA   SER  30           HA       SER  30  -3.362  -4.631 -10.725
  183    HB2  SER  30           2HB      SER  30  -2.069  -2.645  -9.586
  184    HB3  SER  30           1HB      SER  30  -2.770  -3.296  -8.107
  185    HG   SER  30           HG       SER  30  -0.779  -4.281  -9.705
  186    H    CYS  31           H        CYS  31  -3.151  -6.169  -8.706
  187    HA   CYS  31           HA       CYS  31  -5.453  -6.177  -6.952
  188    HB2  CYS  31           2HB      CYS  31  -6.267  -7.114  -9.177
  189    HB3  CYS  31           1HB      CYS  31  -5.181  -8.473  -8.892
  190    HG   CYS  31           HG       CYS  31  -7.768  -7.878  -7.308
  191    H    ASP  32           H        ASP  32  -4.768  -6.951  -5.070
  192    HA   ASP  32           HA       ASP  32  -3.322  -9.366  -4.766
  193    HB2  ASP  32           2HB      ASP  32  -1.588  -7.551  -5.627
  194    HB3  ASP  32           1HB      ASP  32  -1.609  -7.057  -3.937
  195    H    ILE  33           H        ILE  33  -2.955  -9.898  -2.537
  196    HA   ILE  33           HA       ILE  33  -4.837  -8.585  -0.766
  197    HB   ILE  33           HB       ILE  33  -2.951 -10.899  -0.256
  198   HG12  ILE  33          2HG1      ILE  33  -4.851 -11.040  -2.080
  199   HG13  ILE  33          1HG1      ILE  33  -4.657 -12.353  -0.921
  200   HG21  ILE  33          1HG2      ILE  33  -4.780 -11.327   1.547
  201   HG22  ILE  33          2HG2      ILE  33  -5.177  -9.624   1.325
  202   HG23  ILE  33          3HG2      ILE  33  -3.564 -10.091   1.863
  203   HD11  ILE  33          3HD1      ILE  33  -6.502 -10.045  -0.320
  204   HD12  ILE  33          1HD1      ILE  33  -6.518 -11.676   0.349
  205   HD13  ILE  33          2HD1      ILE  33  -7.046 -11.398  -1.311
  206    H    GLU  34           H        GLU  34  -1.678  -8.034  -1.624
  207    HA   GLU  34           HA       GLU  34  -0.907  -7.018   1.038
  208    HB2  GLU  34           2HB      GLU  34   0.802  -7.376  -1.433
  209    HB3  GLU  34           1HB      GLU  34   1.364  -6.961   0.187
  210    HG2  GLU  34           2HG      GLU  34   0.585  -9.108   1.050
  211    HG3  GLU  34           1HG      GLU  34  -0.097  -9.521  -0.524
  212    H    LEU  35           H        LEU  35  -0.514  -6.026  -2.377
  213    HA   LEU  35           HA       LEU  35   0.032  -3.340  -1.900
  214    HB2  LEU  35           2HB      LEU  35  -1.182  -4.804  -4.226
  215    HB3  LEU  35           1HB      LEU  35  -1.060  -3.048  -4.256
  216    HG   LEU  35           HG       LEU  35   1.286  -4.887  -3.704
  217   HD11  LEU  35          1HD1      LEU  35   0.637  -3.422  -6.275
  218   HD12  LEU  35          2HD1      LEU  35   0.290  -5.132  -6.015
  219   HD13  LEU  35          3HD1      LEU  35   1.959  -4.558  -5.996
  220   HD21  LEU  35          3HD2      LEU  35   2.357  -2.580  -4.604
  221   HD22  LEU  35          1HD2      LEU  35   2.009  -2.850  -2.898
  222   HD23  LEU  35          2HD2      LEU  35   0.882  -1.931  -3.893
  223    H    LEU  36           H        LEU  36  -3.134  -4.838  -2.603
  224    HA   LEU  36           HA       LEU  36  -4.699  -2.540  -2.452
  225    HB2  LEU  36           2HB      LEU  36  -5.403  -5.354  -1.579
  226    HB3  LEU  36           1HB      LEU  36  -6.565  -4.059  -1.864
  227    HG   LEU  36           HG       LEU  36  -4.638  -5.162  -3.932
  228   HD11  LEU  36          1HD1      LEU  36  -7.649  -5.417  -3.901
  229   HD12  LEU  36          2HD1      LEU  36  -6.609  -6.629  -3.153
  230   HD13  LEU  36          3HD1      LEU  36  -6.489  -6.309  -4.882
  231   HD21  LEU  36          3HD2      LEU  36  -6.411  -3.813  -5.385
  232   HD22  LEU  36          1HD2      LEU  36  -5.029  -2.990  -4.663
  233   HD23  LEU  36          2HD2      LEU  36  -6.611  -2.901  -3.889
  234    H    ALA  37           H        ALA  37  -3.792  -4.789   0.155
  235    HA   ALA  37           HA       ALA  37  -5.129  -3.376   2.221
  236    HB1  ALA  37           1HB      ALA  37  -2.664  -5.095   2.545
  237    HB2  ALA  37           2HB      ALA  37  -4.280  -5.763   2.319
  238    HB3  ALA  37           3HB      ALA  37  -3.924  -4.780   3.737
  239    H    ALA  38           H        ALA  38  -1.962  -3.083   0.748
  240    HA   ALA  38           HA       ALA  38  -0.895  -1.303   2.738
  241    HB1  ALA  38           1HB      ALA  38   0.096  -1.548  -0.097
  242    HB2  ALA  38           2HB      ALA  38   0.417  -2.797   1.106
  243    HB3  ALA  38           3HB      ALA  38   1.012  -1.158   1.358
  244    H    CYS  39           H        CYS  39  -2.529  -0.954  -0.363
  245    HA   CYS  39           HA       CYS  39  -2.119   1.868  -0.591
  246    HB2  CYS  39           2HB      CYS  39  -2.592   0.552  -2.572
  247    HB3  CYS  39           1HB      CYS  39  -4.132   0.020  -1.894
  248    HG   CYS  39           HG       CYS  39  -3.979   2.385  -3.528
  249    H    ARG  40           H        ARG  40  -4.920  -0.121   0.365
  250    HA   ARG  40           HA       ARG  40  -6.755   1.868   0.905
  251    HB2  ARG  40           2HB      ARG  40  -6.266  -0.772   2.288
  252    HB3  ARG  40           1HB      ARG  40  -7.643   0.265   2.667
  253    HG2  ARG  40           2HG      ARG  40  -8.476   0.120   0.416
  254    HG3  ARG  40           1HG      ARG  40  -6.999  -0.669  -0.140
  255    HD2  ARG  40           2HD      ARG  40  -8.664  -2.386   0.128
  256    HD3  ARG  40           1HD      ARG  40  -7.512  -2.560   1.450
  257    HE   ARG  40           HE       ARG  40  -9.417  -0.969   2.539
  258   HH11  ARG  40          1HH2      ARG  40  -9.502  -3.926   0.743
  259   HH12  ARG  40          2HH2      ARG  40 -10.936  -4.515   1.516
  260   HH21  ARG  40          1HH1      ARG  40 -11.298  -1.734   3.555
  261   HH22  ARG  40          2HH1      ARG  40 -11.953  -3.273   3.108
  262    H    GLU  41           H        GLU  41  -3.983   0.861   2.813
  263    HA   GLU  41           HA       GLU  41  -4.648   2.137   5.239
  264    HB2  GLU  41           2HB      GLU  41  -2.028   1.370   3.961
  265    HB3  GLU  41           1HB      GLU  41  -2.086   2.197   5.520
  266    HG2  GLU  41           2HG      GLU  41  -3.277   0.420   6.544
  267    HG3  GLU  41           1HG      GLU  41  -3.703  -0.298   4.990
  268    H    GLU  42           H        GLU  42  -2.782   3.290   2.433
  269    HA   GLU  42           HA       GLU  42  -2.326   5.893   3.529
  270    HB2  GLU  42           2HB      GLU  42  -2.158   4.853   0.690
  271    HB3  GLU  42           1HB      GLU  42  -1.636   6.461   1.195
  272    HG2  GLU  42           2HG      GLU  42  -0.590   3.898   2.417
  273    HG3  GLU  42           1HG      GLU  42   0.219   4.754   1.107
  274    H    PHE  43           H        PHE  43  -4.547   4.632   1.048
  275    HA   PHE  43           HA       PHE  43  -5.836   6.950   0.307
  276    HB2  PHE  43           2HB      PHE  43  -6.197   4.565  -0.552
  277    HB3  PHE  43           1HB      PHE  43  -7.327   4.373   0.788
  278    HD1  PHE  43           1HD      PHE  43  -9.374   5.760   0.924
  279    HD2  PHE  43           2HD      PHE  43  -6.716   5.979  -2.443
  280    HE1  PHE  43           1HE      PHE  43 -11.129   6.927  -0.384
  281    HE2  PHE  43           2HE      PHE  43  -8.470   7.146  -3.753
  282    HZ   PHE  43           HZ       PHE  43 -10.677   7.619  -2.722
  283    H    HIS  44           H        HIS  44  -6.269   5.045   3.236
  284    HA   HIS  44           HA       HIS  44  -8.623   6.404   4.130
  285    HB2  HIS  44           2HB      HIS  44  -6.585   4.687   5.552
  286    HB3  HIS  44           1HB      HIS  44  -8.012   5.351   6.345
  287    HD2  HIS  44           2HD      HIS  44  -9.053   4.444   2.833
  288    HE1  HIS  44           1HE      HIS  44  -9.821   0.983   5.123
  289    HE2  HIS  44           2HE      HIS  44 -10.234   2.116   2.889
  290    H    ARG  45           H        ARG  45  -5.161   6.875   4.598
  291    HA   ARG  45           HA       ARG  45  -5.308   8.743   6.711
  292    HB2  ARG  45           2HB      ARG  45  -3.238   8.276   4.562
  293    HB3  ARG  45           1HB      ARG  45  -3.025   9.450   5.862
  294    HG2  ARG  45           2HG      ARG  45  -3.321   7.671   7.536
  295    HG3  ARG  45           1HG      ARG  45  -3.560   6.490   6.247
  296    HD2  ARG  45           2HD      ARG  45  -1.311   6.800   5.445
  297    HD3  ARG  45           1HD      ARG  45  -1.063   8.182   6.509
  298    HE   ARG  45           HE       ARG  45  -1.719   5.770   7.944
  299   HH11  ARG  45          1HH2      ARG  45   0.777   7.602   6.398
  300   HH12  ARG  45          2HH2      ARG  45   2.056   6.923   7.348
  301   HH21  ARG  45          1HH1      ARG  45  -0.047   4.874   9.195
  302   HH22  ARG  45          2HH1      ARG  45   1.589   5.379   8.931
  303    H    ARG  46           H        ARG  46  -5.904   9.036   3.310
  304    HA   ARG  46           HA       ARG  46  -5.511  11.852   3.088
  305    HB2  ARG  46           2HB      ARG  46  -7.432  10.321   1.360
  306    HB3  ARG  46           1HB      ARG  46  -6.361  11.652   0.922
  307    HG2  ARG  46           2HG      ARG  46  -5.526   8.821   1.618
  308    HG3  ARG  46           1HG      ARG  46  -5.456   9.572   0.026
  309    HD2  ARG  46           2HD      ARG  46  -3.901  11.300   0.994
  310    HD3  ARG  46           1HD      ARG  46  -3.866  10.360   2.482
  311    HE   ARG  46           HE       ARG  46  -3.137   8.493   0.721
  312   HH11  ARG  46          1HH2      ARG  46  -2.210  11.816   1.031
  313   HH12  ARG  46          2HH2      ARG  46  -0.622  11.575   0.385
  314   HH21  ARG  46          1HH1      ARG  46  -1.052   8.173  -0.123
  315   HH22  ARG  46          2HH1      ARG  46   0.032   9.514  -0.269
  316    H    LEU  47           H        LEU  47  -8.395   9.830   3.608
  317    HA   LEU  47           HA       LEU  47 -10.328  11.839   3.609
  318    HB2  LEU  47           2HB      LEU  47 -10.115   9.177   4.988
  319    HB3  LEU  47           1HB      LEU  47 -11.481  10.239   5.329
  320    HG   LEU  47           HG       LEU  47 -12.099  10.296   2.984
  321   HD11  LEU  47          1HD1      LEU  47  -9.997  10.295   1.866
  322   HD12  LEU  47          2HD1      LEU  47 -10.769   8.779   1.398
  323   HD13  LEU  47          3HD1      LEU  47  -9.506   8.783   2.630
  324   HD21  LEU  47          3HD2      LEU  47 -11.427   7.428   3.703
  325   HD22  LEU  47          1HD2      LEU  47 -12.750   7.989   2.681
  326   HD23  LEU  47          2HD2      LEU  47 -12.773   8.317   4.415
  327    H    LYS  48           H        LYS  48  -7.952  10.994   6.017
  328    HA   LYS  48           HA       LYS  48  -9.079  12.206   8.282
  329    HB2  LYS  48           2HB      LYS  48  -6.980  10.746   8.123
  330    HB3  LYS  48           1HB      LYS  48  -6.130  12.221   7.661
  331    HG2  LYS  48           2HG      LYS  48  -6.746  13.306   9.732
  332    HG3  LYS  48           1HG      LYS  48  -7.802  11.964  10.178
  333    HD2  LYS  48           2HD      LYS  48  -4.918  11.384   9.605
  334    HD3  LYS  48           1HD      LYS  48  -5.337  12.122  11.150
  335    HE2  LYS  48           2HE      LYS  48  -6.957  10.294  11.571
  336    HE3  LYS  48           1HE      LYS  48  -6.494   9.545  10.045
  337    HZ1  LYS  48           3HZ      LYS  48  -5.223   8.483  11.680
  338    HZ2  LYS  48           1HZ      LYS  48  -4.838   9.936  12.464
  339    HZ3  LYS  48           2HZ      LYS  48  -4.152   9.581  10.949
  340    H    VAL  49           H        VAL  49  -6.820  13.556   5.874
  341    HA   VAL  49           HA       VAL  49  -7.091  16.221   6.991
  342    HB   VAL  49           HB       VAL  49  -5.818  15.789   4.327
  343   HG11  VAL  49          1HG1      VAL  49  -4.679  17.122   6.783
  344   HG12  VAL  49          2HG1      VAL  49  -5.881  17.941   5.785
  345   HG13  VAL  49          3HG1      VAL  49  -4.336  17.459   5.085
  346   HG21  VAL  49          3HG2      VAL  49  -3.755  14.939   5.536
  347   HG22  VAL  49          1HG2      VAL  49  -5.078  13.777   5.423
  348   HG23  VAL  49          2HG2      VAL  49  -4.788  14.638   6.934
  349    H    TYR  50           H        TYR  50  -6.976  17.618   4.468
  350    HA   TYR  50           HA       TYR  50  -8.548  18.821   3.258
  351    HB2  TYR  50           2HB      TYR  50  -9.390  16.074   2.335
  352    HB3  TYR  50           1HB      TYR  50  -9.374  17.578   1.412
  353    HD1  TYR  50           1HD      TYR  50  -6.912  18.802   1.579
  354    HD2  TYR  50           2HD      TYR  50  -7.685  14.581   1.789
  355    HE1  TYR  50           1HE      TYR  50  -4.588  18.339   0.851
  356    HE2  TYR  50           2HE      TYR  50  -5.360  14.119   1.060
  357    HH   TYR  50           HH       TYR  50  -3.151  15.304   1.111
  358    H    HIS  51           H        HIS  51  -9.499  18.500   5.830
  359    HA   HIS  51           HA       HIS  51 -12.123  17.356   5.893
  360    HB2  HIS  51           2HB      HIS  51 -12.304  18.695   8.039
  361    HB3  HIS  51           1HB      HIS  51 -10.963  17.550   7.972
  362    HD2  HIS  51           2HD      HIS  51  -8.730  18.815   8.966
  363    HE1  HIS  51           1HE      HIS  51  -9.462  22.674   7.417
  364    HE2  HIS  51           2HE      HIS  51  -7.838  21.261   8.762
  Start of MODEL    6
    1    H1   GLY   9           H        GLY   9   8.757 -14.657  -0.330
    2    HA2  GLY   9           2HA      GLY   9   7.397 -16.437  -2.166
    3    HA3  GLY   9           1HA      GLY   9   6.675 -16.367  -0.561
    4    H    THR  10           H        THR  10   7.895 -13.451  -0.652
    5    HA   THR  10           HA       THR  10   6.061 -12.140  -2.484
    6    HB   THR  10           HB       THR  10   4.688 -12.653  -0.444
    7    HG1  THR  10           1HG      THR  10   4.954 -10.428  -1.782
    8   HG21  THR  10          3HG2      THR  10   6.447 -10.621   0.935
    9   HG22  THR  10          1HG2      THR  10   6.715 -12.356   1.100
   10   HG23  THR  10          2HG2      THR  10   5.197 -11.644   1.648
   11    H    LYS  11           H        LYS  11   6.118  -9.641  -1.162
   12    HA   LYS  11           HA       LYS  11   8.739  -8.849  -0.414
   13    HB2  LYS  11           2HB      LYS  11   8.998  -9.390  -2.908
   14    HB3  LYS  11           1HB      LYS  11   7.999  -7.967  -3.202
   15    HG2  LYS  11           2HG      LYS  11   9.587  -6.566  -1.967
   16    HG3  LYS  11           1HG      LYS  11  10.574  -7.982  -1.598
   17    HD2  LYS  11           2HD      LYS  11  10.713  -8.338  -4.143
   18    HD3  LYS  11           1HD      LYS  11  10.090  -6.694  -4.288
   19    HE2  LYS  11           2HE      LYS  11  12.582  -7.483  -2.750
   20    HE3  LYS  11           1HE      LYS  11  12.568  -6.735  -4.347
   21    HZ1  LYS  11           3HZ      LYS  11  11.046  -5.021  -3.067
   22    HZ2  LYS  11           1HZ      LYS  11  12.737  -4.882  -3.083
   23    HZ3  LYS  11           2HZ      LYS  11  11.955  -5.573  -1.742
   24    H    LYS  12           H        LYS  12   7.952  -7.481   1.086
   25    HA   LYS  12           HA       LYS  12   5.638  -5.967   1.006
   26    HB2  LYS  12           2HB      LYS  12   8.270  -5.547   2.411
   27    HB3  LYS  12           1HB      LYS  12   6.938  -4.408   2.604
   28    HG2  LYS  12           2HG      LYS  12   6.852  -6.077   4.389
   29    HG3  LYS  12           1HG      LYS  12   5.469  -6.288   3.315
   30    HD2  LYS  12           2HD      LYS  12   6.413  -8.196   2.282
   31    HD3  LYS  12           1HD      LYS  12   8.026  -7.834   2.894
   32    HE2  LYS  12           2HE      LYS  12   7.063  -9.669   4.185
   33    HE3  LYS  12           1HE      LYS  12   7.200  -8.242   5.212
   34    HZ1  LYS  12           3HZ      LYS  12   4.723  -8.845   3.718
   35    HZ2  LYS  12           1HZ      LYS  12   4.927  -7.820   5.053
   36    HZ3  LYS  12           2HZ      LYS  12   5.016  -9.505   5.256
   37    H    TYR  13           H        TYR  13   5.975  -3.363   1.263
   38    HA   TYR  13           HA       TYR  13   7.563  -2.304  -0.948
   39    HB2  TYR  13           2HB      TYR  13   4.612  -1.698  -0.862
   40    HB3  TYR  13           1HB      TYR  13   5.760  -1.393  -2.166
   41    HD1  TYR  13           2HD      TYR  13   6.573  -3.226  -3.591
   42    HD2  TYR  13           1HD      TYR  13   3.673  -3.911  -0.497
   43    HE1  TYR  13           2HE      TYR  13   6.039  -5.436  -4.581
   44    HE2  TYR  13           1HE      TYR  13   3.138  -6.121  -1.488
   45    HH   TYR  13           HH       TYR  13   3.820  -7.002  -4.490
   46    H    ASP  14           H        ASP  14   7.888  -0.054  -0.828
   47    HA   ASP  14           HA       ASP  14   7.234   1.106   1.811
   48    HB2  ASP  14           2HB      ASP  14   9.116   2.700   1.230
   49    HB3  ASP  14           1HB      ASP  14   9.596   1.022   1.477
   50    H    LEU  15           H        LEU  15   5.459   2.332   1.707
   51    HA   LEU  15           HA       LEU  15   4.892   3.890  -0.718
   52    HB2  LEU  15           2HB      LEU  15   3.121   3.788   1.709
   53    HB3  LEU  15           1HB      LEU  15   2.678   4.029   0.020
   54    HG   LEU  15           HG       LEU  15   3.686   1.453   1.263
   55   HD11  LEU  15          1HD1      LEU  15   1.393   1.746   1.831
   56   HD12  LEU  15          2HD1      LEU  15   1.384   0.689   0.419
   57   HD13  LEU  15          3HD1      LEU  15   1.003   2.401   0.242
   58   HD21  LEU  15          3HD2      LEU  15   4.547   1.608  -0.994
   59   HD22  LEU  15          1HD2      LEU  15   2.996   2.187  -1.598
   60   HD23  LEU  15          2HD2      LEU  15   3.156   0.526  -1.031
   61    H    SER  16           H        SER  16   7.114   4.715   0.821
   62    HA   SER  16           HA       SER  16   6.901   6.572   2.772
   63    HB2  SER  16           2HB      SER  16   8.525   6.785   0.232
   64    HB3  SER  16           1HB      SER  16   8.738   7.843   1.624
   65    HG   SER  16           HG       SER  16   8.929   5.006   1.610
   66    H    LYS  17           H        LYS  17   5.873   6.981  -0.570
   67    HA   LYS  17           HA       LYS  17   4.149   9.171   0.175
   68    HB2  LYS  17           2HB      LYS  17   5.127  10.814  -1.371
   69    HB3  LYS  17           1HB      LYS  17   6.274  10.373  -0.105
   70    HG2  LYS  17           2HG      LYS  17   7.736   9.946  -1.789
   71    HG3  LYS  17           1HG      LYS  17   6.788   8.490  -2.085
   72    HD2  LYS  17           2HD      LYS  17   5.374   9.722  -3.681
   73    HD3  LYS  17           1HD      LYS  17   6.299  11.192  -3.374
   74    HE2  LYS  17           2HE      LYS  17   6.985   9.889  -5.450
   75    HE3  LYS  17           1HE      LYS  17   8.287  10.247  -4.316
   76    HZ1  LYS  17           3HZ      LYS  17   8.331   8.081  -3.549
   77    HZ2  LYS  17           1HZ      LYS  17   8.057   7.870  -5.210
   78    HZ3  LYS  17           2HZ      LYS  17   6.768   7.729  -4.113
   79    H    TRP  18           H        TRP  18   2.372   9.094  -1.050
   80    HA   TRP  18           HA       TRP  18   2.531   7.969  -3.771
   81    HB2  TRP  18           2HB      TRP  18   0.928   6.936  -1.461
   82    HB3  TRP  18           1HB      TRP  18   0.222   6.863  -3.073
   83    HD1  TRP  18           HD       TRP  18   3.568   5.898  -1.373
   84    HE1  TRP  18           1HE      TRP  18   4.412   3.717  -2.454
   85    HE3  TRP  18           3HE      TRP  18  -0.073   5.188  -4.880
   86    HZ2  TRP  18           2HZ      TRP  18   3.641   1.905  -4.529
   87    HZ3  TRP  18           3HZ      TRP  18   0.004   3.227  -6.392
   88    HH2  TRP  18           HH       TRP  18   1.855   1.584  -6.222
   89    H    LYS  19           H        LYS  19   0.426   8.331  -4.957
   90    HA   LYS  19           HA       LYS  19  -0.694  10.971  -4.208
   91    HB2  LYS  19           2HB      LYS  19  -0.323   9.734  -6.949
   92    HB3  LYS  19           1HB      LYS  19  -1.108  11.281  -6.632
   93    HG2  LYS  19           2HG      LYS  19   1.017  12.075  -7.016
   94    HG3  LYS  19           1HG      LYS  19   1.201  11.710  -5.302
   95    HD2  LYS  19           2HD      LYS  19   2.018   9.411  -5.974
   96    HD3  LYS  19           1HD      LYS  19   2.028   9.974  -7.645
   97    HE2  LYS  19           2HE      LYS  19   3.652  11.681  -7.139
   98    HE3  LYS  19           1HE      LYS  19   3.515  11.372  -5.406
   99    HZ1  LYS  19           3HZ      LYS  19   5.082  10.017  -7.371
  100    HZ2  LYS  19           1HZ      LYS  19   4.111   8.938  -6.494
  101    HZ3  LYS  19           2HZ      LYS  19   5.191   9.964  -5.676
  102    H    TYR  20           H        TYR  20  -2.904  11.310  -4.412
  103    HA   TYR  20           HA       TYR  20  -4.635   9.255  -3.736
  104    HB2  TYR  20           2HB      TYR  20  -5.214  11.615  -3.462
  105    HB3  TYR  20           1HB      TYR  20  -5.272  11.820  -5.212
  106    HD1  TYR  20           1HD      TYR  20  -6.791   9.888  -2.398
  107    HD2  TYR  20           2HD      TYR  20  -7.242  11.326  -6.420
  108    HE1  TYR  20           1HE      TYR  20  -9.149   9.119  -2.409
  109    HE2  TYR  20           2HE      TYR  20  -9.599  10.557  -6.432
  110    HH   TYR  20           HH       TYR  20 -11.311   9.845  -3.746
  111    H    ALA  21           H        ALA  21  -3.726  10.440  -6.934
  112    HA   ALA  21           HA       ALA  21  -5.649   8.917  -8.385
  113    HB1  ALA  21           1HB      ALA  21  -2.983  10.024  -9.300
  114    HB2  ALA  21           2HB      ALA  21  -4.518  10.892  -9.338
  115    HB3  ALA  21           3HB      ALA  21  -4.287   9.466 -10.348
  116    H    GLU  22           H        GLU  22  -2.264   8.368  -7.484
  117    HA   GLU  22           HA       GLU  22  -1.942   5.930  -8.895
  118    HB2  GLU  22           2HB      GLU  22  -0.525   7.072  -6.481
  119    HB3  GLU  22           1HB      GLU  22  -0.032   5.580  -7.282
  120    HG2  GLU  22           2HG      GLU  22  -0.353   8.205  -8.752
  121    HG3  GLU  22           1HG      GLU  22   1.180   7.676  -8.058
  122    H    LEU  23           H        LEU  23  -2.792   6.626  -5.508
  123    HA   LEU  23           HA       LEU  23  -2.980   3.964  -4.629
  124    HB2  LEU  23           2HB      LEU  23  -4.556   6.371  -3.682
  125    HB3  LEU  23           1HB      LEU  23  -4.345   4.863  -2.795
  126    HG   LEU  23           HG       LEU  23  -1.973   6.482  -3.730
  127   HD11  LEU  23          1HD1      LEU  23  -1.957   7.334  -1.311
  128   HD12  LEU  23          2HD1      LEU  23  -3.640   6.815  -1.232
  129   HD13  LEU  23          3HD1      LEU  23  -3.153   8.054  -2.388
  130   HD21  LEU  23          3HD2      LEU  23  -0.995   5.321  -1.665
  131   HD22  LEU  23          1HD2      LEU  23  -1.377   4.273  -3.029
  132   HD23  LEU  23          2HD2      LEU  23  -2.461   4.343  -1.641
  133    H    ARG  24           H        ARG  24  -5.470   6.142  -5.943
  134    HA   ARG  24           HA       ARG  24  -7.573   4.217  -5.800
  135    HB2  ARG  24           2HB      ARG  24  -7.831   6.743  -5.942
  136    HB3  ARG  24           1HB      ARG  24  -7.445   6.596  -7.656
  137    HG2  ARG  24           2HG      ARG  24  -9.757   6.433  -7.756
  138    HG3  ARG  24           1HG      ARG  24  -9.341   4.729  -7.578
  139    HD2  ARG  24           2HD      ARG  24  -9.675   4.905  -5.136
  140    HD3  ARG  24           1HD      ARG  24 -10.093   6.605  -5.318
  141    HE   ARG  24           HE       ARG  24 -11.824   4.382  -5.786
  142   HH11  ARG  24          1HH2      ARG  24 -10.964   7.547  -6.890
  143   HH12  ARG  24          2HH2      ARG  24 -12.531   7.899  -7.536
  144   HH21  ARG  24          1HH1      ARG  24 -13.883   4.837  -6.630
  145   HH22  ARG  24          2HH1      ARG  24 -14.184   6.364  -7.389
  146    H    ASP  25           H        ASP  25  -5.327   5.239  -8.337
  147    HA   ASP  25           HA       ASP  25  -6.489   3.735 -10.440
  148    HB2  ASP  25           2HB      ASP  25  -4.938   5.548 -10.904
  149    HB3  ASP  25           1HB      ASP  25  -3.649   4.703 -10.048
  150    H    THR  26           H        THR  26  -3.756   3.041  -8.260
  151    HA   THR  26           HA       THR  26  -3.007   0.567  -9.271
  152    HB   THR  26           HB       THR  26  -3.026   1.515  -6.396
  153    HG1  THR  26           1HG      THR  26  -1.647   2.238  -8.518
  154   HG21  THR  26          3HG2      THR  26  -1.158  -0.218  -6.214
  155   HG22  THR  26          1HG2      THR  26  -1.746  -0.867  -7.745
  156   HG23  THR  26          2HG2      THR  26  -2.797  -0.857  -6.330
  157    H    ILE  27           H        ILE  27  -5.411   1.263  -6.733
  158    HA   ILE  27           HA       ILE  27  -6.192  -1.435  -6.341
  159    HB   ILE  27           HB       ILE  27  -7.714   1.132  -5.835
  160   HG12  ILE  27          2HG1      ILE  27  -6.229  -0.626  -3.868
  161   HG13  ILE  27          1HG1      ILE  27  -5.463   0.745  -4.674
  162   HG21  ILE  27          1HG2      ILE  27  -8.884  -0.415  -4.138
  163   HG22  ILE  27          2HG2      ILE  27  -8.214  -1.748  -5.079
  164   HG23  ILE  27          3HG2      ILE  27  -9.327  -0.608  -5.834
  165   HD11  ILE  27          3HD1      ILE  27  -8.018   0.941  -3.056
  166   HD12  ILE  27          1HD1      ILE  27  -7.095   2.279  -3.739
  167   HD13  ILE  27          2HD1      ILE  27  -6.416   1.320  -2.423
  168    H    ASN  28           H        ASN  28  -7.102   1.007  -8.663
  169    HA   ASN  28           HA       ASN  28  -9.329  -0.632  -9.660
  170    HB2  ASN  28           2HB      ASN  28  -8.390   2.172 -10.272
  171    HB3  ASN  28           1HB      ASN  28  -9.649   1.361 -11.203
  172   HD21  ASN  28          1HD2      ASN  28  -8.843   2.025  -7.742
  173   HD22  ASN  28          2HD2      ASN  28 -10.453   2.306  -7.279
  174    H    THR  29           H        THR  29  -6.427  -1.347  -9.936
  175    HA   THR  29           HA       THR  29  -6.524  -1.963 -12.786
  176    HB   THR  29           HB       THR  29  -4.112  -1.202 -13.039
  177    HG1  THR  29           1HG      THR  29  -4.265   0.752 -11.251
  178   HG21  THR  29          3HG2      THR  29  -6.110   1.001 -12.474
  179   HG22  THR  29          1HG2      THR  29  -6.124   0.019 -13.938
  180   HG23  THR  29          2HG2      THR  29  -4.745   1.061 -13.588
  181    H    SER  30           H        SER  30  -4.384  -2.072  -9.930
  182    HA   SER  30           HA       SER  30  -3.451  -4.731 -10.690
  183    HB2  SER  30           2HB      SER  30  -2.063  -2.771  -9.627
  184    HB3  SER  30           1HB      SER  30  -2.722  -3.381  -8.112
  185    HG   SER  30           HG       SER  30  -0.931  -4.539  -9.903
  186    H    CYS  31           H        CYS  31  -3.176  -6.227  -8.625
  187    HA   CYS  31           HA       CYS  31  -5.429  -6.176  -6.809
  188    HB2  CYS  31           2HB      CYS  31  -6.510  -7.135  -8.775
  189    HB3  CYS  31           1HB      CYS  31  -5.223  -8.331  -8.924
  190    HG   CYS  31           HG       CYS  31  -6.597  -8.422  -6.195
  191    H    ASP  32           H        ASP  32  -4.700  -6.915  -4.930
  192    HA   ASP  32           HA       ASP  32  -3.243  -9.327  -4.622
  193    HB2  ASP  32           2HB      ASP  32  -1.545  -7.477  -5.527
  194    HB3  ASP  32           1HB      ASP  32  -1.520  -7.020  -3.827
  195    H    ILE  33           H        ILE  33  -3.216  -9.982  -2.497
  196    HA   ILE  33           HA       ILE  33  -4.937  -8.588  -0.688
  197    HB   ILE  33           HB       ILE  33  -3.089 -10.930  -0.164
  198   HG12  ILE  33          2HG1      ILE  33  -6.050 -10.958  -0.807
  199   HG13  ILE  33          1HG1      ILE  33  -4.803 -11.193  -2.031
  200   HG21  ILE  33          1HG2      ILE  33  -3.757 -10.093   1.942
  201   HG22  ILE  33          2HG2      ILE  33  -4.945 -11.349   1.599
  202   HG23  ILE  33          3HG2      ILE  33  -5.360  -9.652   1.358
  203   HD11  ILE  33          3HD1      ILE  33  -3.969 -13.160  -0.918
  204   HD12  ILE  33          1HD1      ILE  33  -5.719 -13.336  -1.052
  205   HD13  ILE  33          2HD1      ILE  33  -4.995 -12.864   0.487
  206    H    GLU  34           H        GLU  34  -1.755  -8.100  -1.526
  207    HA   GLU  34           HA       GLU  34  -0.973  -7.114   1.143
  208    HB2  GLU  34           2HB      GLU  34   0.760  -7.361  -1.320
  209    HB3  GLU  34           1HB      GLU  34   1.284  -7.129   0.348
  210    HG2  GLU  34           2HG      GLU  34   0.192  -9.338   0.906
  211    HG3  GLU  34           1HG      GLU  34  -0.056  -9.578  -0.822
  212    H    LEU  35           H        LEU  35  -0.561  -6.064  -2.254
  213    HA   LEU  35           HA       LEU  35  -0.014  -3.385  -1.710
  214    HB2  LEU  35           2HB      LEU  35  -1.258  -4.740  -4.101
  215    HB3  LEU  35           1HB      LEU  35  -0.957  -3.005  -4.070
  216    HG   LEU  35           HG       LEU  35   1.165  -5.109  -3.552
  217   HD11  LEU  35          1HD1      LEU  35   1.927  -4.753  -5.799
  218   HD12  LEU  35          2HD1      LEU  35   0.796  -3.420  -6.037
  219   HD13  LEU  35          3HD1      LEU  35   0.195  -5.073  -5.903
  220   HD21  LEU  35          3HD2      LEU  35   1.094  -2.118  -3.578
  221   HD22  LEU  35          1HD2      LEU  35   2.519  -2.896  -4.269
  222   HD23  LEU  35          2HD2      LEU  35   2.068  -3.210  -2.594
  223    H    LEU  36           H        LEU  36  -3.161  -4.874  -2.513
  224    HA   LEU  36           HA       LEU  36  -4.734  -2.584  -2.361
  225    HB2  LEU  36           2HB      LEU  36  -5.444  -5.413  -1.548
  226    HB3  LEU  36           1HB      LEU  36  -6.607  -4.118  -1.823
  227    HG   LEU  36           HG       LEU  36  -4.639  -5.150  -3.889
  228   HD11  LEU  36          1HD1      LEU  36  -6.259  -6.858  -3.610
  229   HD12  LEU  36          2HD1      LEU  36  -6.854  -5.911  -4.973
  230   HD13  LEU  36          3HD1      LEU  36  -7.565  -5.695  -3.372
  231   HD21  LEU  36          3HD2      LEU  36  -6.647  -2.925  -3.812
  232   HD22  LEU  36          1HD2      LEU  36  -6.431  -3.803  -5.327
  233   HD23  LEU  36          2HD2      LEU  36  -5.064  -2.978  -4.586
  234    H    ALA  37           H        ALA  37  -3.901  -4.875   0.234
  235    HA   ALA  37           HA       ALA  37  -5.272  -3.494   2.290
  236    HB1  ALA  37           1HB      ALA  37  -3.829  -4.818   3.822
  237    HB2  ALA  37           2HB      ALA  37  -2.884  -5.350   2.431
  238    HB3  ALA  37           3HB      ALA  37  -4.580  -5.813   2.574
  239    H    ALA  38           H        ALA  38  -2.072  -3.172   0.892
  240    HA   ALA  38           HA       ALA  38  -1.071  -1.390   2.918
  241    HB1  ALA  38           1HB      ALA  38   0.017  -1.591   0.118
  242    HB2  ALA  38           2HB      ALA  38   0.276  -2.884   1.288
  243    HB3  ALA  38           3HB      ALA  38   0.882  -1.261   1.620
  244    H    CYS  39           H        CYS  39  -2.655  -1.058  -0.203
  245    HA   CYS  39           HA       CYS  39  -2.243   1.758  -0.460
  246    HB2  CYS  39           2HB      CYS  39  -2.817   0.083  -2.311
  247    HB3  CYS  39           1HB      CYS  39  -4.480   0.187  -1.732
  248    HG   CYS  39           HG       CYS  39  -2.950   2.423  -3.203
  249    H    ARG  40           H        ARG  40  -5.055  -0.211   0.503
  250    HA   ARG  40           HA       ARG  40  -6.879   1.802   1.007
  251    HB2  ARG  40           2HB      ARG  40  -6.440  -0.841   2.398
  252    HB3  ARG  40           1HB      ARG  40  -7.809   0.211   2.756
  253    HG2  ARG  40           2HG      ARG  40  -8.573   0.101   0.458
  254    HG3  ARG  40           1HG      ARG  40  -7.127  -0.790  -0.021
  255    HD2  ARG  40           2HD      ARG  40  -9.009  -2.334   0.262
  256    HD3  ARG  40           1HD      ARG  40  -7.780  -2.641   1.487
  257    HE   ARG  40           HE       ARG  40  -9.655  -0.808   2.529
  258   HH11  ARG  40          1HH2      ARG  40  -9.370  -4.103   1.507
  259   HH12  ARG  40          2HH2      ARG  40 -10.581  -4.690   2.597
  260   HH21  ARG  40          1HH1      ARG  40 -11.245  -1.571   3.960
  261   HH22  ARG  40          2HH1      ARG  40 -11.643  -3.257   3.986
  262    H    GLU  41           H        GLU  41  -4.182   0.712   2.993
  263    HA   GLU  41           HA       GLU  41  -4.839   1.991   5.400
  264    HB2  GLU  41           2HB      GLU  41  -2.207   1.264   4.122
  265    HB3  GLU  41           1HB      GLU  41  -2.279   2.064   5.691
  266    HG2  GLU  41           2HG      GLU  41  -3.448   0.260   6.685
  267    HG3  GLU  41           1HG      GLU  41  -3.880  -0.432   5.124
  268    H    GLU  42           H        GLU  42  -2.841   3.178   2.689
  269    HA   GLU  42           HA       GLU  42  -2.478   5.777   3.798
  270    HB2  GLU  42           2HB      GLU  42  -2.354   5.175   0.852
  271    HB3  GLU  42           1HB      GLU  42  -1.397   6.323   1.787
  272    HG2  GLU  42           2HG      GLU  42  -1.225   3.302   1.880
  273    HG3  GLU  42           1HG      GLU  42   0.007   4.419   1.296
  274    H    PHE  43           H        PHE  43  -4.766   4.396   1.479
  275    HA   PHE  43           HA       PHE  43  -6.025   6.655   0.528
  276    HB2  PHE  43           2HB      PHE  43  -6.494   4.195  -0.022
  277    HB3  PHE  43           1HB      PHE  43  -7.563   4.204   1.380
  278    HD1  PHE  43           2HD      PHE  43  -6.912   5.814  -1.910
  279    HD2  PHE  43           1HD      PHE  43  -9.709   5.247   1.300
  280    HE1  PHE  43           2HE      PHE  43  -8.691   6.875  -3.274
  281    HE2  PHE  43           1HE      PHE  43 -11.488   6.310  -0.063
  282    HZ   PHE  43           HZ       PHE  43 -10.980   7.123  -2.350
  283    H    HIS  44           H        HIS  44  -6.734   4.904   3.545
  284    HA   HIS  44           HA       HIS  44  -8.879   6.466   4.423
  285    HB2  HIS  44           2HB      HIS  44  -6.780   4.898   5.920
  286    HB3  HIS  44           1HB      HIS  44  -8.110   5.715   6.740
  287    HD2  HIS  44           2HD      HIS  44  -8.880   3.991   3.311
  288    HE1  HIS  44           1HE      HIS  44 -10.610   1.636   6.357
  289    HE2  HIS  44           2HE      HIS  44 -10.444   1.970   3.845
  290    H    ARG  45           H        ARG  45  -5.432   7.082   4.516
  291    HA   ARG  45           HA       ARG  45  -5.547   9.213   6.420
  292    HB2  ARG  45           2HB      ARG  45  -3.438   8.740   4.305
  293    HB3  ARG  45           1HB      ARG  45  -3.260   9.647   5.806
  294    HG2  ARG  45           2HG      ARG  45  -3.791   7.542   7.067
  295    HG3  ARG  45           1HG      ARG  45  -3.753   6.673   5.534
  296    HD2  ARG  45           2HD      ARG  45  -1.405   7.747   5.237
  297    HD3  ARG  45           1HD      ARG  45  -1.494   8.055   6.971
  298    HE   ARG  45           HE       ARG  45  -2.092   5.322   6.255
  299   HH11  ARG  45          1HH2      ARG  45   0.366   7.654   6.957
  300   HH12  ARG  45          2HH2      ARG  45   1.526   6.478   7.482
  301   HH21  ARG  45          1HH1      ARG  45  -0.578   3.775   6.940
  302   HH22  ARG  45          2HH1      ARG  45   0.990   4.282   7.472
  303    H    ARG  46           H        ARG  46  -5.489   9.074   2.870
  304    HA   ARG  46           HA       ARG  46  -5.337  11.809   2.338
  305    HB2  ARG  46           2HB      ARG  46  -7.043   9.957   0.690
  306    HB3  ARG  46           1HB      ARG  46  -6.038  11.301   0.155
  307    HG2  ARG  46           2HG      ARG  46  -5.086   8.635   1.229
  308    HG3  ARG  46           1HG      ARG  46  -4.894   9.245  -0.411
  309    HD2  ARG  46           2HD      ARG  46  -3.586  11.182   0.592
  310    HD3  ARG  46           1HD      ARG  46  -3.591  10.291   2.111
  311    HE   ARG  46           HE       ARG  46  -2.599   8.444   0.437
  312   HH11  ARG  46          1HH2      ARG  46  -1.922  11.816   0.832
  313   HH12  ARG  46          2HH2      ARG  46  -0.267  11.683   0.336
  314   HH21  ARG  46          1HH1      ARG  46  -0.431   8.263  -0.215
  315   HH22  ARG  46          2HH1      ARG  46   0.575   9.672  -0.258
  316    H    LEU  47           H        LEU  47  -8.118   9.799   3.170
  317    HA   LEU  47           HA       LEU  47 -10.204  11.530   2.582
  318    HB2  LEU  47           2HB      LEU  47  -9.775   9.347   4.560
  319    HB3  LEU  47           1HB      LEU  47 -11.137  10.425   4.859
  320    HG   LEU  47           HG       LEU  47 -11.903  10.014   2.502
  321   HD11  LEU  47          1HD1      LEU  47  -9.642   9.327   1.656
  322   HD12  LEU  47          2HD1      LEU  47 -10.917   8.183   1.242
  323   HD13  LEU  47          3HD1      LEU  47  -9.806   7.826   2.563
  324   HD21  LEU  47          3HD2      LEU  47 -12.701   7.691   2.952
  325   HD22  LEU  47          1HD2      LEU  47 -12.893   8.753   4.348
  326   HD23  LEU  47          2HD2      LEU  47 -11.565   7.591   4.298
  327    H    LYS  48           H        LYS  48  -8.164  11.423   5.485
  328    HA   LYS  48           HA       LYS  48  -8.711  14.242   5.972
  329    HB2  LYS  48           2HB      LYS  48  -9.371  13.835   8.333
  330    HB3  LYS  48           1HB      LYS  48 -10.549  13.210   7.179
  331    HG2  LYS  48           2HG      LYS  48 -10.384  11.268   8.358
  332    HG3  LYS  48           1HG      LYS  48  -8.870  11.044   7.486
  333    HD2  LYS  48           2HD      LYS  48  -7.677  12.234   9.327
  334    HD3  LYS  48           1HD      LYS  48  -9.199  12.335  10.210
  335    HE2  LYS  48           2HE      LYS  48  -9.343   9.800  10.005
  336    HE3  LYS  48           1HE      LYS  48  -7.673   9.840   9.440
  337    HZ1  LYS  48           3HZ      LYS  48  -7.563   9.503  11.744
  338    HZ2  LYS  48           1HZ      LYS  48  -8.728  10.692  12.069
  339    HZ3  LYS  48           2HZ      LYS  48  -7.186  11.144  11.522
  340    H    VAL  49           H        VAL  49  -7.041  15.254   6.971
  341    HA   VAL  49           HA       VAL  49  -4.936  13.626   8.226
  342    HB   VAL  49           HB       VAL  49  -3.418  15.463   6.946
  343   HG11  VAL  49          1HG1      VAL  49  -4.382  12.755   6.011
  344   HG12  VAL  49          2HG1      VAL  49  -2.875  13.146   6.841
  345   HG13  VAL  49          3HG1      VAL  49  -3.114  13.642   5.165
  346   HG21  VAL  49          3HG2      VAL  49  -5.526  16.311   5.798
  347   HG22  VAL  49          1HG2      VAL  49  -5.580  14.768   4.944
  348   HG23  VAL  49          2HG2      VAL  49  -4.210  15.856   4.716
  349    H    TYR  50           H        TYR  50  -3.256  15.180   9.244
  350    HA   TYR  50           HA       TYR  50  -4.333  17.739  10.105
  351    HB2  TYR  50           2HB      TYR  50  -4.085  17.100  12.534
  352    HB3  TYR  50           1HB      TYR  50  -5.443  16.338  11.707
  353    HD1  TYR  50           1HD      TYR  50  -5.092  13.986  10.727
  354    HD2  TYR  50           2HD      TYR  50  -2.413  15.785  13.562
  355    HE1  TYR  50           1HE      TYR  50  -4.180  11.749  11.286
  356    HE2  TYR  50           2HE      TYR  50  -1.502  13.547  14.120
  357    HH   TYR  50           HH       TYR  50  -3.005  10.706  13.343
  358    H    HIS  51           H        HIS  51  -2.284  18.009   8.749
  359    HA   HIS  51           HA       HIS  51   0.224  17.373  10.025
  360    HB2  HIS  51           2HB      HIS  51   0.092  17.488   7.590
  361    HB3  HIS  51           1HB      HIS  51  -0.423  19.173   7.678
  362    HD2  HIS  51           2HD      HIS  51   2.811  17.149   8.864
  363    HE1  HIS  51           1HE      HIS  51   3.924  21.085   7.817
  364    HE2  HIS  51           2HE      HIS  51   4.791  18.831   8.604
  Start of MODEL    7
    1    H1   GLY   9           H        GLY   9  11.957 -10.899   9.125
    2    HA2  GLY   9           2HA      GLY   9  13.411 -10.059   6.915
    3    HA3  GLY   9           1HA      GLY   9  13.700 -11.790   7.060
    4    H    THR  10           H        THR  10  11.584  -9.398   5.925
    5    HA   THR  10           HA       THR  10   9.619 -11.458   5.157
    6    HB   THR  10           HB       THR  10   7.787  -9.922   5.618
    7    HG1  THR  10           1HG      THR  10   9.899  -8.226   6.432
    8   HG21  THR  10          3HG2      THR  10   7.913  -9.911   8.066
    9   HG22  THR  10          1HG2      THR  10   9.659 -10.153   7.988
   10   HG23  THR  10          2HG2      THR  10   8.568 -11.419   7.429
   11    H    LYS  11           H        LYS  11   7.916  -9.604   3.855
   12    HA   LYS  11           HA       LYS  11   9.551  -8.227   1.864
   13    HB2  LYS  11           2HB      LYS  11   9.341 -10.612   1.094
   14    HB3  LYS  11           1HB      LYS  11   7.596 -10.375   1.023
   15    HG2  LYS  11           2HG      LYS  11   7.831  -8.622  -0.624
   16    HG3  LYS  11           1HG      LYS  11   9.586  -8.629  -0.449
   17    HD2  LYS  11           2HD      LYS  11   9.693 -10.917  -1.320
   18    HD3  LYS  11           1HD      LYS  11   7.934 -10.970  -1.440
   19    HE2  LYS  11           2HE      LYS  11   7.892  -9.347  -3.171
   20    HE3  LYS  11           1HE      LYS  11   9.553  -8.847  -2.852
   21    HZ1  LYS  11           3HZ      LYS  11  10.328 -10.435  -4.170
   22    HZ2  LYS  11           1HZ      LYS  11   8.736 -10.702  -4.692
   23    HZ3  LYS  11           2HZ      LYS  11   9.380 -11.631  -3.424
   24    H    LYS  12           H        LYS  12   8.613  -6.340   1.457
   25    HA   LYS  12           HA       LYS  12   5.744  -6.130   1.095
   26    HB2  LYS  12           2HB      LYS  12   5.803  -4.135   2.820
   27    HB3  LYS  12           1HB      LYS  12   5.548  -5.786   3.382
   28    HG2  LYS  12           2HG      LYS  12   7.265  -4.583   4.728
   29    HG3  LYS  12           1HG      LYS  12   7.921  -6.008   3.925
   30    HD2  LYS  12           2HD      LYS  12   9.011  -4.706   2.267
   31    HD3  LYS  12           1HD      LYS  12   8.071  -3.267   2.663
   32    HE2  LYS  12           2HE      LYS  12  10.010  -4.589   4.581
   33    HE3  LYS  12           1HE      LYS  12  10.432  -3.224   3.548
   34    HZ1  LYS  12           3HZ      LYS  12   8.173  -3.203   5.469
   35    HZ2  LYS  12           1HZ      LYS  12   8.789  -1.885   4.597
   36    HZ3  LYS  12           2HZ      LYS  12   9.721  -2.600   5.825
   37    H    TYR  13           H        TYR  13   5.357  -3.491   1.077
   38    HA   TYR  13           HA       TYR  13   7.442  -2.409  -0.732
   39    HB2  TYR  13           2HB      TYR  13   4.514  -1.747  -0.983
   40    HB3  TYR  13           1HB      TYR  13   5.797  -1.555  -2.179
   41    HD1  TYR  13           1HD      TYR  13   7.101  -3.853  -2.718
   42    HD2  TYR  13           2HD      TYR  13   3.067  -3.555  -1.269
   43    HE1  TYR  13           1HE      TYR  13   6.610  -6.111  -3.618
   44    HE2  TYR  13           2HE      TYR  13   2.577  -5.812  -2.170
   45    HH   TYR  13           HH       TYR  13   3.336  -7.466  -3.495
   46    H    ASP  14           H        ASP  14   8.029  -0.302  -0.439
   47    HA   ASP  14           HA       ASP  14   7.028   0.995   2.000
   48    HB2  ASP  14           2HB      ASP  14   9.367   1.807   0.269
   49    HB3  ASP  14           1HB      ASP  14   9.011   2.345   1.909
   50    H    LEU  15           H        LEU  15   5.310   2.259   1.682
   51    HA   LEU  15           HA       LEU  15   4.986   3.724  -0.828
   52    HB2  LEU  15           2HB      LEU  15   3.116   3.882   1.524
   53    HB3  LEU  15           1HB      LEU  15   2.757   4.062  -0.194
   54    HG   LEU  15           HG       LEU  15   3.532   1.500   1.231
   55   HD11  LEU  15          1HD1      LEU  15   1.238   0.839   0.256
   56   HD12  LEU  15          2HD1      LEU  15   0.982   2.565   0.009
   57   HD13  LEU  15          3HD1      LEU  15   1.233   1.936   1.637
   58   HD21  LEU  15          3HD2      LEU  15   3.054   0.497  -1.060
   59   HD22  LEU  15          1HD2      LEU  15   4.540   1.438  -0.949
   60   HD23  LEU  15          2HD2      LEU  15   3.107   2.138  -1.700
   61    H    SER  16           H        SER  16   7.192   4.515   0.738
   62    HA   SER  16           HA       SER  16   7.055   6.498   2.557
   63    HB2  SER  16           2HB      SER  16   8.698   6.825   0.046
   64    HB3  SER  16           1HB      SER  16   9.065   7.424   1.660
   65    HG   SER  16           HG       SER  16   8.799   4.965   2.109
   66    H    LYS  17           H        LYS  17   6.067   6.754  -0.808
   67    HA   LYS  17           HA       LYS  17   4.454   9.065  -0.224
   68    HB2  LYS  17           2HB      LYS  17   5.545  10.586  -1.813
   69    HB3  LYS  17           1HB      LYS  17   6.644  10.149  -0.505
   70    HG2  LYS  17           2HG      LYS  17   8.108   9.620  -2.166
   71    HG3  LYS  17           1HG      LYS  17   7.145   8.155  -2.345
   72    HD2  LYS  17           2HD      LYS  17   5.662   9.521  -3.942
   73    HD3  LYS  17           1HD      LYS  17   6.959  10.716  -3.941
   74    HE2  LYS  17           2HE      LYS  17   7.332   7.791  -4.646
   75    HE3  LYS  17           1HE      LYS  17   7.140   9.085  -5.829
   76    HZ1  LYS  17           3HZ      LYS  17   9.073  10.153  -4.492
   77    HZ2  LYS  17           1HZ      LYS  17   9.406   8.960  -5.650
   78    HZ3  LYS  17           2HZ      LYS  17   9.377   8.555  -4.001
   79    H    TRP  18           H        TRP  18   2.706   9.004  -1.486
   80    HA   TRP  18           HA       TRP  18   2.877   7.789  -4.161
   81    HB2  TRP  18           2HB      TRP  18   1.207   6.844  -1.859
   82    HB3  TRP  18           1HB      TRP  18   0.540   6.743  -3.487
   83    HD1  TRP  18           HD       TRP  18   3.785   5.731  -1.638
   84    HE1  TRP  18           1HE      TRP  18   4.630   3.521  -2.657
   85    HE3  TRP  18           3HE      TRP  18   0.315   5.077  -5.323
   86    HZ2  TRP  18           2HZ      TRP  18   3.925   1.710  -4.756
   87    HZ3  TRP  18           3HZ      TRP  18   0.423   3.102  -6.816
   88    HH2  TRP  18           HH       TRP  18   2.222   1.418  -6.537
   89    H    LYS  19           H        LYS  19   0.788   8.163  -5.379
   90    HA   LYS  19           HA       LYS  19  -0.179  10.895  -4.787
   91    HB2  LYS  19           2HB      LYS  19  -0.391   9.461  -7.432
   92    HB3  LYS  19           1HB      LYS  19  -0.523  11.190  -7.113
   93    HG2  LYS  19           2HG      LYS  19   1.982   9.512  -6.781
   94    HG3  LYS  19           1HG      LYS  19   1.677  10.668  -8.078
   95    HD2  LYS  19           2HD      LYS  19   1.325  12.403  -6.196
   96    HD3  LYS  19           1HD      LYS  19   2.103  11.221  -5.142
   97    HE2  LYS  19           2HE      LYS  19   3.787  12.765  -6.001
   98    HE3  LYS  19           1HE      LYS  19   4.051  11.165  -6.696
   99    HZ1  LYS  19           3HZ      LYS  19   4.115  13.104  -8.284
  100    HZ2  LYS  19           1HZ      LYS  19   2.439  13.241  -8.058
  101    HZ3  LYS  19           2HZ      LYS  19   3.092  11.818  -8.718
  102    H    TYR  20           H        TYR  20  -2.340  11.341  -4.688
  103    HA   TYR  20           HA       TYR  20  -4.136   9.426  -3.796
  104    HB2  TYR  20           2HB      TYR  20  -4.507  11.830  -3.511
  105    HB3  TYR  20           1HB      TYR  20  -4.741  12.013  -5.250
  106    HD1  TYR  20           1HD      TYR  20  -6.746  11.140  -6.358
  107    HD2  TYR  20           2HD      TYR  20  -6.193  10.750  -2.117
  108    HE1  TYR  20           1HE      TYR  20  -9.141  10.551  -6.099
  109    HE2  TYR  20           2HE      TYR  20  -8.588  10.162  -1.858
  110    HH   TYR  20           HH       TYR  20 -10.563   9.314  -4.466
  111    H    ALA  21           H        ALA  21  -3.302  10.353  -7.064
  112    HA   ALA  21           HA       ALA  21  -5.516   8.976  -8.295
  113    HB1  ALA  21           1HB      ALA  21  -4.292   9.421 -10.401
  114    HB2  ALA  21           2HB      ALA  21  -2.928  10.030  -9.463
  115    HB3  ALA  21           3HB      ALA  21  -4.475  10.877  -9.423
  116    H    GLU  22           H        GLU  22  -2.077   8.314  -7.731
  117    HA   GLU  22           HA       GLU  22  -1.965   5.863  -9.138
  118    HB2  GLU  22           2HB      GLU  22  -0.314   7.013  -6.889
  119    HB3  GLU  22           1HB      GLU  22   0.037   5.443  -7.613
  120    HG2  GLU  22           2HG      GLU  22  -0.248   7.972  -9.247
  121    HG3  GLU  22           1HG      GLU  22   1.300   7.410  -8.616
  122    H    LEU  23           H        LEU  23  -2.554   6.608  -5.710
  123    HA   LEU  23           HA       LEU  23  -2.744   3.982  -4.755
  124    HB2  LEU  23           2HB      LEU  23  -4.226   6.455  -3.833
  125    HB3  LEU  23           1HB      LEU  23  -4.090   4.955  -2.917
  126    HG   LEU  23           HG       LEU  23  -1.717   6.587  -3.859
  127   HD11  LEU  23          1HD1      LEU  23  -3.143   6.509  -1.188
  128   HD12  LEU  23          2HD1      LEU  23  -2.936   7.907  -2.242
  129   HD13  LEU  23          3HD1      LEU  23  -1.540   7.206  -1.421
  130   HD21  LEU  23          3HD2      LEU  23  -2.086   4.103  -2.193
  131   HD22  LEU  23          1HD2      LEU  23  -0.703   5.158  -1.897
  132   HD23  LEU  23          2HD2      LEU  23  -0.919   4.414  -3.479
  133    H    ARG  24           H        ARG  24  -5.300   6.143  -5.971
  134    HA   ARG  24           HA       ARG  24  -7.384   4.212  -5.710
  135    HB2  ARG  24           2HB      ARG  24  -7.656   6.736  -5.846
  136    HB3  ARG  24           1HB      ARG  24  -7.360   6.587  -7.577
  137    HG2  ARG  24           2HG      ARG  24  -9.675   6.424  -7.551
  138    HG3  ARG  24           1HG      ARG  24  -9.245   4.721  -7.407
  139    HD2  ARG  24           2HD      ARG  24  -9.472   4.854  -4.963
  140    HD3  ARG  24           1HD      ARG  24  -9.850   6.570  -5.081
  141    HE   ARG  24           HE       ARG  24 -11.732   5.414  -6.673
  142   HH11  ARG  24          1HH2      ARG  24 -10.603   4.867  -3.447
  143   HH12  ARG  24          2HH2      ARG  24 -12.129   4.295  -2.863
  144   HH21  ARG  24          1HH1      ARG  24 -13.737   4.665  -5.914
  145   HH22  ARG  24          2HH1      ARG  24 -13.904   4.180  -4.259
  146    H    ASP  25           H        ASP  25  -5.111   5.045  -8.249
  147    HA   ASP  25           HA       ASP  25  -6.438   3.615 -10.341
  148    HB2  ASP  25           2HB      ASP  25  -4.810   5.412 -10.789
  149    HB3  ASP  25           1HB      ASP  25  -3.531   4.417 -10.095
  150    H    THR  26           H        THR  26  -3.627   2.864  -8.277
  151    HA   THR  26           HA       THR  26  -3.009   0.352  -9.287
  152    HB   THR  26           HB       THR  26  -2.895   1.125  -6.365
  153    HG1  THR  26           1HG      THR  26  -1.790   2.706  -7.290
  154   HG21  THR  26          3HG2      THR  26  -2.412  -1.236  -6.858
  155   HG22  THR  26          1HG2      THR  26  -0.940  -0.391  -6.375
  156   HG23  THR  26          2HG2      THR  26  -1.234  -0.748  -8.077
  157    H    ILE  27           H        ILE  27  -5.530   1.302  -7.019
  158    HA   ILE  27           HA       ILE  27  -6.285  -1.397  -6.362
  159    HB   ILE  27           HB       ILE  27  -7.729   1.234  -5.967
  160   HG12  ILE  27          2HG1      ILE  27  -6.256  -0.484  -3.954
  161   HG13  ILE  27          1HG1      ILE  27  -5.493   0.860  -4.802
  162   HG21  ILE  27          1HG2      ILE  27  -9.394  -0.455  -5.874
  163   HG22  ILE  27          2HG2      ILE  27  -8.931  -0.196  -4.191
  164   HG23  ILE  27          3HG2      ILE  27  -8.310  -1.592  -5.072
  165   HD11  ILE  27          3HD1      ILE  27  -6.968   2.451  -3.827
  166   HD12  ILE  27          1HD1      ILE  27  -6.502   1.388  -2.501
  167   HD13  ILE  27          2HD1      ILE  27  -8.077   1.197  -3.272
  168    H    ASN  28           H        ASN  28  -7.341   1.058  -8.661
  169    HA   ASN  28           HA       ASN  28  -9.541  -0.627  -9.600
  170    HB2  ASN  28           2HB      ASN  28  -8.590   2.130 -10.398
  171    HB3  ASN  28           1HB      ASN  28  -9.947   1.301 -11.156
  172   HD21  ASN  28          1HD2      ASN  28  -8.828   2.002  -7.786
  173   HD22  ASN  28          2HD2      ASN  28 -10.372   2.421  -7.216
  174    H    THR  29           H        THR  29  -6.606  -1.303  -9.922
  175    HA   THR  29           HA       THR  29  -6.782  -2.029 -12.751
  176    HB   THR  29           HB       THR  29  -4.421  -1.275 -13.131
  177    HG1  THR  29           1HG      THR  29  -4.765  -0.586 -10.508
  178   HG21  THR  29          3HG2      THR  29  -6.461   0.035 -13.828
  179   HG22  THR  29          1HG2      THR  29  -5.018   1.017 -13.574
  180   HG23  THR  29          2HG2      THR  29  -6.285   0.977 -12.346
  181    H    SER  30           H        SER  30  -4.540  -2.069  -9.969
  182    HA   SER  30           HA       SER  30  -3.658  -4.756 -10.659
  183    HB2  SER  30           2HB      SER  30  -2.254  -2.780  -9.642
  184    HB3  SER  30           1HB      SER  30  -2.906  -3.363  -8.113
  185    HG   SER  30           HG       SER  30  -1.886  -5.240  -9.910
  186    H    CYS  31           H        CYS  31  -3.396  -6.237  -8.599
  187    HA   CYS  31           HA       CYS  31  -5.617  -6.123  -6.746
  188    HB2  CYS  31           2HB      CYS  31  -6.537  -7.112  -8.915
  189    HB3  CYS  31           1HB      CYS  31  -5.494  -8.499  -8.602
  190    HG   CYS  31           HG       CYS  31  -8.011  -7.744  -6.981
  191    H    ASP  32           H        ASP  32  -4.870  -6.855  -4.870
  192    HA   ASP  32           HA       ASP  32  -3.469  -9.298  -4.552
  193    HB2  ASP  32           2HB      ASP  32  -1.735  -7.540  -5.535
  194    HB3  ASP  32           1HB      ASP  32  -1.672  -7.010  -3.857
  195    H    ILE  33           H        ILE  33  -3.110  -9.814  -2.346
  196    HA   ILE  33           HA       ILE  33  -4.876  -8.424  -0.541
  197    HB   ILE  33           HB       ILE  33  -2.960 -10.710  -0.015
  198   HG12  ILE  33          2HG1      ILE  33  -5.948 -10.811  -0.506
  199   HG13  ILE  33          1HG1      ILE  33  -4.760 -11.068  -1.785
  200   HG21  ILE  33          1HG2      ILE  33  -4.718 -11.094   1.853
  201   HG22  ILE  33          2HG2      ILE  33  -5.178  -9.415   1.570
  202   HG23  ILE  33          3HG2      ILE  33  -3.537  -9.805   2.090
  203   HD11  ILE  33          3HD1      ILE  33  -5.632 -13.172  -0.611
  204   HD12  ILE  33          1HD1      ILE  33  -4.708 -12.641   0.795
  205   HD13  ILE  33          2HD1      ILE  33  -3.880 -13.007  -0.719
  206    H    GLU  34           H        GLU  34  -1.735  -7.907  -1.519
  207    HA   GLU  34           HA       GLU  34  -0.876  -6.801   1.078
  208    HB2  GLU  34           2HB      GLU  34   0.746  -7.165  -1.449
  209    HB3  GLU  34           1HB      GLU  34   1.355  -6.765   0.157
  210    HG2  GLU  34           2HG      GLU  34   0.450  -8.937   0.994
  211    HG3  GLU  34           1HG      GLU  34  -0.015  -9.342  -0.656
  212    H    LEU  35           H        LEU  35  -0.634  -5.888  -2.372
  213    HA   LEU  35           HA       LEU  35  -0.102  -3.186  -1.984
  214    HB2  LEU  35           2HB      LEU  35  -1.358  -4.742  -4.220
  215    HB3  LEU  35           1HB      LEU  35  -1.315  -2.984  -4.305
  216    HG   LEU  35           HG       LEU  35   1.132  -4.692  -3.780
  217   HD11  LEU  35          1HD1      LEU  35   1.671  -4.027  -6.200
  218   HD12  LEU  35          2HD1      LEU  35  -0.038  -3.616  -6.351
  219   HD13  LEU  35          3HD1      LEU  35   0.441  -5.272  -5.982
  220   HD21  LEU  35          3HD2      LEU  35   2.060  -2.387  -4.821
  221   HD22  LEU  35          1HD2      LEU  35   1.780  -2.584  -3.092
  222   HD23  LEU  35          2HD2      LEU  35   0.580  -1.769  -4.093
  223    H    LEU  36           H        LEU  36  -3.276  -4.725  -2.550
  224    HA   LEU  36           HA       LEU  36  -4.839  -2.417  -2.353
  225    HB2  LEU  36           2HB      LEU  36  -5.547  -5.234  -1.496
  226    HB3  LEU  36           1HB      LEU  36  -6.698  -3.933  -1.795
  227    HG   LEU  36           HG       LEU  36  -4.768  -5.067  -3.842
  228   HD11  LEU  36          1HD1      LEU  36  -7.006  -5.774  -4.903
  229   HD12  LEU  36          2HD1      LEU  36  -7.714  -5.477  -3.317
  230   HD13  LEU  36          3HD1      LEU  36  -6.458  -6.700  -3.507
  231   HD21  LEU  36          3HD2      LEU  36  -6.484  -3.692  -5.324
  232   HD22  LEU  36          1HD2      LEU  36  -5.116  -2.881  -4.565
  233   HD23  LEU  36          2HD2      LEU  36  -6.716  -2.781  -3.831
  234    H    ALA  37           H        ALA  37  -3.910  -4.726   0.198
  235    HA   ALA  37           HA       ALA  37  -5.203  -3.366   2.314
  236    HB1  ALA  37           1HB      ALA  37  -3.889  -4.744   3.784
  237    HB2  ALA  37           2HB      ALA  37  -2.701  -5.053   2.518
  238    HB3  ALA  37           3HB      ALA  37  -4.326  -5.727   2.387
  239    H    ALA  38           H        ALA  38  -2.034  -3.038   0.829
  240    HA   ALA  38           HA       ALA  38  -1.015  -1.205   2.797
  241    HB1  ALA  38           1HB      ALA  38   0.922  -1.113   1.480
  242    HB2  ALA  38           2HB      ALA  38   0.042  -1.459  -0.009
  243    HB3  ALA  38           3HB      ALA  38   0.309  -2.738   1.176
  244    H    CYS  39           H        CYS  39  -2.742  -0.958  -0.237
  245    HA   CYS  39           HA       CYS  39  -2.296   1.839  -0.635
  246    HB2  CYS  39           2HB      CYS  39  -3.004   0.124  -2.389
  247    HB3  CYS  39           1HB      CYS  39  -4.624   0.244  -1.703
  248    HG   CYS  39           HG       CYS  39  -4.767   2.699  -2.447
  249    H    ARG  40           H        ARG  40  -5.098  -0.029   0.542
  250    HA   ARG  40           HA       ARG  40  -6.828   2.055   1.098
  251    HB2  ARG  40           2HB      ARG  40  -6.455  -0.707   2.105
  252    HB3  ARG  40           1HB      ARG  40  -7.375   0.361   3.161
  253    HG2  ARG  40           2HG      ARG  40  -8.929  -0.732   1.661
  254    HG3  ARG  40           1HG      ARG  40  -8.818   0.961   1.186
  255    HD2  ARG  40           2HD      ARG  40  -6.997   0.197  -0.468
  256    HD3  ARG  40           1HD      ARG  40  -7.562  -1.441  -0.146
  257    HE   ARG  40           HE       ARG  40  -8.874   0.515  -1.773
  258   HH11  ARG  40          1HH2      ARG  40  -9.367  -2.091   0.451
  259   HH12  ARG  40          2HH2      ARG  40 -10.913  -2.529  -0.191
  260   HH21  ARG  40          1HH1      ARG  40 -10.903  -0.056  -2.619
  261   HH22  ARG  40          2HH1      ARG  40 -11.784  -1.376  -1.929
  262    H    GLU  41           H        GLU  41  -4.029   0.969   2.921
  263    HA   GLU  41           HA       GLU  41  -4.513   2.264   5.356
  264    HB2  GLU  41           2HB      GLU  41  -1.983   1.529   3.895
  265    HB3  GLU  41           1HB      GLU  41  -1.934   2.361   5.450
  266    HG2  GLU  41           2HG      GLU  41  -3.527  -0.171   5.017
  267    HG3  GLU  41           1HG      GLU  41  -1.845  -0.192   5.544
  268    H    GLU  42           H        GLU  42  -2.706   3.457   2.513
  269    HA   GLU  42           HA       GLU  42  -2.382   6.089   3.615
  270    HB2  GLU  42           2HB      GLU  42  -1.935   4.906   0.876
  271    HB3  GLU  42           1HB      GLU  42  -1.695   6.621   1.207
  272    HG2  GLU  42           2HG      GLU  42  -0.390   4.465   2.870
  273    HG3  GLU  42           1HG      GLU  42   0.372   5.122   1.424
  274    H    PHE  43           H        PHE  43  -4.418   4.711   1.039
  275    HA   PHE  43           HA       PHE  43  -5.749   6.971   0.197
  276    HB2  PHE  43           2HB      PHE  43  -5.979   4.589  -0.675
  277    HB3  PHE  43           1HB      PHE  43  -7.136   4.326   0.630
  278    HD1  PHE  43           2HD      PHE  43  -6.403   6.503  -2.311
  279    HD2  PHE  43           1HD      PHE  43  -9.375   5.079   0.445
  280    HE1  PHE  43           2HE      PHE  43  -8.178   7.581  -3.668
  281    HE2  PHE  43           1HE      PHE  43 -11.149   6.157  -0.912
  282    HZ   PHE  43           HZ       PHE  43 -10.551   7.407  -2.968
  283    H    HIS  44           H        HIS  44  -6.228   5.127   3.146
  284    HA   HIS  44           HA       HIS  44  -8.698   6.367   3.884
  285    HB2  HIS  44           2HB      HIS  44  -6.633   4.828   5.465
  286    HB3  HIS  44           1HB      HIS  44  -8.145   5.417   6.157
  287    HD2  HIS  44           2HD      HIS  44  -8.778   4.276   2.579
  288    HE1  HIS  44           1HE      HIS  44  -9.691   0.951   5.015
  289    HE2  HIS  44           2HE      HIS  44  -9.877   1.910   2.670
  290    H    ARG  45           H        ARG  45  -5.293   7.050   4.521
  291    HA   ARG  45           HA       ARG  45  -5.655   8.979   6.549
  292    HB2  ARG  45           2HB      ARG  45  -3.459   8.654   4.494
  293    HB3  ARG  45           1HB      ARG  45  -3.387   9.788   5.843
  294    HG2  ARG  45           2HG      ARG  45  -3.864   7.768   7.358
  295    HG3  ARG  45           1HG      ARG  45  -3.496   6.771   5.951
  296    HD2  ARG  45           2HD      ARG  45  -1.422   6.940   7.041
  297    HD3  ARG  45           1HD      ARG  45  -1.320   8.175   5.791
  298    HE   ARG  45           HE       ARG  45  -2.284   9.587   7.874
  299   HH11  ARG  45          1HH2      ARG  45   0.283   7.283   7.581
  300   HH12  ARG  45          2HH2      ARG  45   1.244   7.989   8.837
  301   HH21  ARG  45          1HH1      ARG  45  -1.028  10.517   9.522
  302   HH22  ARG  45          2HH1      ARG  45   0.501   9.820   9.937
  303    H    ARG  46           H        ARG  46  -6.098   9.116   3.114
  304    HA   ARG  46           HA       ARG  46  -5.893  11.945   2.809
  305    HB2  ARG  46           2HB      ARG  46  -7.596  10.172   1.068
  306    HB3  ARG  46           1HB      ARG  46  -6.677  11.610   0.617
  307    HG2  ARG  46           2HG      ARG  46  -5.543   8.917   1.426
  308    HG3  ARG  46           1HG      ARG  46  -5.477   9.651  -0.177
  309    HD2  ARG  46           2HD      ARG  46  -4.235  11.596   0.925
  310    HD3  ARG  46           1HD      ARG  46  -4.077  10.562   2.343
  311    HE   ARG  46           HE       ARG  46  -2.530   9.254   1.170
  312   HH11  ARG  46          1HH2      ARG  46  -4.130  11.528  -0.890
  313   HH12  ARG  46          2HH2      ARG  46  -3.058  11.279  -2.227
  314   HH21  ARG  46          1HH1      ARG  46  -1.121   8.923  -0.580
  315   HH22  ARG  46          2HH1      ARG  46  -1.355   9.804  -2.053
  316    H    LEU  47           H        LEU  47  -8.539   9.734   3.565
  317    HA   LEU  47           HA       LEU  47 -10.599  11.721   3.390
  318    HB2  LEU  47           2HB      LEU  47 -10.435   8.930   4.506
  319    HB3  LEU  47           1HB      LEU  47 -11.858   9.930   4.798
  320    HG   LEU  47           HG       LEU  47 -12.250  10.182   2.426
  321   HD11  LEU  47          1HD1      LEU  47 -10.694   8.877   0.842
  322   HD12  LEU  47          2HD1      LEU  47  -9.557   8.832   2.189
  323   HD13  LEU  47          3HD1      LEU  47 -10.064  10.380   1.515
  324   HD21  LEU  47          3HD2      LEU  47 -11.523   7.292   3.004
  325   HD22  LEU  47          1HD2      LEU  47 -12.682   7.858   1.802
  326   HD23  LEU  47          2HD2      LEU  47 -13.018   8.070   3.519
  327    H    LYS  48           H        LYS  48  -8.636  10.361   6.000
  328    HA   LYS  48           HA       LYS  48  -9.860  11.353   8.245
  329    HB2  LYS  48           2HB      LYS  48  -7.717   9.993   8.112
  330    HB3  LYS  48           1HB      LYS  48  -6.874  11.514   7.815
  331    HG2  LYS  48           2HG      LYS  48  -7.815  12.418   9.935
  332    HG3  LYS  48           1HG      LYS  48  -8.566  10.852  10.242
  333    HD2  LYS  48           2HD      LYS  48  -6.219   9.850  10.015
  334    HD3  LYS  48           1HD      LYS  48  -5.617  11.506  10.109
  335    HE2  LYS  48           2HE      LYS  48  -7.211  10.000  12.195
  336    HE3  LYS  48           1HE      LYS  48  -5.578  10.650  12.348
  337    HZ1  LYS  48           3HZ      LYS  48  -6.482  12.504  13.114
  338    HZ2  LYS  48           1HZ      LYS  48  -8.052  11.938  12.807
  339    HZ3  LYS  48           2HZ      LYS  48  -7.194  12.763  11.594
  340    H    VAL  49           H        VAL  49  -7.274  13.074   6.478
  341    HA   VAL  49           HA       VAL  49  -8.437  15.627   7.432
  342    HB   VAL  49           HB       VAL  49  -6.175  15.126   8.328
  343   HG11  VAL  49          1HG1      VAL  49  -5.493  13.818   6.251
  344   HG12  VAL  49          2HG1      VAL  49  -4.280  14.937   6.874
  345   HG13  VAL  49          3HG1      VAL  49  -5.240  15.374   5.460
  346   HG21  VAL  49          3HG2      VAL  49  -5.278  17.292   7.883
  347   HG22  VAL  49          1HG2      VAL  49  -7.025  17.476   7.727
  348   HG23  VAL  49          2HG2      VAL  49  -6.019  17.352   6.284
  349    H    TYR  50           H        TYR  50  -8.171  17.462   5.964
  350    HA   TYR  50           HA       TYR  50  -7.937  16.704   3.118
  351    HB2  TYR  50           2HB      TYR  50  -9.862  18.321   2.703
  352    HB3  TYR  50           1HB      TYR  50 -10.291  16.781   3.451
  353    HD1  TYR  50           1HD      TYR  50 -10.706  16.657   5.914
  354    HD2  TYR  50           2HD      TYR  50 -10.108  20.394   3.884
  355    HE1  TYR  50           1HE      TYR  50 -11.663  17.866   7.858
  356    HE2  TYR  50           2HE      TYR  50 -11.065  21.604   5.826
  357    HH   TYR  50           HH       TYR  50 -12.908  20.555   7.915
  358    H    HIS  51           H        HIS  51  -6.089  17.746   2.613
  359    HA   HIS  51           HA       HIS  51  -5.147  20.137   3.730
  360    HB2  HIS  51           2HB      HIS  51  -3.829  18.492   2.338
  361    HB3  HIS  51           1HB      HIS  51  -4.605  19.183   0.912
  362    HD2  HIS  51           2HD      HIS  51  -2.506  20.719   3.950
  363    HE1  HIS  51           1HE      HIS  51  -1.634  22.850   0.412
  364    HE2  HIS  51           2HE      HIS  51  -1.099  22.643   2.886
  Start of MODEL    8
    1    H1   GLY   9           H        GLY   9   8.128 -12.031   6.589
    2    HA2  GLY   9           2HA      GLY   9   5.876 -11.464   4.813
    3    HA3  GLY   9           1HA      GLY   9   7.086 -10.312   5.369
    4    H    THR  10           H        THR  10   5.979 -11.676   2.671
    5    HA   THR  10           HA       THR  10   8.526 -12.320   1.402
    6    HB   THR  10           HB       THR  10   7.010 -12.618  -0.634
    7    HG1  THR  10           1HG      THR  10   4.756 -12.986   0.345
    8   HG21  THR  10          3HG2      THR  10   6.157 -14.762   0.191
    9   HG22  THR  10          1HG2      THR  10   6.390 -14.231   1.856
   10   HG23  THR  10          2HG2      THR  10   7.786 -14.480   0.808
   11    H    LYS  11           H        LYS  11   9.700 -10.447   1.243
   12    HA   LYS  11           HA       LYS  11  10.224  -8.264   0.665
   13    HB2  LYS  11           2HB      LYS  11  10.247  -9.787  -1.453
   14    HB3  LYS  11           1HB      LYS  11   8.807  -8.879  -1.913
   15    HG2  LYS  11           2HG      LYS  11  10.448  -7.547  -2.866
   16    HG3  LYS  11           1HG      LYS  11  10.324  -6.791  -1.280
   17    HD2  LYS  11           2HD      LYS  11  12.174  -8.439  -0.553
   18    HD3  LYS  11           1HD      LYS  11  12.423  -8.721  -2.276
   19    HE2  LYS  11           2HE      LYS  11  12.689  -6.104  -0.778
   20    HE3  LYS  11           1HE      LYS  11  13.948  -6.980  -1.649
   21    HZ1  LYS  11           3HZ      LYS  11  11.926  -6.595  -3.470
   22    HZ2  LYS  11           1HZ      LYS  11  13.410  -5.774  -3.411
   23    HZ3  LYS  11           2HZ      LYS  11  12.047  -5.118  -2.638
   24    H    LYS  12           H        LYS  12   9.010  -6.907   1.943
   25    HA   LYS  12           HA       LYS  12   6.247  -6.337   1.422
   26    HB2  LYS  12           2HB      LYS  12   8.090  -4.573   3.024
   27    HB3  LYS  12           1HB      LYS  12   6.364  -4.852   3.243
   28    HG2  LYS  12           2HG      LYS  12   6.991  -6.342   4.842
   29    HG3  LYS  12           1HG      LYS  12   7.393  -7.405   3.495
   30    HD2  LYS  12           2HD      LYS  12   9.702  -6.416   3.482
   31    HD3  LYS  12           1HD      LYS  12   9.274  -5.514   4.936
   32    HE2  LYS  12           2HE      LYS  12   9.025  -8.523   4.754
   33    HE3  LYS  12           1HE      LYS  12  10.484  -7.720   5.334
   34    HZ1  LYS  12           3HZ      LYS  12   7.888  -7.991   6.599
   35    HZ2  LYS  12           1HZ      LYS  12   8.617  -6.469   6.759
   36    HZ3  LYS  12           2HZ      LYS  12   9.431  -7.859   7.298
   37    H    TYR  13           H        TYR  13   6.348  -3.494   1.794
   38    HA   TYR  13           HA       TYR  13   7.685  -2.475  -0.612
   39    HB2  TYR  13           2HB      TYR  13   4.741  -1.984  -0.144
   40    HB3  TYR  13           1HB      TYR  13   5.697  -1.571  -1.568
   41    HD1  TYR  13           2HD      TYR  13   6.734  -3.472  -2.930
   42    HD2  TYR  13           1HD      TYR  13   3.703  -4.103   0.046
   43    HE1  TYR  13           2HE      TYR  13   6.228  -5.690  -3.916
   44    HE2  TYR  13           1HE      TYR  13   3.194  -6.321  -0.940
   45    HH   TYR  13           HH       TYR  13   3.478  -7.378  -3.325
   46    H    ASP  14           H        ASP  14   7.374  -0.042  -0.759
   47    HA   ASP  14           HA       ASP  14   7.119   1.177   1.924
   48    HB2  ASP  14           2HB      ASP  14   9.530   0.805   1.203
   49    HB3  ASP  14           1HB      ASP  14   9.231   1.979  -0.078
   50    H    LEU  15           H        LEU  15   5.381   2.441   1.760
   51    HA   LEU  15           HA       LEU  15   4.885   3.920  -0.739
   52    HB2  LEU  15           2HB      LEU  15   3.016   3.853   1.616
   53    HB3  LEU  15           1HB      LEU  15   2.642   4.077  -0.092
   54    HG   LEU  15           HG       LEU  15   3.610   1.508   1.200
   55   HD11  LEU  15          1HD1      LEU  15   1.320   0.742   0.332
   56   HD12  LEU  15          2HD1      LEU  15   0.944   2.453   0.130
   57   HD13  LEU  15          3HD1      LEU  15   1.308   1.813   1.733
   58   HD21  LEU  15          3HD2      LEU  15   4.502   1.659  -1.047
   59   HD22  LEU  15          1HD2      LEU  15   2.952   2.220  -1.674
   60   HD23  LEU  15          2HD2      LEU  15   3.121   0.564  -1.092
   61    H    SER  16           H        SER  16   7.044   4.766   0.877
   62    HA   SER  16           HA       SER  16   6.754   6.650   2.790
   63    HB2  SER  16           2HB      SER  16   8.460   6.952   0.308
   64    HB3  SER  16           1HB      SER  16   8.672   7.850   1.810
   65    HG   SER  16           HG       SER  16   8.887   5.751   2.834
   66    H    LYS  17           H        LYS  17   5.906   7.039  -0.612
   67    HA   LYS  17           HA       LYS  17   4.137   9.232   0.045
   68    HB2  LYS  17           2HB      LYS  17   5.211  10.722  -1.724
   69    HB3  LYS  17           1HB      LYS  17   6.072  10.589  -0.193
   70    HG2  LYS  17           2HG      LYS  17   6.851   8.499  -2.103
   71    HG3  LYS  17           1HG      LYS  17   7.167  10.123  -2.711
   72    HD2  LYS  17           2HD      LYS  17   8.516  10.675  -0.810
   73    HD3  LYS  17           1HD      LYS  17   8.002   9.226   0.056
   74    HE2  LYS  17           2HE      LYS  17  10.211   8.804  -0.827
   75    HE3  LYS  17           1HE      LYS  17   9.068   7.853  -1.775
   76    HZ1  LYS  17           3HZ      LYS  17  10.197   8.835  -3.454
   77    HZ2  LYS  17           1HZ      LYS  17  10.623  10.199  -2.541
   78    HZ3  LYS  17           2HZ      LYS  17   9.059  10.068  -3.191
   79    H    TRP  18           H        TRP  18   2.400   9.130  -1.229
   80    HA   TRP  18           HA       TRP  18   2.640   7.956  -3.922
   81    HB2  TRP  18           2HB      TRP  18   0.973   6.964  -1.640
   82    HB3  TRP  18           1HB      TRP  18   0.302   6.872  -3.268
   83    HD1  TRP  18           HD       TRP  18   3.607   5.915  -1.480
   84    HE1  TRP  18           1HE      TRP  18   4.463   3.715  -2.512
   85    HE3  TRP  18           3HE      TRP  18   0.041   5.173  -5.059
   86    HZ2  TRP  18           2HZ      TRP  18   3.731   1.879  -4.580
   87    HZ3  TRP  18           3HZ      TRP  18   0.143   3.193  -6.542
   88    HH2  TRP  18           HH       TRP  18   1.981   1.544  -6.309
   89    H    LYS  19           H        LYS  19   0.572   8.306  -5.179
   90    HA   LYS  19           HA       LYS  19  -0.519  10.983  -4.536
   91    HB2  LYS  19           2HB      LYS  19  -0.194   9.598  -7.209
   92    HB3  LYS  19           1HB      LYS  19  -0.950  11.171  -6.972
   93    HG2  LYS  19           2HG      LYS  19   1.188  11.898  -7.421
   94    HG3  LYS  19           1HG      LYS  19   1.367  11.645  -5.686
   95    HD2  LYS  19           2HD      LYS  19   2.216   9.349  -6.135
   96    HD3  LYS  19           1HD      LYS  19   2.097   9.665  -7.865
   97    HE2  LYS  19           2HE      LYS  19   3.910  10.997  -5.848
   98    HE3  LYS  19           1HE      LYS  19   4.365  10.124  -7.312
   99    HZ1  LYS  19           3HZ      LYS  19   4.541  12.437  -7.752
  100    HZ2  LYS  19           1HZ      LYS  19   2.990  12.747  -7.138
  101    HZ3  LYS  19           2HZ      LYS  19   3.170  11.873  -8.583
  102    H    TYR  20           H        TYR  20  -2.715  11.343  -4.654
  103    HA   TYR  20           HA       TYR  20  -4.470   9.331  -3.911
  104    HB2  TYR  20           2HB      TYR  20  -5.014  11.694  -3.645
  105    HB3  TYR  20           1HB      TYR  20  -5.081  11.899  -5.394
  106    HD1  TYR  20           2HD      TYR  20  -6.680  10.202  -2.501
  107    HD2  TYR  20           1HD      TYR  20  -7.006  11.244  -6.655
  108    HE1  TYR  20           2HE      TYR  20  -9.053   9.482  -2.496
  109    HE2  TYR  20           1HE      TYR  20  -9.378  10.525  -6.649
  110    HH   TYR  20           HH       TYR  20 -11.229  10.313  -4.330
  111    H    ALA  21           H        ALA  21  -3.571  10.433  -7.135
  112    HA   ALA  21           HA       ALA  21  -5.563   8.944  -8.537
  113    HB1  ALA  21           1HB      ALA  21  -4.339   9.511 -10.524
  114    HB2  ALA  21           2HB      ALA  21  -2.878   9.849  -9.594
  115    HB3  ALA  21           3HB      ALA  21  -4.277  10.912  -9.454
  116    H    GLU  22           H        GLU  22  -2.153   8.343  -7.739
  117    HA   GLU  22           HA       GLU  22  -1.923   5.870  -9.088
  118    HB2  GLU  22           2HB      GLU  22  -0.433   7.060  -6.746
  119    HB3  GLU  22           1HB      GLU  22  -0.005   5.504  -7.456
  120    HG2  GLU  22           2HG      GLU  22  -0.261   8.024  -9.107
  121    HG3  GLU  22           1HG      GLU  22   1.259   7.527  -8.367
  122    H    LEU  23           H        LEU  23  -2.762   6.665  -5.727
  123    HA   LEU  23           HA       LEU  23  -2.974   4.016  -4.782
  124    HB2  LEU  23           2HB      LEU  23  -4.456   6.490  -3.861
  125    HB3  LEU  23           1HB      LEU  23  -4.298   4.989  -2.949
  126    HG   LEU  23           HG       LEU  23  -1.883   6.521  -3.926
  127   HD11  LEU  23          1HD1      LEU  23  -1.798   7.355  -1.505
  128   HD12  LEU  23          2HD1      LEU  23  -3.492   6.878  -1.392
  129   HD13  LEU  23          3HD1      LEU  23  -3.001   8.114  -2.551
  130   HD21  LEU  23          3HD2      LEU  23  -0.927   5.314  -1.859
  131   HD22  LEU  23          1HD2      LEU  23  -1.308   4.310  -3.256
  132   HD23  LEU  23          2HD2      LEU  23  -2.407   4.356  -1.878
  133    H    ARG  24           H        ARG  24  -5.451   6.236  -6.057
  134    HA   ARG  24           HA       ARG  24  -7.582   4.350  -5.847
  135    HB2  ARG  24           2HB      ARG  24  -7.791   6.883  -5.995
  136    HB3  ARG  24           1HB      ARG  24  -7.469   6.716  -7.720
  137    HG2  ARG  24           2HG      ARG  24  -9.788   6.603  -7.730
  138    HG3  ARG  24           1HG      ARG  24  -9.396   4.890  -7.569
  139    HD2  ARG  24           2HD      ARG  24  -9.648   5.056  -5.124
  140    HD3  ARG  24           1HD      ARG  24 -10.014   6.772  -5.271
  141    HE   ARG  24           HE       ARG  24 -11.807   4.571  -5.830
  142   HH11  ARG  24          1HH2      ARG  24 -10.987   7.876  -6.447
  143   HH12  ARG  24          2HH2      ARG  24 -12.595   8.334  -6.903
  144   HH21  ARG  24          1HH1      ARG  24 -13.917   5.164  -6.427
  145   HH22  ARG  24          2HH1      ARG  24 -14.253   6.799  -6.891
  146    H    ASP  25           H        ASP  25  -5.227   5.133  -8.329
  147    HA   ASP  25           HA       ASP  25  -6.538   3.695 -10.432
  148    HB2  ASP  25           2HB      ASP  25  -3.749   4.781 -10.069
  149    HB3  ASP  25           1HB      ASP  25  -4.229   3.881 -11.504
  150    H    THR  26           H        THR  26  -3.762   2.994  -8.307
  151    HA   THR  26           HA       THR  26  -3.065   0.498  -9.300
  152    HB   THR  26           HB       THR  26  -3.052   1.255  -6.373
  153    HG1  THR  26           1HG      THR  26  -1.871   2.425  -8.457
  154   HG21  THR  26          3HG2      THR  26  -2.498  -1.103  -6.967
  155   HG22  THR  26          1HG2      THR  26  -1.126  -0.235  -6.279
  156   HG23  THR  26          2HG2      THR  26  -1.216  -0.506  -8.019
  157    H    ILE  27           H        ILE  27  -5.535   1.328  -6.889
  158    HA   ILE  27           HA       ILE  27  -6.294  -1.380  -6.370
  159    HB   ILE  27           HB       ILE  27  -7.795   1.208  -5.903
  160   HG12  ILE  27          2HG1      ILE  27  -6.242  -0.501  -3.942
  161   HG13  ILE  27          1HG1      ILE  27  -5.538   0.889  -4.766
  162   HG21  ILE  27          1HG2      ILE  27  -8.279  -1.651  -5.054
  163   HG22  ILE  27          2HG2      ILE  27  -9.405  -0.535  -5.826
  164   HG23  ILE  27          3HG2      ILE  27  -8.935  -0.290  -4.144
  165   HD11  ILE  27          3HD1      ILE  27  -7.009   2.409  -3.713
  166   HD12  ILE  27          1HD1      ILE  27  -6.571   1.286  -2.428
  167   HD13  ILE  27          2HD1      ILE  27  -8.128   1.131  -3.238
  168    H    ASN  28           H        ASN  28  -7.230   1.039  -8.713
  169    HA   ASN  28           HA       ASN  28  -9.465  -0.617  -9.663
  170    HB2  ASN  28           2HB      ASN  28  -8.557   2.189 -10.307
  171    HB3  ASN  28           1HB      ASN  28  -9.829   1.364 -11.208
  172   HD21  ASN  28          1HD2      ASN  28  -8.984   1.851  -7.721
  173   HD22  ASN  28          2HD2      ASN  28 -10.574   2.211  -7.247
  174    H    THR  29           H        THR  29  -6.574  -1.331  -9.987
  175    HA   THR  29           HA       THR  29  -6.713  -1.943 -12.836
  176    HB   THR  29           HB       THR  29  -4.325  -1.176 -13.151
  177    HG1  THR  29           1HG      THR  29  -3.438  -0.656 -11.322
  178   HG21  THR  29          3HG2      THR  29  -6.375   0.089 -13.921
  179   HG22  THR  29          1HG2      THR  29  -4.955   1.093 -13.640
  180   HG23  THR  29          2HG2      THR  29  -6.252   1.048 -12.447
  181    H    SER  30           H        SER  30  -4.566  -2.075  -9.985
  182    HA   SER  30           HA       SER  30  -3.619  -4.718 -10.776
  183    HB2  SER  30           2HB      SER  30  -2.241  -2.779  -9.673
  184    HB3  SER  30           1HB      SER  30  -2.928  -3.395  -8.172
  185    HG   SER  30           HG       SER  30  -2.046  -5.398  -9.768
  186    H    CYS  31           H        CYS  31  -3.358  -6.237  -8.715
  187    HA   CYS  31           HA       CYS  31  -5.645  -6.220  -6.942
  188    HB2  CYS  31           2HB      CYS  31  -6.728  -7.177  -8.871
  189    HB3  CYS  31           1HB      CYS  31  -5.389  -8.298  -9.125
  190    HG   CYS  31           HG       CYS  31  -7.305  -9.534  -7.787
  191    H    ASP  32           H        ASP  32  -4.946  -6.963  -5.054
  192    HA   ASP  32           HA       ASP  32  -3.493  -9.370  -4.719
  193    HB2  ASP  32           2HB      ASP  32  -1.775  -7.537  -5.614
  194    HB3  ASP  32           1HB      ASP  32  -1.769  -7.065  -3.917
  195    H    ILE  33           H        ILE  33  -3.145  -9.881  -2.495
  196    HA   ILE  33           HA       ILE  33  -5.005  -8.533  -0.731
  197    HB   ILE  33           HB       ILE  33  -3.106 -10.771  -0.020
  198   HG12  ILE  33          2HG1      ILE  33  -4.276 -11.506  -2.002
  199   HG13  ILE  33          1HG1      ILE  33  -5.057 -12.267  -0.616
  200   HG21  ILE  33          1HG2      ILE  33  -5.014 -11.326   1.534
  201   HG22  ILE  33          2HG2      ILE  33  -5.768  -9.808   1.053
  202   HG23  ILE  33          3HG2      ILE  33  -4.215  -9.795   1.887
  203   HD11  ILE  33          3HD1      ILE  33  -6.867 -11.455  -1.895
  204   HD12  ILE  33          1HD1      ILE  33  -6.034  -9.949  -2.280
  205   HD13  ILE  33          2HD1      ILE  33  -6.653 -10.224  -0.653
  206    H    GLU  34           H        GLU  34  -1.765  -8.154  -1.544
  207    HA   GLU  34           HA       GLU  34  -1.001  -7.083   1.088
  208    HB2  GLU  34           2HB      GLU  34   0.711  -7.385  -1.386
  209    HB3  GLU  34           1HB      GLU  34   1.258  -7.086   0.264
  210    HG2  GLU  34           2HG      GLU  34   0.394  -9.263   0.975
  211    HG3  GLU  34           1HG      GLU  34  -0.234  -9.565  -0.644
  212    H    LEU  35           H        LEU  35  -0.629  -6.070  -2.326
  213    HA   LEU  35           HA       LEU  35  -0.048  -3.396  -1.831
  214    HB2  LEU  35           2HB      LEU  35  -1.307  -4.821  -4.158
  215    HB3  LEU  35           1HB      LEU  35  -1.158  -3.067  -4.173
  216    HG   LEU  35           HG       LEU  35   1.160  -4.960  -3.677
  217   HD11  LEU  35          1HD1      LEU  35   1.813  -4.603  -5.965
  218   HD12  LEU  35          2HD1      LEU  35   0.535  -3.410  -6.203
  219   HD13  LEU  35          3HD1      LEU  35   0.123  -5.112  -5.986
  220   HD21  LEU  35          3HD2      LEU  35   1.947  -2.965  -2.833
  221   HD22  LEU  35          1HD2      LEU  35   0.812  -1.994  -3.771
  222   HD23  LEU  35          2HD2      LEU  35   2.261  -2.644  -4.536
  223    H    LEU  36           H        LEU  36  -3.243  -4.828  -2.546
  224    HA   LEU  36           HA       LEU  36  -4.764  -2.506  -2.340
  225    HB2  LEU  36           2HB      LEU  36  -5.515  -5.327  -1.532
  226    HB3  LEU  36           1HB      LEU  36  -6.658  -4.004  -1.771
  227    HG   LEU  36           HG       LEU  36  -4.768  -5.082  -3.886
  228   HD11  LEU  36          1HD1      LEU  36  -6.742  -6.547  -3.139
  229   HD12  LEU  36          2HD1      LEU  36  -6.657  -6.159  -4.857
  230   HD13  LEU  36          3HD1      LEU  36  -7.783  -5.293  -3.812
  231   HD21  LEU  36          3HD2      LEU  36  -6.536  -3.665  -5.283
  232   HD22  LEU  36          1HD2      LEU  36  -5.130  -2.888  -4.560
  233   HD23  LEU  36          2HD2      LEU  36  -6.700  -2.789  -3.761
  234    H    ALA  37           H        ALA  37  -3.892  -4.822   0.221
  235    HA   ALA  37           HA       ALA  37  -5.207  -3.438   2.315
  236    HB1  ALA  37           1HB      ALA  37  -2.886  -5.378   2.336
  237    HB2  ALA  37           2HB      ALA  37  -4.584  -5.740   2.639
  238    HB3  ALA  37           3HB      ALA  37  -3.669  -4.774   3.796
  239    H    ALA  38           H        ALA  38  -2.041  -3.135   0.844
  240    HA   ALA  38           HA       ALA  38  -0.960  -1.404   2.868
  241    HB1  ALA  38           1HB      ALA  38   0.030  -1.583   0.028
  242    HB2  ALA  38           2HB      ALA  38   0.331  -2.877   1.191
  243    HB3  ALA  38           3HB      ALA  38   0.950  -1.255   1.498
  244    H    CYS  39           H        CYS  39  -2.530  -0.971  -0.266
  245    HA   CYS  39           HA       CYS  39  -2.131   1.857  -0.390
  246    HB2  CYS  39           2HB      CYS  39  -2.537   0.567  -2.416
  247    HB3  CYS  39           1HB      CYS  39  -4.115   0.067  -1.810
  248    HG   CYS  39           HG       CYS  39  -4.773   2.115  -3.128
  249    H    ARG  40           H        ARG  40  -4.923  -0.187   0.461
  250    HA   ARG  40           HA       ARG  40  -6.812   1.759   0.977
  251    HB2  ARG  40           2HB      ARG  40  -6.289  -0.887   2.329
  252    HB3  ARG  40           1HB      ARG  40  -7.681   0.119   2.731
  253    HG2  ARG  40           2HG      ARG  40  -8.584  -0.056   0.546
  254    HG3  ARG  40           1HG      ARG  40  -7.063  -0.650  -0.123
  255    HD2  ARG  40           2HD      ARG  40  -9.018  -2.342   0.389
  256    HD3  ARG  40           1HD      ARG  40  -7.352  -2.786   0.752
  257    HE   ARG  40           HE       ARG  40  -8.772  -1.495   2.935
  258   HH11  ARG  40          1HH2      ARG  40  -7.903  -4.434   1.328
  259   HH12  ARG  40          2HH2      ARG  40  -8.132  -5.428   2.727
  260   HH21  ARG  40          1HH1      ARG  40  -9.072  -2.793   4.774
  261   HH22  ARG  40          2HH1      ARG  40  -8.793  -4.499   4.679
  262    H    GLU  41           H        GLU  41  -4.083   0.764   2.962
  263    HA   GLU  41           HA       GLU  41  -4.825   2.030   5.367
  264    HB2  GLU  41           2HB      GLU  41  -2.182   1.251   4.156
  265    HB3  GLU  41           1HB      GLU  41  -2.248   2.131   5.683
  266    HG2  GLU  41           2HG      GLU  41  -3.595   0.395   6.699
  267    HG3  GLU  41           1HG      GLU  41  -3.757  -0.443   5.156
  268    H    GLU  42           H        GLU  42  -2.748   3.213   2.709
  269    HA   GLU  42           HA       GLU  42  -2.411   5.812   3.811
  270    HB2  GLU  42           2HB      GLU  42  -2.285   5.270   0.857
  271    HB3  GLU  42           1HB      GLU  42  -1.285   6.347   1.834
  272    HG2  GLU  42           2HG      GLU  42  -1.220   3.322   1.781
  273    HG3  GLU  42           1HG      GLU  42   0.059   4.428   1.285
  274    H    PHE  43           H        PHE  43  -4.651   4.456   1.425
  275    HA   PHE  43           HA       PHE  43  -5.928   6.723   0.520
  276    HB2  PHE  43           2HB      PHE  43  -6.357   4.302  -0.143
  277    HB3  PHE  43           1HB      PHE  43  -7.407   4.202   1.271
  278    HD1  PHE  43           1HD      PHE  43  -6.866   5.956  -1.958
  279    HD2  PHE  43           2HD      PHE  43  -9.572   5.226   1.296
  280    HE1  PHE  43           1HE      PHE  43  -8.697   7.032  -3.240
  281    HE2  PHE  43           2HE      PHE  43 -11.402   6.302   0.015
  282    HZ   PHE  43           HZ       PHE  43 -10.966   7.204  -2.252
  283    H    HIS  44           H        HIS  44  -6.615   4.885   3.483
  284    HA   HIS  44           HA       HIS  44  -8.819   6.344   4.383
  285    HB2  HIS  44           2HB      HIS  44  -7.642   4.173   5.309
  286    HB3  HIS  44           1HB      HIS  44  -6.782   5.322   6.333
  287    HD2  HIS  44           2HD      HIS  44  -9.855   7.167   6.310
  288    HE1  HIS  44           1HE      HIS  44 -10.832   4.013   8.941
  289    HE2  HIS  44           2HE      HIS  44 -11.519   6.320   8.135
  290    H    ARG  45           H        ARG  45  -5.363   6.993   4.702
  291    HA   ARG  45           HA       ARG  45  -5.558   9.110   6.568
  292    HB2  ARG  45           2HB      ARG  45  -3.447   8.732   4.436
  293    HB3  ARG  45           1HB      ARG  45  -3.289   9.647   5.936
  294    HG2  ARG  45           2HG      ARG  45  -3.638   7.581   7.238
  295    HG3  ARG  45           1HG      ARG  45  -3.792   6.662   5.740
  296    HD2  ARG  45           2HD      ARG  45  -1.532   6.369   6.420
  297    HD3  ARG  45           1HD      ARG  45  -1.478   7.559   5.121
  298    HE   ARG  45           HE       ARG  45  -1.689   8.727   7.759
  299   HH11  ARG  45          1HH2      ARG  45   0.396   7.467   5.302
  300   HH12  ARG  45          2HH2      ARG  45   1.781   8.367   5.821
  301   HH21  ARG  45          1HH1      ARG  45   0.125   9.912   8.447
  302   HH22  ARG  45          2HH1      ARG  45   1.628   9.751   7.602
  303    H    ARG  46           H        ARG  46  -5.524   9.072   3.014
  304    HA   ARG  46           HA       ARG  46  -5.436  11.819   2.551
  305    HB2  ARG  46           2HB      ARG  46  -7.147   9.992   0.882
  306    HB3  ARG  46           1HB      ARG  46  -6.158  11.357   0.367
  307    HG2  ARG  46           2HG      ARG  46  -5.164   8.680   1.379
  308    HG3  ARG  46           1HG      ARG  46  -5.025   9.303  -0.264
  309    HD2  ARG  46           2HD      ARG  46  -3.695  11.236   0.697
  310    HD3  ARG  46           1HD      ARG  46  -3.669  10.363   2.227
  311    HE   ARG  46           HE       ARG  46  -2.703   8.499   0.561
  312   HH11  ARG  46          1HH2      ARG  46  -2.031  11.880   0.893
  313   HH12  ARG  46          2HH2      ARG  46  -0.386  11.745   0.367
  314   HH21  ARG  46          1HH1      ARG  46  -0.546   8.317  -0.127
  315   HH22  ARG  46          2HH1      ARG  46   0.455   9.729  -0.210
  316    H    LEU  47           H        LEU  47  -8.175   9.747   3.372
  317    HA   LEU  47           HA       LEU  47 -10.209  11.672   2.933
  318    HB2  LEU  47           2HB      LEU  47  -9.991   9.078   4.393
  319    HB3  LEU  47           1HB      LEU  47 -11.352  10.125   4.792
  320    HG   LEU  47           HG       LEU  47 -11.940  10.244   2.378
  321   HD11  LEU  47          1HD1      LEU  47  -9.692   9.850   1.461
  322   HD12  LEU  47          2HD1      LEU  47 -10.834   8.669   0.822
  323   HD13  LEU  47          3HD1      LEU  47  -9.710   8.206   2.100
  324   HD21  LEU  47          3HD2      LEU  47 -11.655   7.420   3.454
  325   HD22  LEU  47          1HD2      LEU  47 -12.780   7.935   2.197
  326   HD23  LEU  47          2HD2      LEU  47 -12.967   8.530   3.847
  327    H    LYS  48           H        LYS  48  -7.991  11.102   5.565
  328    HA   LYS  48           HA       LYS  48  -9.426  12.688   7.489
  329    HB2  LYS  48           2HB      LYS  48  -7.899  10.923   8.226
  330    HB3  LYS  48           1HB      LYS  48  -6.548  11.752   7.452
  331    HG2  LYS  48           2HG      LYS  48  -6.684  13.595   8.960
  332    HG3  LYS  48           1HG      LYS  48  -8.262  13.082   9.558
  333    HD2  LYS  48           2HD      LYS  48  -7.312  11.161  10.653
  334    HD3  LYS  48           1HD      LYS  48  -5.749  11.422   9.875
  335    HE2  LYS  48           2HE      LYS  48  -6.004  12.224  12.318
  336    HE3  LYS  48           1HE      LYS  48  -5.299  13.356  11.162
  337    HZ1  LYS  48           3HZ      LYS  48  -8.189  13.424  11.366
  338    HZ2  LYS  48           1HZ      LYS  48  -7.075  14.701  11.265
  339    HZ3  LYS  48           2HZ      LYS  48  -7.357  13.939  12.756
  340    H    VAL  49           H        VAL  49  -6.156  13.216   6.166
  341    HA   VAL  49           HA       VAL  49  -6.194  16.002   6.707
  342    HB   VAL  49           HB       VAL  49  -4.126  16.058   5.359
  343   HG11  VAL  49          1HG1      VAL  49  -4.206  13.577   7.092
  344   HG12  VAL  49          2HG1      VAL  49  -4.209  15.212   7.753
  345   HG13  VAL  49          3HG1      VAL  49  -2.831  14.646   6.808
  346   HG21  VAL  49          3HG2      VAL  49  -5.064  13.283   4.628
  347   HG22  VAL  49          1HG2      VAL  49  -3.355  13.713   4.551
  348   HG23  VAL  49          2HG2      VAL  49  -4.526  14.578   3.559
  349    H    TYR  50           H        TYR  50  -7.192  17.569   5.635
  350    HA   TYR  50           HA       TYR  50  -8.264  17.034   2.957
  351    HB2  TYR  50           2HB      TYR  50  -9.417  19.276   3.376
  352    HB3  TYR  50           1HB      TYR  50  -9.899  17.938   4.420
  353    HD1  TYR  50           2HD      TYR  50  -8.808  17.718   6.711
  354    HD2  TYR  50           1HD      TYR  50  -8.449  21.243   4.282
  355    HE1  TYR  50           2HE      TYR  50  -8.123  19.022   8.706
  356    HE2  TYR  50           1HE      TYR  50  -7.764  22.547   6.277
  357    HH   TYR  50           HH       TYR  50  -6.641  21.948   8.568
  358    H    HIS  51           H        HIS  51  -5.523  17.260   2.934
  359    HA   HIS  51           HA       HIS  51  -4.409  19.785   2.594
  360    HB2  HIS  51           2HB      HIS  51  -2.803  18.611   1.030
  361    HB3  HIS  51           1HB      HIS  51  -2.973  17.869   2.622
  362    HD2  HIS  51           2HD      HIS  51  -2.132  15.585   0.692
  363    HE1  HIS  51           1HE      HIS  51  -6.203  14.828  -0.133
  364    HE2  HIS  51           2HE      HIS  51  -3.851  13.886  -0.295
  Start of MODEL    9
    1    H1   GLY   9           H        GLY   9  12.829  -5.217  -2.478
    2    HA2  GLY   9           2HA      GLY   9  13.496  -7.942  -3.113
    3    HA3  GLY   9           1HA      GLY   9  13.588  -7.609  -1.386
    4    H    THR  10           H        THR  10  11.807  -8.276  -0.382
    5    HA   THR  10           HA       THR  10   9.180  -7.653  -1.578
    6    HB   THR  10           HB       THR  10   8.330  -9.819  -0.934
    7    HG1  THR  10           1HG      THR  10   9.368 -10.500   0.789
    8   HG21  THR  10          3HG2      THR  10   9.502  -9.622  -3.122
    9   HG22  THR  10          1HG2      THR  10   9.613 -11.247  -2.444
   10   HG23  THR  10          2HG2      THR  10  10.993 -10.153  -2.342
   11    H    LYS  11           H        LYS  11   7.737  -8.894   0.525
   12    HA   LYS  11           HA       LYS  11   7.007  -8.561   2.687
   13    HB2  LYS  11           2HB      LYS  11   9.609  -8.668   3.086
   14    HB3  LYS  11           1HB      LYS  11   9.433  -6.935   3.353
   15    HG2  LYS  11           2HG      LYS  11   7.638  -7.413   5.022
   16    HG3  LYS  11           1HG      LYS  11   7.947  -9.137   4.814
   17    HD2  LYS  11           2HD      LYS  11  10.361  -8.675   5.436
   18    HD3  LYS  11           1HD      LYS  11   9.858  -7.044   5.880
   19    HE2  LYS  11           2HE      LYS  11   9.775  -8.302   7.903
   20    HE3  LYS  11           1HE      LYS  11   8.100  -8.152   7.376
   21    HZ1  LYS  11           3HZ      LYS  11   8.730 -10.372   6.129
   22    HZ2  LYS  11           1HZ      LYS  11   8.175 -10.373   7.732
   23    HZ3  LYS  11           2HZ      LYS  11   9.839 -10.497   7.409
   24    H    LYS  12           H        LYS  12   5.328  -7.238   2.011
   25    HA   LYS  12           HA       LYS  12   4.127  -5.297   1.708
   26    HB2  LYS  12           2HB      LYS  12   6.036  -4.477   3.906
   27    HB3  LYS  12           1HB      LYS  12   4.628  -3.533   3.421
   28    HG2  LYS  12           2HG      LYS  12   3.201  -4.899   4.537
   29    HG3  LYS  12           1HG      LYS  12   3.957  -6.350   3.880
   30    HD2  LYS  12           2HD      LYS  12   5.610  -6.394   5.586
   31    HD3  LYS  12           1HD      LYS  12   5.256  -4.738   6.083
   32    HE2  LYS  12           2HE      LYS  12   3.031  -5.435   6.868
   33    HE3  LYS  12           1HE      LYS  12   3.355  -7.088   6.347
   34    HZ1  LYS  12           3HZ      LYS  12   4.333  -5.652   8.666
   35    HZ2  LYS  12           1HZ      LYS  12   5.493  -6.593   7.863
   36    HZ3  LYS  12           2HZ      LYS  12   4.072  -7.317   8.445
   37    H    TYR  13           H        TYR  13   4.807  -2.620   1.895
   38    HA   TYR  13           HA       TYR  13   7.127  -2.142   0.193
   39    HB2  TYR  13           2HB      TYR  13   4.398  -1.244  -0.737
   40    HB3  TYR  13           1HB      TYR  13   5.925  -1.156  -1.615
   41    HD1  TYR  13           1HD      TYR  13   3.308  -3.444  -0.331
   42    HD2  TYR  13           2HD      TYR  13   6.837  -3.074  -2.752
   43    HE1  TYR  13           1HE      TYR  13   2.906  -5.706  -1.263
   44    HE2  TYR  13           2HE      TYR  13   6.435  -5.337  -3.683
   45    HH   TYR  13           HH       TYR  13   5.272  -7.310  -3.279
   46    H    ASP  14           H        ASP  14   7.652   0.118   0.009
   47    HA   ASP  14           HA       ASP  14   6.702   1.653   2.327
   48    HB2  ASP  14           2HB      ASP  14   8.662   3.129   1.764
   49    HB3  ASP  14           1HB      ASP  14   9.091   1.470   2.181
   50    H    LEU  15           H        LEU  15   4.973   2.880   1.924
   51    HA   LEU  15           HA       LEU  15   4.691   4.181  -0.703
   52    HB2  LEU  15           2HB      LEU  15   2.629   4.245   1.488
   53    HB3  LEU  15           1HB      LEU  15   2.399   4.372  -0.256
   54    HG   LEU  15           HG       LEU  15   3.267   1.888   1.253
   55   HD11  LEU  15          1HD1      LEU  15   0.928   2.196   1.579
   56   HD12  LEU  15          2HD1      LEU  15   1.062   1.051   0.245
   57   HD13  LEU  15          3HD1      LEU  15   0.693   2.745  -0.080
   58   HD21  LEU  15          3HD2      LEU  15   2.946   0.827  -1.033
   59   HD22  LEU  15          1HD2      LEU  15   4.344   1.893  -0.903
   60   HD23  LEU  15          2HD2      LEU  15   2.875   2.458  -1.698
   61    H    SER  16           H        SER  16   6.699   5.158   1.019
   62    HA   SER  16           HA       SER  16   6.261   7.159   2.775
   63    HB2  SER  16           2HB      SER  16   8.118   7.406   0.398
   64    HB3  SER  16           1HB      SER  16   8.244   8.287   1.918
   65    HG   SER  16           HG       SER  16   9.188   6.608   2.741
   66    H    LYS  17           H        LYS  17   5.641   7.320  -0.693
   67    HA   LYS  17           HA       LYS  17   3.829   9.541  -0.297
   68    HB2  LYS  17           2HB      LYS  17   4.945  11.065  -1.846
   69    HB3  LYS  17           1HB      LYS  17   6.000  10.701  -0.482
   70    HG2  LYS  17           2HG      LYS  17   7.561  10.191  -2.056
   71    HG3  LYS  17           1HG      LYS  17   6.656   8.694  -2.268
   72    HD2  LYS  17           2HD      LYS  17   5.263   9.843  -4.006
   73    HD3  LYS  17           1HD      LYS  17   6.304  11.257  -3.849
   74    HE2  LYS  17           2HE      LYS  17   7.033   9.860  -5.738
   75    HE3  LYS  17           1HE      LYS  17   8.261   9.880  -4.474
   76    HZ1  LYS  17           3HZ      LYS  17   6.935   7.672  -5.559
   77    HZ2  LYS  17           1HZ      LYS  17   6.460   7.805  -3.936
   78    HZ3  LYS  17           2HZ      LYS  17   8.108   7.692  -4.331
   79    H    TRP  18           H        TRP  18   2.177   9.355  -1.671
   80    HA   TRP  18           HA       TRP  18   2.583   8.024  -4.266
   81    HB2  TRP  18           2HB      TRP  18   0.850   7.103  -2.013
   82    HB3  TRP  18           1HB      TRP  18   0.213   6.950  -3.647
   83    HD1  TRP  18           HD       TRP  18   3.472   6.067  -1.746
   84    HE1  TRP  18           1HE      TRP  18   4.371   3.849  -2.699
   85    HE3  TRP  18           3HE      TRP  18   0.022   5.218  -5.414
   86    HZ2  TRP  18           2HZ      TRP  18   3.715   1.959  -4.744
   87    HZ3  TRP  18           3HZ      TRP  18   0.180   3.203  -6.847
   88    HH2  TRP  18           HH       TRP  18   2.021   1.573  -6.517
   89    H    LYS  19           H        LYS  19   0.581   8.266  -5.653
   90    HA   LYS  19           HA       LYS  19  -0.499  10.990  -5.288
   91    HB2  LYS  19           2HB      LYS  19  -0.586   9.357  -7.823
   92    HB3  LYS  19           1HB      LYS  19  -0.750  11.103  -7.639
   93    HG2  LYS  19           2HG      LYS  19   1.758   9.483  -7.109
   94    HG3  LYS  19           1HG      LYS  19   1.489  10.564  -8.477
   95    HD2  LYS  19           2HD      LYS  19   1.058  12.396  -6.709
   96    HD3  LYS  19           1HD      LYS  19   1.799  11.280  -5.560
   97    HE2  LYS  19           2HE      LYS  19   3.834  11.188  -6.924
   98    HE3  LYS  19           1HE      LYS  19   3.097  12.247  -8.123
   99    HZ1  LYS  19           3HZ      LYS  19   2.798  13.865  -6.215
  100    HZ2  LYS  19           1HZ      LYS  19   4.380  13.643  -6.783
  101    HZ3  LYS  19           2HZ      LYS  19   3.882  12.887  -5.345
  102    H    TYR  20           H        TYR  20  -2.683  11.399  -5.386
  103    HA   TYR  20           HA       TYR  20  -4.466   9.519  -4.376
  104    HB2  TYR  20           2HB      TYR  20  -4.895  11.931  -4.315
  105    HB3  TYR  20           1HB      TYR  20  -5.079  11.953  -6.070
  106    HD1  TYR  20           2HD      TYR  20  -6.970  10.724  -7.146
  107    HD2  TYR  20           1HD      TYR  20  -6.651  11.142  -2.883
  108    HE1  TYR  20           2HE      TYR  20  -9.357  10.095  -6.907
  109    HE2  TYR  20           1HE      TYR  20  -9.039  10.513  -2.643
  110    HH   TYR  20           HH       TYR  20 -10.891   9.282  -5.318
  111    H    ALA  21           H        ALA  21  -3.618  10.254  -7.708
  112    HA   ALA  21           HA       ALA  21  -5.733   8.661  -8.842
  113    HB1  ALA  21           1HB      ALA  21  -4.684  10.590 -10.028
  114    HB2  ALA  21           2HB      ALA  21  -4.655   9.097 -10.968
  115    HB3  ALA  21           3HB      ALA  21  -3.194   9.655 -10.153
  116    H    GLU  22           H        GLU  22  -2.228   8.254  -8.381
  117    HA   GLU  22           HA       GLU  22  -1.961   5.741  -9.584
  118    HB2  GLU  22           2HB      GLU  22  -0.446   7.068  -7.334
  119    HB3  GLU  22           1HB      GLU  22   0.014   5.496  -7.987
  120    HG2  GLU  22           2HG      GLU  22   0.358   6.419 -10.183
  121    HG3  GLU  22           1HG      GLU  22  -0.349   7.961  -9.706
  122    H    LEU  23           H        LEU  23  -2.869   6.626  -6.276
  123    HA   LEU  23           HA       LEU  23  -2.896   3.999  -5.216
  124    HB2  LEU  23           2HB      LEU  23  -4.462   6.455  -4.392
  125    HB3  LEU  23           1HB      LEU  23  -4.323   4.981  -3.436
  126    HG   LEU  23           HG       LEU  23  -1.865   6.442  -4.395
  127   HD11  LEU  23          1HD1      LEU  23  -2.947   8.176  -3.208
  128   HD12  LEU  23          2HD1      LEU  23  -1.900   7.429  -2.001
  129   HD13  LEU  23          3HD1      LEU  23  -3.624   7.059  -2.021
  130   HD21  LEU  23          3HD2      LEU  23  -0.991   5.392  -2.235
  131   HD22  LEU  23          1HD2      LEU  23  -1.413   4.254  -3.514
  132   HD23  LEU  23          2HD2      LEU  23  -2.511   4.502  -2.155
  133    H    ARG  24           H        ARG  24  -5.575   6.061  -6.363
  134    HA   ARG  24           HA       ARG  24  -7.565   4.062  -6.145
  135    HB2  ARG  24           2HB      ARG  24  -8.147   6.421  -6.281
  136    HB3  ARG  24           1HB      ARG  24  -7.453   6.525  -7.898
  137    HG2  ARG  24           2HG      ARG  24  -9.294   5.613  -8.869
  138    HG3  ARG  24           1HG      ARG  24  -9.418   4.352  -7.642
  139    HD2  ARG  24           2HD      ARG  24 -10.612   5.778  -6.153
  140    HD3  ARG  24           1HD      ARG  24 -10.207   7.215  -7.086
  141    HE   ARG  24           HE       ARG  24 -11.676   5.378  -8.689
  142   HH11  ARG  24          1HH2      ARG  24 -11.957   7.626  -6.073
  143   HH12  ARG  24          2HH2      ARG  24 -13.619   8.001  -6.390
  144   HH21  ARG  24          1HH1      ARG  24 -13.855   5.863  -9.112
  145   HH22  ARG  24          2HH1      ARG  24 -14.692   7.003  -8.111
  146    H    ASP  25           H        ASP  25  -5.330   4.940  -8.718
  147    HA   ASP  25           HA       ASP  25  -6.572   3.344 -10.738
  148    HB2  ASP  25           2HB      ASP  25  -3.861   4.632 -10.454
  149    HB3  ASP  25           1HB      ASP  25  -4.266   3.619 -11.837
  150    H    THR  26           H        THR  26  -3.741   2.872  -8.620
  151    HA   THR  26           HA       THR  26  -2.911   0.386  -9.542
  152    HB   THR  26           HB       THR  26  -2.911   1.398  -6.686
  153    HG1  THR  26           1HG      THR  26  -1.545   2.741  -7.522
  154   HG21  THR  26          3HG2      THR  26  -1.416  -0.827  -8.087
  155   HG22  THR  26          1HG2      THR  26  -2.469  -0.961  -6.680
  156   HG23  THR  26          2HG2      THR  26  -0.908  -0.152  -6.540
  157    H    ILE  27           H        ILE  27  -5.565   1.219  -7.391
  158    HA   ILE  27           HA       ILE  27  -6.142  -1.511  -6.666
  159    HB   ILE  27           HB       ILE  27  -7.785   1.017  -6.377
  160   HG12  ILE  27          2HG1      ILE  27  -6.218  -0.512  -4.283
  161   HG13  ILE  27          1HG1      ILE  27  -5.546   0.859  -5.164
  162   HG21  ILE  27          1HG2      ILE  27  -8.158  -1.818  -5.402
  163   HG22  ILE  27          2HG2      ILE  27  -9.314  -0.791  -6.249
  164   HG23  ILE  27          3HG2      ILE  27  -8.897  -0.450  -4.569
  165   HD11  ILE  27          3HD1      ILE  27  -7.106   2.372  -4.240
  166   HD12  ILE  27          1HD1      ILE  27  -6.669   1.338  -2.881
  167   HD13  ILE  27          2HD1      ILE  27  -8.191   1.079  -3.732
  168    H    ASN  28           H        ASN  28  -7.226   0.775  -9.101
  169    HA   ASN  28           HA       ASN  28  -9.285  -1.093 -10.051
  170    HB2  ASN  28           2HB      ASN  28  -8.600   1.768 -10.721
  171    HB3  ASN  28           1HB      ASN  28  -9.740   0.824 -11.681
  172   HD21  ASN  28          1HD2      ASN  28  -9.222   2.306  -8.500
  173   HD22  ASN  28          2HD2      ASN  28 -10.828   2.148  -7.976
  174    H    THR  29           H        THR  29  -6.395  -1.667 -10.290
  175    HA   THR  29           HA       THR  29  -6.392  -2.299 -13.137
  176    HB   THR  29           HB       THR  29  -4.038  -1.424 -13.373
  177    HG1  THR  29           1HG      THR  29  -3.630   0.321 -11.812
  178   HG21  THR  29          3HG2      THR  29  -4.745   0.808 -13.897
  179   HG22  THR  29          1HG2      THR  29  -6.059   0.730 -12.724
  180   HG23  THR  29          2HG2      THR  29  -6.129  -0.243 -14.192
  181    H    SER  30           H        SER  30  -4.312  -2.296 -10.232
  182    HA   SER  30           HA       SER  30  -3.240  -4.910 -10.945
  183    HB2  SER  30           2HB      SER  30  -1.960  -2.922  -9.842
  184    HB3  SER  30           1HB      SER  30  -2.703  -3.490  -8.348
  185    HG   SER  30           HG       SER  30  -1.241  -5.126 -10.154
  186    H    CYS  31           H        CYS  31  -2.971  -6.361  -8.812
  187    HA   CYS  31           HA       CYS  31  -5.336  -6.422  -7.145
  188    HB2  CYS  31           2HB      CYS  31  -6.134  -7.484  -9.246
  189    HB3  CYS  31           1HB      CYS  31  -4.850  -8.682  -9.098
  190    HG   CYS  31           HG       CYS  31  -6.018  -9.730  -7.104
  191    H    ASP  32           H        ASP  32  -4.678  -7.059  -5.206
  192    HA   ASP  32           HA       ASP  32  -3.129  -9.380  -4.729
  193    HB2  ASP  32           2HB      ASP  32  -1.462  -7.494  -5.617
  194    HB3  ASP  32           1HB      ASP  32  -1.544  -6.976  -3.937
  195    H    ILE  33           H        ILE  33  -2.819  -9.781  -2.469
  196    HA   ILE  33           HA       ILE  33  -4.816  -8.460  -0.827
  197    HB   ILE  33           HB       ILE  33  -2.872 -10.598   0.045
  198   HG12  ILE  33          2HG1      ILE  33  -3.885 -11.446  -1.975
  199   HG13  ILE  33          1HG1      ILE  33  -4.723 -12.195  -0.616
  200   HG21  ILE  33          1HG2      ILE  33  -4.808 -11.189   1.524
  201   HG22  ILE  33          2HG2      ILE  33  -5.654  -9.765   0.917
  202   HG23  ILE  33          3HG2      ILE  33  -4.159  -9.578   1.835
  203   HD11  ILE  33          3HD1      ILE  33  -6.402 -10.239  -0.816
  204   HD12  ILE  33          1HD1      ILE  33  -6.469 -11.495  -2.054
  205   HD13  ILE  33          2HD1      ILE  33  -5.679  -9.957  -2.401
  206    H    GLU  34           H        GLU  34  -1.540  -8.032  -1.506
  207    HA   GLU  34           HA       GLU  34  -0.914  -6.857   1.111
  208    HB2  GLU  34           2HB      GLU  34   0.935  -7.023  -1.264
  209    HB3  GLU  34           1HB      GLU  34   1.353  -6.888   0.444
  210    HG2  GLU  34           2HG      GLU  34   0.373  -9.136   0.840
  211    HG3  GLU  34           1HG      GLU  34   0.036  -9.273  -0.885
  212    H    LEU  35           H        LEU  35  -0.486  -5.900  -2.311
  213    HA   LEU  35           HA       LEU  35  -0.012  -3.197  -1.865
  214    HB2  LEU  35           2HB      LEU  35  -1.139  -4.736  -4.182
  215    HB3  LEU  35           1HB      LEU  35  -1.101  -2.977  -4.243
  216    HG   LEU  35           HG       LEU  35   1.326  -4.675  -3.602
  217   HD11  LEU  35          1HD1      LEU  35   2.023  -4.250  -5.934
  218   HD12  LEU  35          2HD1      LEU  35   0.486  -3.444  -6.245
  219   HD13  LEU  35          3HD1      LEU  35   0.519  -5.169  -5.879
  220   HD21  LEU  35          3HD2      LEU  35   2.304  -2.371  -4.577
  221   HD22  LEU  35          1HD2      LEU  35   1.903  -2.556  -2.872
  222   HD23  LEU  35          2HD2      LEU  35   0.774  -1.753  -3.961
  223    H    LEU  36           H        LEU  36  -3.135  -4.757  -2.624
  224    HA   LEU  36           HA       LEU  36  -4.729  -2.466  -2.477
  225    HB2  LEU  36           2HB      LEU  36  -5.446  -5.308  -1.712
  226    HB3  LEU  36           1HB      LEU  36  -6.600  -4.014  -2.025
  227    HG   LEU  36           HG       LEU  36  -4.571  -5.068  -4.021
  228   HD11  LEU  36          1HD1      LEU  36  -6.566  -6.559  -3.379
  229   HD12  LEU  36          2HD1      LEU  36  -6.381  -6.181  -5.091
  230   HD13  LEU  36          3HD1      LEU  36  -7.583  -5.326  -4.124
  231   HD21  LEU  36          3HD2      LEU  36  -4.930  -2.877  -4.718
  232   HD22  LEU  36          1HD2      LEU  36  -6.552  -2.810  -4.027
  233   HD23  LEU  36          2HD2      LEU  36  -6.267  -3.687  -5.531
  234    H    ALA  37           H        ALA  37  -3.914  -4.805   0.082
  235    HA   ALA  37           HA       ALA  37  -5.342  -3.537   2.154
  236    HB1  ALA  37           1HB      ALA  37  -4.588  -5.768   2.523
  237    HB2  ALA  37           2HB      ALA  37  -3.681  -4.758   3.648
  238    HB3  ALA  37           3HB      ALA  37  -2.916  -5.337   2.168
  239    H    ALA  38           H        ALA  38  -2.132  -2.996   0.822
  240    HA   ALA  38           HA       ALA  38  -1.289  -1.203   2.904
  241    HB1  ALA  38           1HB      ALA  38   0.654  -0.837   1.572
  242    HB2  ALA  38           2HB      ALA  38  -0.163  -1.383   0.107
  243    HB3  ALA  38           3HB      ALA  38   0.238  -2.540   1.377
  244    H    CYS  39           H        CYS  39  -2.656  -0.845  -0.340
  245    HA   CYS  39           HA       CYS  39  -2.453   1.984  -0.468
  246    HB2  CYS  39           2HB      CYS  39  -2.811   0.506  -2.439
  247    HB3  CYS  39           1HB      CYS  39  -4.446   0.181  -1.861
  248    HG   CYS  39           HG       CYS  39  -4.966   2.763  -2.144
  249    H    ARG  40           H        ARG  40  -5.213  -0.147   0.296
  250    HA   ARG  40           HA       ARG  40  -7.083   1.846   0.863
  251    HB2  ARG  40           2HB      ARG  40  -6.778  -0.943   1.990
  252    HB3  ARG  40           1HB      ARG  40  -8.181   0.083   2.289
  253    HG2  ARG  40           2HG      ARG  40  -8.497   0.285  -0.188
  254    HG3  ARG  40           1HG      ARG  40  -7.185  -0.873  -0.409
  255    HD2  ARG  40           2HD      ARG  40  -8.911  -2.380  -0.398
  256    HD3  ARG  40           1HD      ARG  40  -8.704  -2.261   1.346
  257    HE   ARG  40           HE       ARG  40 -10.858  -1.057  -0.241
  258   HH11  ARG  40          1HH2      ARG  40  -9.241  -1.458   2.798
  259   HH12  ARG  40          2HH2      ARG  40 -10.586  -0.900   3.737
  260   HH21  ARG  40          1HH1      ARG  40 -12.615  -0.327   0.988
  261   HH22  ARG  40          2HH1      ARG  40 -12.493  -0.261   2.714
  262    H    GLU  41           H        GLU  41  -4.466   0.567   2.808
  263    HA   GLU  41           HA       GLU  41  -5.353   1.638   5.302
  264    HB2  GLU  41           2HB      GLU  41  -2.736   0.573   4.271
  265    HB3  GLU  41           1HB      GLU  41  -2.833   1.333   5.860
  266    HG2  GLU  41           2HG      GLU  41  -4.346  -0.286   6.676
  267    HG3  GLU  41           1HG      GLU  41  -4.766  -0.839   5.057
  268    H    GLU  42           H        GLU  42  -2.857   2.727   2.979
  269    HA   GLU  42           HA       GLU  42  -2.334   5.144   4.396
  270    HB2  GLU  42           2HB      GLU  42  -0.779   5.606   2.749
  271    HB3  GLU  42           1HB      GLU  42  -0.903   3.856   2.595
  272    HG2  GLU  42           2HG      GLU  42  -1.125   4.525   0.375
  273    HG3  GLU  42           1HG      GLU  42  -2.811   4.427   0.872
  274    H    PHE  43           H        PHE  43  -4.628   4.221   1.930
  275    HA   PHE  43           HA       PHE  43  -5.348   6.770   0.975
  276    HB2  PHE  43           2HB      PHE  43  -6.054   4.410   0.146
  277    HB3  PHE  43           1HB      PHE  43  -7.347   4.546   1.335
  278    HD1  PHE  43           1HD      PHE  43  -8.892   6.575   1.233
  279    HD2  PHE  43           2HD      PHE  43  -6.181   5.538  -1.935
  280    HE1  PHE  43           1HE      PHE  43 -10.187   7.989  -0.340
  281    HE2  PHE  43           2HE      PHE  43  -7.476   6.952  -3.507
  282    HZ   PHE  43           HZ       PHE  43  -9.480   8.178  -2.710
  283    H    HIS  44           H        HIS  44  -6.243   4.996   3.865
  284    HA   HIS  44           HA       HIS  44  -8.452   6.573   4.658
  285    HB2  HIS  44           2HB      HIS  44  -7.658   4.305   5.591
  286    HB3  HIS  44           1HB      HIS  44  -6.539   5.246   6.575
  287    HD2  HIS  44           2HD      HIS  44  -9.454   7.501   6.525
  288    HE1  HIS  44           1HE      HIS  44 -10.417   4.762   9.588
  289    HE2  HIS  44           2HE      HIS  44 -11.006   7.009   8.564
  290    H    ARG  45           H        ARG  45  -4.975   6.828   5.307
  291    HA   ARG  45           HA       ARG  45  -5.022   8.914   7.163
  292    HB2  ARG  45           2HB      ARG  45  -2.969   8.340   5.011
  293    HB3  ARG  45           1HB      ARG  45  -2.716   9.393   6.404
  294    HG2  ARG  45           2HG      ARG  45  -3.377   7.371   7.846
  295    HG3  ARG  45           1HG      ARG  45  -3.173   6.405   6.384
  296    HD2  ARG  45           2HD      ARG  45  -1.071   6.318   7.499
  297    HD3  ARG  45           1HD      ARG  45  -0.856   7.462   6.178
  298    HE   ARG  45           HE       ARG  45  -1.650   8.682   8.685
  299   HH11  ARG  45          1HH2      ARG  45   0.937   7.570   6.674
  300   HH12  ARG  45          2HH2      ARG  45   2.124   8.614   7.387
  301   HH21  ARG  45          1HH1      ARG  45  -0.101  10.052   9.625
  302   HH22  ARG  45          2HH1      ARG  45   1.535  10.017   9.057
  303    H    ARG  46           H        ARG  46  -5.056   9.004   3.619
  304    HA   ARG  46           HA       ARG  46  -4.747  11.732   3.197
  305    HB2  ARG  46           2HB      ARG  46  -6.625   9.918   1.665
  306    HB3  ARG  46           1HB      ARG  46  -5.862  11.397   1.079
  307    HG2  ARG  46           2HG      ARG  46  -4.395   8.883   1.935
  308    HG3  ARG  46           1HG      ARG  46  -4.658   9.399   0.268
  309    HD2  ARG  46           2HD      ARG  46  -3.525  11.632   1.087
  310    HD3  ARG  46           1HD      ARG  46  -2.879  10.606   2.364
  311    HE   ARG  46           HE       ARG  46  -1.509   9.581   0.786
  312   HH11  ARG  46          1HH2      ARG  46  -3.992  11.461  -0.722
  313   HH12  ARG  46          2HH2      ARG  46  -3.326  11.318  -2.314
  314   HH21  ARG  46          1HH1      ARG  46  -0.629   9.389  -1.299
  315   HH22  ARG  46          2HH1      ARG  46  -1.421  10.146  -2.640
  316    H    LEU  47           H        LEU  47  -7.563   9.928   4.268
  317    HA   LEU  47           HA       LEU  47  -9.390  12.136   3.992
  318    HB2  LEU  47           2HB      LEU  47  -9.856   9.768   5.785
  319    HB3  LEU  47           1HB      LEU  47 -11.023  10.688   4.833
  320    HG   LEU  47           HG       LEU  47  -8.893   8.813   3.764
  321   HD11  LEU  47          1HD1      LEU  47 -10.900   7.602   2.886
  322   HD12  LEU  47          2HD1      LEU  47 -11.925   8.728   3.773
  323   HD13  LEU  47          3HD1      LEU  47 -10.841   7.646   4.648
  324   HD21  LEU  47          3HD2      LEU  47 -10.792  10.729   2.392
  325   HD22  LEU  47          1HD2      LEU  47 -10.089   9.344   1.556
  326   HD23  LEU  47          2HD2      LEU  47  -9.043  10.611   2.199
  327    H    LYS  48           H        LYS  48  -7.269  10.911   6.486
  328    HA   LYS  48           HA       LYS  48  -8.409  12.788   8.454
  329    HB2  LYS  48           2HB      LYS  48  -7.938  10.295   8.955
  330    HB3  LYS  48           1HB      LYS  48  -6.242  10.771   9.009
  331    HG2  LYS  48           2HG      LYS  48  -6.724  12.416  10.755
  332    HG3  LYS  48           1HG      LYS  48  -8.446  12.042  10.662
  333    HD2  LYS  48           2HD      LYS  48  -7.804   9.628  11.208
  334    HD3  LYS  48           1HD      LYS  48  -6.208  10.252  11.622
  335    HE2  LYS  48           2HE      LYS  48  -8.851  10.821  12.952
  336    HE3  LYS  48           1HE      LYS  48  -7.339  10.285  13.684
  337    HZ1  LYS  48           3HZ      LYS  48  -7.866  12.952  12.489
  338    HZ2  LYS  48           1HZ      LYS  48  -6.368  12.442  13.096
  339    HZ3  LYS  48           2HZ      LYS  48  -7.696  12.604  14.143
  340    H    VAL  49           H        VAL  49  -6.028  12.715   6.137
  341    HA   VAL  49           HA       VAL  49  -3.819  13.875   7.468
  342    HB   VAL  49           HB       VAL  49  -3.973  12.858   5.088
  343   HG11  VAL  49          1HG1      VAL  49  -4.417  15.726   4.282
  344   HG12  VAL  49          2HG1      VAL  49  -5.789  14.643   4.511
  345   HG13  VAL  49          3HG1      VAL  49  -4.561  14.267   3.304
  346   HG21  VAL  49          3HG2      VAL  49  -1.939  13.880   6.110
  347   HG22  VAL  49          1HG2      VAL  49  -2.454  15.452   5.501
  348   HG23  VAL  49          2HG2      VAL  49  -2.036  14.165   4.372
  349    H    TYR  50           H        TYR  50  -6.828  15.060   7.356
  350    HA   TYR  50           HA       TYR  50  -5.909  17.876   7.307
  351    HB2  TYR  50           2HB      TYR  50  -7.505  17.080   5.431
  352    HB3  TYR  50           1HB      TYR  50  -8.736  17.039   6.692
  353    HD1  TYR  50           2HD      TYR  50  -6.208  19.251   5.066
  354    HD2  TYR  50           1HD      TYR  50  -9.781  19.029   7.439
  355    HE1  TYR  50           2HE      TYR  50  -6.492  21.705   4.865
  356    HE2  TYR  50           1HE      TYR  50 -10.066  21.484   7.238
  357    HH   TYR  50           HH       TYR  50  -7.731  23.460   5.397
  358    H    HIS  51           H        HIS  51  -5.815  16.248   9.609
  359    HA   HIS  51           HA       HIS  51  -6.426  16.257  11.823
  360    HB2  HIS  51           2HB      HIS  51  -6.129  18.737  11.413
  361    HB3  HIS  51           1HB      HIS  51  -7.875  18.830  11.175
  362    HD2  HIS  51           2HD      HIS  51  -5.320  18.268  14.105
  363    HE1  HIS  51           1HE      HIS  51  -9.192  18.505  15.770
  364    HE2  HIS  51           2HE      HIS  51  -6.713  18.398  16.310
  Start of MODEL   10
    1    H1   GLY   9           H        GLY   9   7.060 -13.862   4.827
    2    HA2  GLY   9           2HA      GLY   9   9.694 -13.394   4.365
    3    HA3  GLY   9           1HA      GLY   9   9.190 -14.242   2.905
    4    H    THR  10           H        THR  10  10.055 -11.853   2.357
    5    HA   THR  10           HA       THR  10   9.563  -9.830   1.422
    6    HB   THR  10           HB       THR  10   6.664 -10.389   1.221
    7    HG1  THR  10           1HG      THR  10   7.870 -11.915  -0.570
    8   HG21  THR  10          3HG2      THR  10   7.116  -9.821  -1.131
    9   HG22  THR  10          1HG2      THR  10   8.848  -9.819  -0.797
   10   HG23  THR  10          2HG2      THR  10   7.806  -8.608  -0.051
   11    H    LYS  11           H        LYS  11   8.986  -7.795   2.029
   12    HA   LYS  11           HA       LYS  11   7.370  -7.543   4.496
   13    HB2  LYS  11           2HB      LYS  11   8.852  -5.607   5.051
   14    HB3  LYS  11           1HB      LYS  11   9.666  -7.171   5.070
   15    HG2  LYS  11           2HG      LYS  11  10.825  -6.749   3.089
   16    HG3  LYS  11           1HG      LYS  11   9.657  -5.549   2.538
   17    HD2  LYS  11           2HD      LYS  11  10.401  -4.006   4.311
   18    HD3  LYS  11           1HD      LYS  11  11.573  -5.202   4.861
   19    HE2  LYS  11           2HE      LYS  11  11.551  -4.201   2.012
   20    HE3  LYS  11           1HE      LYS  11  12.444  -3.365   3.281
   21    HZ1  LYS  11           3HZ      LYS  11  12.764  -6.251   2.678
   22    HZ2  LYS  11           1HZ      LYS  11  13.728  -5.299   3.700
   23    HZ3  LYS  11           2HZ      LYS  11  13.755  -5.038   2.020
   24    H    LYS  12           H        LYS  12   5.854  -7.358   2.416
   25    HA   LYS  12           HA       LYS  12   4.594  -6.015   1.009
   26    HB2  LYS  12           2HB      LYS  12   4.925  -4.178   3.393
   27    HB3  LYS  12           1HB      LYS  12   3.673  -4.045   2.161
   28    HG2  LYS  12           2HG      LYS  12   2.474  -5.304   3.660
   29    HG3  LYS  12           1HG      LYS  12   3.312  -6.633   2.862
   30    HD2  LYS  12           2HD      LYS  12   3.574  -6.941   5.240
   31    HD3  LYS  12           1HD      LYS  12   5.132  -6.425   4.601
   32    HE2  LYS  12           2HE      LYS  12   5.052  -4.399   5.677
   33    HE3  LYS  12           1HE      LYS  12   3.306  -4.247   5.487
   34    HZ1  LYS  12           3HZ      LYS  12   3.621  -6.403   7.126
   35    HZ2  LYS  12           1HZ      LYS  12   3.180  -4.838   7.609
   36    HZ3  LYS  12           2HZ      LYS  12   4.810  -5.317   7.667
   37    H    TYR  13           H        TYR  13   4.534  -3.146   0.935
   38    HA   TYR  13           HA       TYR  13   7.164  -2.556  -0.296
   39    HB2  TYR  13           2HB      TYR  13   4.483  -1.545  -1.265
   40    HB3  TYR  13           1HB      TYR  13   6.048  -1.347  -2.051
   41    HD1  TYR  13           2HD      TYR  13   3.339  -3.714  -1.250
   42    HD2  TYR  13           1HD      TYR  13   7.125  -3.203  -3.214
   43    HE1  TYR  13           2HE      TYR  13   3.021  -5.876  -2.423
   44    HE2  TYR  13           1HE      TYR  13   6.808  -5.365  -4.387
   45    HH   TYR  13           HH       TYR  13   4.163  -7.519  -3.584
   46    H    ASP  14           H        ASP  14   7.716  -0.269  -0.374
   47    HA   ASP  14           HA       ASP  14   6.799   1.119   2.047
   48    HB2  ASP  14           2HB      ASP  14   8.777   2.621   1.517
   49    HB3  ASP  14           1HB      ASP  14   9.170   0.952   1.922
   50    H    LEU  15           H        LEU  15   5.084   2.396   1.739
   51    HA   LEU  15           HA       LEU  15   4.777   3.843  -0.801
   52    HB2  LEU  15           2HB      LEU  15   2.799   3.886   1.466
   53    HB3  LEU  15           1HB      LEU  15   2.510   4.092  -0.261
   54    HG   LEU  15           HG       LEU  15   3.327   1.523   1.126
   55   HD11  LEU  15          1HD1      LEU  15   1.007   1.881   1.497
   56   HD12  LEU  15          2HD1      LEU  15   1.077   0.811   0.096
   57   HD13  LEU  15          3HD1      LEU  15   0.767   2.533  -0.124
   58   HD21  LEU  15          3HD2      LEU  15   4.379   1.563  -1.038
   59   HD22  LEU  15          1HD2      LEU  15   2.929   2.224  -1.795
   60   HD23  LEU  15          2HD2      LEU  15   2.933   0.565  -1.198
   61    H    SER  16           H        SER  16   6.879   4.675   0.897
   62    HA   SER  16           HA       SER  16   6.550   6.625   2.738
   63    HB2  SER  16           2HB      SER  16   8.737   5.943   1.787
   64    HB3  SER  16           1HB      SER  16   8.376   6.876   0.337
   65    HG   SER  16           HG       SER  16   8.526   7.868   2.998
   66    H    LYS  17           H        LYS  17   5.851   6.913  -0.702
   67    HA   LYS  17           HA       LYS  17   4.174   9.223  -0.195
   68    HB2  LYS  17           2HB      LYS  17   5.341  10.615  -1.926
   69    HB3  LYS  17           1HB      LYS  17   6.268  10.383  -0.445
   70    HG2  LYS  17           2HG      LYS  17   6.895   8.201  -2.184
   71    HG3  LYS  17           1HG      LYS  17   7.007   9.681  -3.137
   72    HD2  LYS  17           2HD      LYS  17   8.473  10.674  -1.402
   73    HD3  LYS  17           1HD      LYS  17   8.388   9.168  -0.485
   74    HE2  LYS  17           2HE      LYS  17   9.485   7.945  -2.247
   75    HE3  LYS  17           1HE      LYS  17   9.372   9.320  -3.345
   76    HZ1  LYS  17           3HZ      LYS  17  11.078  10.379  -2.347
   77    HZ2  LYS  17           1HZ      LYS  17  11.529   8.803  -1.916
   78    HZ3  LYS  17           2HZ      LYS  17  10.707   9.783  -0.799
   79    H    TRP  18           H        TRP  18   2.460   9.145  -1.503
   80    HA   TRP  18           HA       TRP  18   2.691   7.890  -4.151
   81    HB2  TRP  18           2HB      TRP  18   1.045   6.904  -1.858
   82    HB3  TRP  18           1HB      TRP  18   0.347   6.818  -3.474
   83    HD1  TRP  18           HD       TRP  18   3.613   5.792  -1.674
   84    HE1  TRP  18           1HE      TRP  18   4.473   3.615  -2.754
   85    HE3  TRP  18           3HE      TRP  18   0.140   5.213  -5.371
   86    HZ2  TRP  18           2HZ      TRP  18   3.778   1.858  -4.902
   87    HZ3  TRP  18           3HZ      TRP  18   0.261   3.281  -6.919
   88    HH2  TRP  18           HH       TRP  18   2.073   1.603  -6.688
   89    H    LYS  19           H        LYS  19   0.616   8.210  -5.407
   90    HA   LYS  19           HA       LYS  19  -0.430  10.919  -4.845
   91    HB2  LYS  19           2HB      LYS  19  -0.109   9.370  -7.422
   92    HB3  LYS  19           1HB      LYS  19  -1.035  10.863  -7.309
   93    HG2  LYS  19           2HG      LYS  19   1.072  11.654  -7.946
   94    HG3  LYS  19           1HG      LYS  19   1.136  11.828  -6.194
   95    HD2  LYS  19           2HD      LYS  19   2.389   9.773  -5.967
   96    HD3  LYS  19           1HD      LYS  19   2.166   9.391  -7.674
   97    HE2  LYS  19           2HE      LYS  19   4.378  10.298  -7.456
   98    HE3  LYS  19           1HE      LYS  19   3.388  11.553  -8.203
   99    HZ1  LYS  19           3HZ      LYS  19   4.333  11.372  -5.411
  100    HZ2  LYS  19           1HZ      LYS  19   3.009  12.346  -5.829
  101    HZ3  LYS  19           2HZ      LYS  19   4.531  12.646  -6.519
  102    H    TYR  20           H        TYR  20  -2.597  11.290  -4.736
  103    HA   TYR  20           HA       TYR  20  -4.345   9.307  -3.907
  104    HB2  TYR  20           2HB      TYR  20  -4.775  11.707  -3.594
  105    HB3  TYR  20           1HB      TYR  20  -5.041  11.888  -5.328
  106    HD1  TYR  20           2HD      TYR  20  -6.952  10.679  -6.428
  107    HD2  TYR  20           1HD      TYR  20  -6.474  10.825  -2.162
  108    HE1  TYR  20           2HE      TYR  20  -9.320   9.996  -6.139
  109    HE2  TYR  20           1HE      TYR  20  -8.840  10.142  -1.873
  110    HH   TYR  20           HH       TYR  20 -10.612   9.127  -3.021
  111    H    ALA  21           H        ALA  21  -3.496  10.308  -7.145
  112    HA   ALA  21           HA       ALA  21  -5.661   8.899  -8.429
  113    HB1  ALA  21           1HB      ALA  21  -3.075   9.894  -9.647
  114    HB2  ALA  21           2HB      ALA  21  -4.511  10.893  -9.424
  115    HB3  ALA  21           3HB      ALA  21  -4.567   9.496 -10.499
  116    H    GLU  22           H        GLU  22  -2.256   8.279  -7.713
  117    HA   GLU  22           HA       GLU  22  -2.075   5.844  -9.187
  118    HB2  GLU  22           2HB      GLU  22  -0.432   7.024  -6.945
  119    HB3  GLU  22           1HB      GLU  22  -0.045   5.476  -7.697
  120    HG2  GLU  22           2HG      GLU  22  -0.433   8.008  -9.303
  121    HG3  GLU  22           1HG      GLU  22   1.140   7.515  -8.678
  122    H    LEU  23           H        LEU  23  -2.811   6.633  -5.815
  123    HA   LEU  23           HA       LEU  23  -2.865   3.995  -4.815
  124    HB2  LEU  23           2HB      LEU  23  -4.396   6.445  -3.912
  125    HB3  LEU  23           1HB      LEU  23  -4.230   4.958  -2.980
  126    HG   LEU  23           HG       LEU  23  -1.880   6.600  -3.960
  127   HD11  LEU  23          1HD1      LEU  23  -1.717   7.483  -1.695
  128   HD12  LEU  23          2HD1      LEU  23  -3.112   6.529  -1.189
  129   HD13  LEU  23          3HD1      LEU  23  -3.318   7.850  -2.340
  130   HD21  LEU  23          3HD2      LEU  23  -1.061   4.450  -3.508
  131   HD22  LEU  23          1HD2      LEU  23  -2.229   4.167  -2.215
  132   HD23  LEU  23          2HD2      LEU  23  -0.859   5.245  -1.948
  133    H    ARG  24           H        ARG  24  -5.509   6.085  -5.986
  134    HA   ARG  24           HA       ARG  24  -7.526   4.097  -5.710
  135    HB2  ARG  24           2HB      ARG  24  -7.852   6.624  -5.889
  136    HB3  ARG  24           1HB      ARG  24  -7.603   6.429  -7.624
  137    HG2  ARG  24           2HG      ARG  24  -9.909   6.205  -7.525
  138    HG3  ARG  24           1HG      ARG  24  -9.432   4.520  -7.336
  139    HD2  ARG  24           2HD      ARG  24  -9.397   5.081  -4.781
  140    HD3  ARG  24           1HD      ARG  24 -10.391   6.458  -5.244
  141    HE   ARG  24           HE       ARG  24 -11.683   4.410  -6.437
  142   HH11  ARG  24          1HH2      ARG  24 -10.393   4.867  -3.258
  143   HH12  ARG  24          2HH2      ARG  24 -11.572   3.860  -2.486
  144   HH21  ARG  24          1HH1      ARG  24 -13.232   3.087  -5.430
  145   HH22  ARG  24          2HH1      ARG  24 -13.179   2.853  -3.715
  146    H    ASP  25           H        ASP  25  -5.360   5.024  -8.328
  147    HA   ASP  25           HA       ASP  25  -6.645   3.483 -10.353
  148    HB2  ASP  25           2HB      ASP  25  -3.892   4.683 -10.082
  149    HB3  ASP  25           1HB      ASP  25  -4.370   3.743 -11.491
  150    H    THR  26           H        THR  26  -3.815   2.904  -8.269
  151    HA   THR  26           HA       THR  26  -3.027   0.433  -9.259
  152    HB   THR  26           HB       THR  26  -3.013   1.282  -6.353
  153    HG1  THR  26           1HG      THR  26  -1.758   2.247  -8.533
  154   HG21  THR  26          3HG2      THR  26  -1.368  -0.699  -7.949
  155   HG22  THR  26          1HG2      THR  26  -2.473  -1.066  -6.626
  156   HG23  THR  26          2HG2      THR  26  -0.980  -0.185  -6.307
  157    H    ILE  27           H        ILE  27  -5.648   1.237  -7.052
  158    HA   ILE  27           HA       ILE  27  -6.259  -1.511  -6.421
  159    HB   ILE  27           HB       ILE  27  -7.870   1.022  -6.014
  160   HG12  ILE  27          2HG1      ILE  27  -6.270  -0.575  -3.997
  161   HG13  ILE  27          1HG1      ILE  27  -5.602   0.813  -4.856
  162   HG21  ILE  27          1HG2      ILE  27  -9.407  -0.778  -5.905
  163   HG22  ILE  27          2HG2      ILE  27  -8.947  -0.498  -4.225
  164   HG23  ILE  27          3HG2      ILE  27  -8.236  -1.840  -5.123
  165   HD11  ILE  27          3HD1      ILE  27  -8.204   0.991  -3.333
  166   HD12  ILE  27          1HD1      ILE  27  -7.168   2.308  -3.882
  167   HD13  ILE  27          2HD1      ILE  27  -6.649   1.274  -2.551
  168    H    ASN  28           H        ASN  28  -7.300   0.867  -8.776
  169    HA   ASN  28           HA       ASN  28  -9.426  -0.911  -9.752
  170    HB2  ASN  28           2HB      ASN  28  -8.669   1.943 -10.381
  171    HB3  ASN  28           1HB      ASN  28  -9.887   1.053 -11.295
  172   HD21  ASN  28          1HD2      ASN  28  -9.083   1.863  -7.866
  173   HD22  ASN  28          2HD2      ASN  28 -10.701   2.012  -7.377
  174    H    THR  29           H        THR  29  -6.506  -1.474 -10.047
  175    HA   THR  29           HA       THR  29  -6.577  -2.078 -12.901
  176    HB   THR  29           HB       THR  29  -4.252  -1.176 -13.211
  177    HG1  THR  29           1HG      THR  29  -3.705  -1.001 -11.026
  178   HG21  THR  29          3HG2      THR  29  -4.985   1.060 -13.651
  179   HG22  THR  29          1HG2      THR  29  -6.233   0.963 -12.410
  180   HG23  THR  29          2HG2      THR  29  -6.389   0.020 -13.892
  181    H    SER  30           H        SER  30  -4.460  -2.106 -10.024
  182    HA   SER  30           HA       SER  30  -3.388  -4.709 -10.805
  183    HB2  SER  30           2HB      SER  30  -2.086  -2.704  -9.734
  184    HB3  SER  30           1HB      SER  30  -2.741  -3.322  -8.221
  185    HG   SER  30           HG       SER  30  -1.540  -5.074 -10.064
  186    H    CYS  31           H        CYS  31  -3.052  -6.200  -8.741
  187    HA   CYS  31           HA       CYS  31  -5.317  -6.262  -6.941
  188    HB2  CYS  31           2HB      CYS  31  -6.123  -7.283  -9.139
  189    HB3  CYS  31           1HB      CYS  31  -4.988  -8.597  -8.825
  190    HG   CYS  31           HG       CYS  31  -7.425  -9.080  -7.772
  191    H    ASP  32           H        ASP  32  -4.560  -6.963  -5.059
  192    HA   ASP  32           HA       ASP  32  -3.011  -9.312  -4.731
  193    HB2  ASP  32           2HB      ASP  32  -1.375  -7.438  -5.669
  194    HB3  ASP  32           1HB      ASP  32  -1.372  -6.923  -3.985
  195    H    ILE  33           H        ILE  33  -2.639  -9.808  -2.516
  196    HA   ILE  33           HA       ILE  33  -4.530  -8.553  -0.734
  197    HB   ILE  33           HB       ILE  33  -2.452 -10.621  -0.012
  198   HG12  ILE  33          2HG1      ILE  33  -3.580 -11.484  -1.967
  199   HG13  ILE  33          1HG1      ILE  33  -4.284 -12.279  -0.560
  200   HG21  ILE  33          1HG2      ILE  33  -4.283 -11.297   1.580
  201   HG22  ILE  33          2HG2      ILE  33  -5.179  -9.866   1.072
  202   HG23  ILE  33          3HG2      ILE  33  -3.625  -9.690   1.886
  203   HD11  ILE  33          3HD1      ILE  33  -6.160 -11.635  -1.843
  204   HD12  ILE  33          1HD1      ILE  33  -5.456 -10.070  -2.247
  205   HD13  ILE  33          2HD1      ILE  33  -6.043 -10.380  -0.612
  206    H    GLU  34           H        GLU  34  -1.329  -7.953  -1.600
  207    HA   GLU  34           HA       GLU  34  -0.637  -6.756   0.999
  208    HB2  GLU  34           2HB      GLU  34   1.126  -6.938  -1.445
  209    HB3  GLU  34           1HB      GLU  34   1.612  -6.697   0.234
  210    HG2  GLU  34           2HG      GLU  34   0.373  -9.199  -0.944
  211    HG3  GLU  34           1HG      GLU  34   2.032  -9.014  -0.378
  212    H    LEU  35           H        LEU  35  -0.353  -5.836  -2.450
  213    HA   LEU  35           HA       LEU  35   0.059  -3.115  -2.054
  214    HB2  LEU  35           2HB      LEU  35  -1.209  -4.644  -4.321
  215    HB3  LEU  35           1HB      LEU  35  -1.007  -2.896  -4.383
  216    HG   LEU  35           HG       LEU  35   1.255  -4.844  -3.855
  217   HD11  LEU  35          1HD1      LEU  35   1.900  -4.570  -6.153
  218   HD12  LEU  35          2HD1      LEU  35   0.667  -3.337  -6.414
  219   HD13  LEU  35          3HD1      LEU  35   0.194  -5.015  -6.154
  220   HD21  LEU  35          3HD2      LEU  35   2.440  -2.604  -4.758
  221   HD22  LEU  35          1HD2      LEU  35   2.078  -2.839  -3.049
  222   HD23  LEU  35          2HD2      LEU  35   1.001  -1.868  -4.053
  223    H    LEU  36           H        LEU  36  -3.047  -4.771  -2.678
  224    HA   LEU  36           HA       LEU  36  -4.690  -2.515  -2.507
  225    HB2  LEU  36           2HB      LEU  36  -5.317  -5.362  -1.680
  226    HB3  LEU  36           1HB      LEU  36  -6.509  -4.098  -1.984
  227    HG   LEU  36           HG       LEU  36  -4.515  -5.161  -4.010
  228   HD11  LEU  36          1HD1      LEU  36  -7.463  -5.633  -3.539
  229   HD12  LEU  36          2HD1      LEU  36  -6.180  -6.829  -3.718
  230   HD13  LEU  36          3HD1      LEU  36  -6.722  -5.902  -5.116
  231   HD21  LEU  36          3HD2      LEU  36  -6.248  -3.805  -5.503
  232   HD22  LEU  36          1HD2      LEU  36  -4.892  -2.985  -4.733
  233   HD23  LEU  36          2HD2      LEU  36  -6.495  -2.906  -4.006
  234    H    ALA  37           H        ALA  37  -3.718  -4.792   0.052
  235    HA   ALA  37           HA       ALA  37  -5.099  -3.460   2.142
  236    HB1  ALA  37           1HB      ALA  37  -4.209  -5.823   2.214
  237    HB2  ALA  37           2HB      ALA  37  -3.839  -4.852   3.638
  238    HB3  ALA  37           3HB      ALA  37  -2.597  -5.138   2.417
  239    H    ALA  38           H        ALA  38  -1.908  -3.084   0.720
  240    HA   ALA  38           HA       ALA  38  -0.930  -1.292   2.747
  241    HB1  ALA  38           1HB      ALA  38   0.451  -2.754   1.135
  242    HB2  ALA  38           2HB      ALA  38   1.012  -1.108   1.425
  243    HB3  ALA  38           3HB      ALA  38   0.144  -1.495  -0.060
  244    H    CYS  39           H        CYS  39  -2.555  -0.970  -0.351
  245    HA   CYS  39           HA       CYS  39  -2.162   1.851  -0.611
  246    HB2  CYS  39           2HB      CYS  39  -2.661   0.434  -2.551
  247    HB3  CYS  39           1HB      CYS  39  -4.237   0.039  -1.868
  248    HG   CYS  39           HG       CYS  39  -3.457   2.758  -3.123
  249    H    ARG  40           H        ARG  40  -4.958  -0.134   0.375
  250    HA   ARG  40           HA       ARG  40  -6.778   1.875   0.919
  251    HB2  ARG  40           2HB      ARG  40  -6.318  -0.794   2.250
  252    HB3  ARG  40           1HB      ARG  40  -7.665   0.258   2.689
  253    HG2  ARG  40           2HG      ARG  40  -8.388   0.282   0.309
  254    HG3  ARG  40           1HG      ARG  40  -7.084  -0.841  -0.079
  255    HD2  ARG  40           2HD      ARG  40  -9.004  -2.208   0.228
  256    HD3  ARG  40           1HD      ARG  40  -8.078  -2.374   1.717
  257    HE   ARG  40           HE       ARG  40  -9.850  -1.391   2.834
  258   HH11  ARG  40          1HH2      ARG  40  -9.954  -0.619  -0.537
  259   HH12  ARG  40          2HH2      ARG  40 -11.473   0.208  -0.442
  260   HH21  ARG  40          1HH1      ARG  40 -11.842  -0.309   2.967
  261   HH22  ARG  40          2HH1      ARG  40 -12.542   0.383   1.542
  262    H    GLU  41           H        GLU  41  -4.044   0.788   2.852
  263    HA   GLU  41           HA       GLU  41  -4.674   2.026   5.286
  264    HB2  GLU  41           2HB      GLU  41  -2.059   1.354   3.948
  265    HB3  GLU  41           1HB      GLU  41  -2.106   2.146   5.522
  266    HG2  GLU  41           2HG      GLU  41  -3.238   0.320   6.530
  267    HG3  GLU  41           1HG      GLU  41  -3.669  -0.377   4.970
  268    H    GLU  42           H        GLU  42  -2.963   3.296   2.439
  269    HA   GLU  42           HA       GLU  42  -2.500   5.877   3.591
  270    HB2  GLU  42           2HB      GLU  42  -2.298   4.729   0.816
  271    HB3  GLU  42           1HB      GLU  42  -2.126   6.463   1.084
  272    HG2  GLU  42           2HG      GLU  42  -0.544   4.454   2.685
  273    HG3  GLU  42           1HG      GLU  42   0.029   5.049   1.129
  274    H    PHE  43           H        PHE  43  -4.839   4.602   1.233
  275    HA   PHE  43           HA       PHE  43  -6.212   6.901   0.586
  276    HB2  PHE  43           2HB      PHE  43  -6.609   4.551  -0.291
  277    HB3  PHE  43           1HB      PHE  43  -7.581   4.270   1.153
  278    HD1  PHE  43           1HD      PHE  43  -7.331   6.140  -2.011
  279    HD2  PHE  43           2HD      PHE  43  -9.707   5.421   1.494
  280    HE1  PHE  43           1HE      PHE  43  -9.258   7.270  -3.087
  281    HE2  PHE  43           2HE      PHE  43 -11.635   6.550   0.420
  282    HZ   PHE  43           HZ       PHE  43 -11.410   7.476  -1.871
  283    H    HIS  44           H        HIS  44  -6.362   5.020   3.545
  284    HA   HIS  44           HA       HIS  44  -8.688   6.296   4.612
  285    HB2  HIS  44           2HB      HIS  44  -7.575   4.049   5.301
  286    HB3  HIS  44           1HB      HIS  44  -6.524   5.053   6.296
  287    HD2  HIS  44           2HD      HIS  44  -9.613   6.985   6.611
  288    HE1  HIS  44           1HE      HIS  44 -10.199   3.868   9.396
  289    HE2  HIS  44           2HE      HIS  44 -11.020   6.150   8.644
  290    H    ARG  45           H        ARG  45  -5.213   6.879   4.819
  291    HA   ARG  45           HA       ARG  45  -5.365   8.904   6.824
  292    HB2  ARG  45           2HB      ARG  45  -3.238   8.315   4.753
  293    HB3  ARG  45           1HB      ARG  45  -3.049   9.446   6.094
  294    HG2  ARG  45           2HG      ARG  45  -3.690   7.485   7.625
  295    HG3  ARG  45           1HG      ARG  45  -3.428   6.450   6.222
  296    HD2  ARG  45           2HD      ARG  45  -1.387   6.595   7.594
  297    HD3  ARG  45           1HD      ARG  45  -1.130   7.314   6.007
  298    HE   ARG  45           HE       ARG  45  -1.873   9.445   7.513
  299   HH11  ARG  45          1HH2      ARG  45   0.431   6.896   7.917
  300   HH12  ARG  45          2HH2      ARG  45   1.535   7.854   8.847
  301   HH21  ARG  45          1HH1      ARG  45  -0.432  10.707   8.733
  302   HH22  ARG  45          2HH1      ARG  45   1.046  10.012   9.310
  303    H    ARG  46           H        ARG  46  -5.655   8.877   3.336
  304    HA   ARG  46           HA       ARG  46  -5.269  11.630   2.850
  305    HB2  ARG  46           2HB      ARG  46  -7.055   9.707   1.337
  306    HB3  ARG  46           1HB      ARG  46  -6.416  11.235   0.733
  307    HG2  ARG  46           2HG      ARG  46  -4.492   9.173   1.768
  308    HG3  ARG  46           1HG      ARG  46  -5.190   8.955   0.165
  309    HD2  ARG  46           2HD      ARG  46  -4.271  10.988  -0.633
  310    HD3  ARG  46           1HD      ARG  46  -3.920  11.565   0.994
  311    HE   ARG  46           HE       ARG  46  -2.439   9.255   0.730
  312   HH11  ARG  46          1HH2      ARG  46  -2.781  12.245  -0.980
  313   HH12  ARG  46          2HH2      ARG  46  -1.144  12.271  -1.542
  314   HH21  ARG  46          1HH1      ARG  46  -0.290   9.282  -0.005
  315   HH22  ARG  46          2HH1      ARG  46   0.268  10.592  -0.989
  316    H    LEU  47           H        LEU  47  -8.061   9.782   3.926
  317    HA   LEU  47           HA       LEU  47 -10.046  11.744   3.507
  318    HB2  LEU  47           2HB      LEU  47 -10.053   9.792   5.806
  319    HB3  LEU  47           1HB      LEU  47 -11.431  10.444   4.917
  320    HG   LEU  47           HG       LEU  47  -9.362   8.475   3.917
  321   HD11  LEU  47          1HD1      LEU  47 -11.397   7.742   5.303
  322   HD12  LEU  47          2HD1      LEU  47 -11.188   6.961   3.736
  323   HD13  LEU  47          3HD1      LEU  47 -12.375   8.251   3.926
  324   HD21  LEU  47          3HD2      LEU  47 -10.820   8.586   1.794
  325   HD22  LEU  47          1HD2      LEU  47  -9.710   9.929   2.066
  326   HD23  LEU  47          2HD2      LEU  47 -11.425  10.114   2.434
  327    H    LYS  48           H        LYS  48  -7.902  11.106   6.258
  328    HA   LYS  48           HA       LYS  48  -9.011  13.073   7.980
  329    HB2  LYS  48           2HB      LYS  48  -6.312  11.722   7.888
  330    HB3  LYS  48           1HB      LYS  48  -6.763  12.874   9.146
  331    HG2  LYS  48           2HG      LYS  48  -8.641  11.487   9.817
  332    HG3  LYS  48           1HG      LYS  48  -8.348  10.378   8.477
  333    HD2  LYS  48           2HD      LYS  48  -6.286   9.628   9.418
  334    HD3  LYS  48           1HD      LYS  48  -6.262  10.946  10.592
  335    HE2  LYS  48           2HE      LYS  48  -8.072  10.011  11.830
  336    HE3  LYS  48           1HE      LYS  48  -8.473   8.884  10.534
  337    HZ1  LYS  48           3HZ      LYS  48  -5.820   8.814  11.819
  338    HZ2  LYS  48           1HZ      LYS  48  -6.630   7.584  10.981
  339    HZ3  LYS  48           2HZ      LYS  48  -7.146   8.030  12.536
  340    H    VAL  49           H        VAL  49  -6.356  13.127   5.638
  341    HA   VAL  49           HA       VAL  49  -6.487  16.066   5.638
  342    HB   VAL  49           HB       VAL  49  -4.625  15.410   7.140
  343   HG11  VAL  49          1HG1      VAL  49  -3.340  14.226   4.671
  344   HG12  VAL  49          2HG1      VAL  49  -4.197  13.240   5.856
  345   HG13  VAL  49          3HG1      VAL  49  -2.762  14.146   6.336
  346   HG21  VAL  49          3HG2      VAL  49  -3.620  16.515   4.501
  347   HG22  VAL  49          1HG2      VAL  49  -2.968  16.836   6.108
  348   HG23  VAL  49          2HG2      VAL  49  -4.556  17.459   5.659
  349    H    TYR  50           H        TYR  50  -6.368  16.924   3.640
  350    HA   TYR  50           HA       TYR  50  -6.242  15.117   1.374
  351    HB2  TYR  50           2HB      TYR  50  -6.423  18.107   1.152
  352    HB3  TYR  50           1HB      TYR  50  -7.129  16.869   0.113
  353    HD1  TYR  50           1HD      TYR  50  -8.534  15.068   1.802
  354    HD2  TYR  50           2HD      TYR  50  -8.094  19.318   2.247
  355    HE1  TYR  50           1HE      TYR  50 -10.631  15.147   3.123
  356    HE2  TYR  50           2HE      TYR  50 -10.190  19.396   3.568
  357    HH   TYR  50           HH       TYR  50 -11.612  16.732   4.916
  358    H    HIS  51           H        HIS  51  -5.187  17.372  -0.308
  359    HA   HIS  51           HA       HIS  51  -3.172  17.753  -1.368
  360    HB2  HIS  51           2HB      HIS  51  -3.180  19.337   0.611
  361    HB3  HIS  51           1HB      HIS  51  -2.158  18.167   1.448
  362    HD2  HIS  51           2HD      HIS  51  -0.796  17.768  -1.907
  363    HE1  HIS  51           1HE      HIS  51   1.115  21.292  -0.577
  364    HE2  HIS  51           2HE      HIS  51   1.159  19.448  -2.324
  Start of MODEL   11
    1    H1   GLY   9           H        GLY   9  10.555 -13.342  -4.680
    2    HA2  GLY   9           2HA      GLY   9   9.479 -13.626  -2.136
    3    HA3  GLY   9           1HA      GLY   9  11.206 -13.929  -1.972
    4    H    THR  10           H        THR  10   9.717 -11.732  -0.834
    5    HA   THR  10           HA       THR  10  11.386  -9.553  -1.779
    6    HB   THR  10           HB       THR  10   9.367  -9.448  -3.247
    7    HG1  THR  10           1HG      THR  10  10.575  -7.577  -2.068
    8   HG21  THR  10          3HG2      THR  10   7.209  -9.011  -2.332
    9   HG22  THR  10          1HG2      THR  10   7.868  -8.755  -0.716
   10   HG23  THR  10          2HG2      THR  10   7.847 -10.374  -1.414
   11    H    LYS  11           H        LYS  11   9.851  -7.523  -0.506
   12    HA   LYS  11           HA       LYS  11   9.495  -8.354   2.265
   13    HB2  LYS  11           2HB      LYS  11  11.977  -7.847   1.869
   14    HB3  LYS  11           1HB      LYS  11  11.481  -6.168   1.665
   15    HG2  LYS  11           2HG      LYS  11  10.326  -6.325   3.907
   16    HG3  LYS  11           1HG      LYS  11  11.083  -7.906   4.112
   17    HD2  LYS  11           2HD      LYS  11  13.314  -6.739   3.659
   18    HD3  LYS  11           1HD      LYS  11  12.443  -5.218   3.859
   19    HE2  LYS  11           2HE      LYS  11  13.343  -5.736   6.010
   20    HE3  LYS  11           1HE      LYS  11  11.627  -6.135   6.098
   21    HZ1  LYS  11           3HZ      LYS  11  13.948  -7.928   5.958
   22    HZ2  LYS  11           1HZ      LYS  11  12.465  -8.451   5.320
   23    HZ3  LYS  11           2HZ      LYS  11  12.576  -8.014   6.957
   24    H    LYS  12           H        LYS  12   7.357  -7.661   1.912
   25    HA   LYS  12           HA       LYS  12   5.616  -6.154   1.655
   26    HB2  LYS  12           2HB      LYS  12   7.322  -4.312   3.313
   27    HB3  LYS  12           1HB      LYS  12   5.580  -4.570   3.385
   28    HG2  LYS  12           2HG      LYS  12   7.723  -6.554   4.205
   29    HG3  LYS  12           1HG      LYS  12   6.635  -5.681   5.285
   30    HD2  LYS  12           2HD      LYS  12   4.711  -6.765   3.995
   31    HD3  LYS  12           1HD      LYS  12   5.926  -7.822   3.274
   32    HE2  LYS  12           2HE      LYS  12   4.903  -8.868   5.268
   33    HE3  LYS  12           1HE      LYS  12   6.624  -8.567   5.516
   34    HZ1  LYS  12           3HZ      LYS  12   4.702  -6.495   6.299
   35    HZ2  LYS  12           1HZ      LYS  12   6.216  -6.871   6.966
   36    HZ3  LYS  12           2HZ      LYS  12   4.873  -7.860   7.297
   37    H    TYR  13           H        TYR  13   5.735  -3.302   1.821
   38    HA   TYR  13           HA       TYR  13   7.354  -2.485  -0.489
   39    HB2  TYR  13           2HB      TYR  13   4.391  -1.906  -0.368
   40    HB3  TYR  13           1HB      TYR  13   5.500  -1.602  -1.706
   41    HD1  TYR  13           1HD      TYR  13   6.457  -3.501  -3.003
   42    HD2  TYR  13           2HD      TYR  13   3.459  -4.091   0.018
   43    HE1  TYR  13           1HE      TYR  13   6.000  -5.769  -3.900
   44    HE2  TYR  13           2HE      TYR  13   3.003  -6.357  -0.880
   45    HH   TYR  13           HH       TYR  13   3.946  -8.029  -2.216
   46    H    ASP  14           H        ASP  14   7.507  -0.166  -0.718
   47    HA   ASP  14           HA       ASP  14   7.015   1.253   1.836
   48    HB2  ASP  14           2HB      ASP  14   9.059   2.024  -0.241
   49    HB3  ASP  14           1HB      ASP  14   8.968   2.531   1.445
   50    H    LEU  15           H        LEU  15   5.249   2.482   1.643
   51    HA   LEU  15           HA       LEU  15   4.747   3.886  -0.907
   52    HB2  LEU  15           2HB      LEU  15   2.781   3.715   1.363
   53    HB3  LEU  15           1HB      LEU  15   2.471   3.937  -0.357
   54    HG   LEU  15           HG       LEU  15   3.522   1.403   0.941
   55   HD11  LEU  15          1HD1      LEU  15   1.284   0.533   0.063
   56   HD12  LEU  15          2HD1      LEU  15   0.828   2.221  -0.170
   57   HD13  LEU  15          3HD1      LEU  15   1.195   1.622   1.448
   58   HD21  LEU  15          3HD2      LEU  15   2.858   2.111  -1.933
   59   HD22  LEU  15          1HD2      LEU  15   3.103   0.461  -1.365
   60   HD23  LEU  15          2HD2      LEU  15   4.428   1.622  -1.298
   61    H    SER  16           H        SER  16   6.760   4.757   0.978
   62    HA   SER  16           HA       SER  16   6.214   6.658   2.811
   63    HB2  SER  16           2HB      SER  16   8.491   6.308   2.279
   64    HB3  SER  16           1HB      SER  16   8.240   6.701   0.580
   65    HG   SER  16           HG       SER  16   9.195   8.415   1.826
   66    H    LYS  17           H        LYS  17   5.953   7.094  -0.699
   67    HA   LYS  17           HA       LYS  17   4.128   9.349  -0.241
   68    HB2  LYS  17           2HB      LYS  17   6.700   9.470  -1.807
   69    HB3  LYS  17           1HB      LYS  17   5.357  10.559  -2.152
   70    HG2  LYS  17           2HG      LYS  17   5.397  11.439   0.095
   71    HG3  LYS  17           1HG      LYS  17   6.568  10.222   0.604
   72    HD2  LYS  17           2HD      LYS  17   8.193  11.150  -1.042
   73    HD3  LYS  17           1HD      LYS  17   7.035  12.425  -1.421
   74    HE2  LYS  17           2HE      LYS  17   8.473  11.927   1.188
   75    HE3  LYS  17           1HE      LYS  17   8.483  13.387   0.200
   76    HZ1  LYS  17           3HZ      LYS  17   6.093  12.295   1.583
   77    HZ2  LYS  17           1HZ      LYS  17   6.179  13.750   0.714
   78    HZ3  LYS  17           2HZ      LYS  17   7.048  13.575   2.164
   79    H    TRP  18           H        TRP  18   2.407   9.231  -1.538
   80    HA   TRP  18           HA       TRP  18   2.619   7.892  -4.144
   81    HB2  TRP  18           2HB      TRP  18   0.982   6.984  -1.814
   82    HB3  TRP  18           1HB      TRP  18   0.262   6.869  -3.416
   83    HD1  TRP  18           HD       TRP  18   3.566   5.864  -1.665
   84    HE1  TRP  18           1HE      TRP  18   4.371   3.641  -2.691
   85    HE3  TRP  18           3HE      TRP  18  -0.030   5.182  -5.224
   86    HZ2  TRP  18           2HZ      TRP  18   3.590   1.813  -4.745
   87    HZ3  TRP  18           3HZ      TRP  18   0.022   3.191  -6.700
   88    HH2  TRP  18           HH       TRP  18   1.825   1.505  -6.464
   89    H    LYS  19           H        LYS  19   0.542   8.205  -5.408
   90    HA   LYS  19           HA       LYS  19  -0.482  10.934  -4.899
   91    HB2  LYS  19           2HB      LYS  19  -0.571   9.443  -7.522
   92    HB3  LYS  19           1HB      LYS  19  -0.785  11.171  -7.244
   93    HG2  LYS  19           2HG      LYS  19   1.778   9.612  -6.785
   94    HG3  LYS  19           1HG      LYS  19   1.466  10.707  -8.133
   95    HD2  LYS  19           2HD      LYS  19   0.972  12.487  -6.318
   96    HD3  LYS  19           1HD      LYS  19   1.781  11.379  -5.209
   97    HE2  LYS  19           2HE      LYS  19   2.922  12.817  -7.597
   98    HE3  LYS  19           1HE      LYS  19   3.537  12.759  -5.946
   99    HZ1  LYS  19           3HZ      LYS  19   3.926  10.344  -6.303
  100    HZ2  LYS  19           1HZ      LYS  19   4.885  11.350  -7.274
  101    HZ3  LYS  19           2HZ      LYS  19   3.535  10.564  -7.941
  102    H    TYR  20           H        TYR  20  -2.654  11.335  -4.864
  103    HA   TYR  20           HA       TYR  20  -4.430   9.379  -4.006
  104    HB2  TYR  20           2HB      TYR  20  -4.757  11.854  -3.804
  105    HB3  TYR  20           1HB      TYR  20  -5.179  11.891  -5.517
  106    HD1  TYR  20           2HD      TYR  20  -7.217  10.758  -6.341
  107    HD2  TYR  20           1HD      TYR  20  -6.261  10.913  -2.156
  108    HE1  TYR  20           2HE      TYR  20  -9.540  10.090  -5.785
  109    HE2  TYR  20           1HE      TYR  20  -8.583  10.245  -1.600
  110    HH   TYR  20           HH       TYR  20 -10.600   9.782  -2.392
  111    H    ALA  21           H        ALA  21  -3.577  10.368  -7.256
  112    HA   ALA  21           HA       ALA  21  -5.731   8.925  -8.522
  113    HB1  ALA  21           1HB      ALA  21  -4.513  10.961  -9.471
  114    HB2  ALA  21           2HB      ALA  21  -4.766   9.613 -10.580
  115    HB3  ALA  21           3HB      ALA  21  -3.184   9.863  -9.840
  116    H    GLU  22           H        GLU  22  -2.303   8.367  -7.861
  117    HA   GLU  22           HA       GLU  22  -2.058   5.961  -9.342
  118    HB2  GLU  22           2HB      GLU  22  -0.506   7.127  -7.033
  119    HB3  GLU  22           1HB      GLU  22  -0.081   5.578  -7.761
  120    HG2  GLU  22           2HG      GLU  22  -0.437   8.078  -9.420
  121    HG3  GLU  22           1HG      GLU  22   1.112   7.655  -8.693
  122    H    LEU  23           H        LEU  23  -2.708   6.587  -5.898
  123    HA   LEU  23           HA       LEU  23  -2.833   3.938  -5.018
  124    HB2  LEU  23           2HB      LEU  23  -4.454   6.309  -4.057
  125    HB3  LEU  23           1HB      LEU  23  -4.212   4.806  -3.169
  126    HG   LEU  23           HG       LEU  23  -1.878   6.465  -4.128
  127   HD11  LEU  23          1HD1      LEU  23  -3.575   6.795  -1.656
  128   HD12  LEU  23          2HD1      LEU  23  -2.998   8.034  -2.769
  129   HD13  LEU  23          3HD1      LEU  23  -1.872   7.256  -1.656
  130   HD21  LEU  23          3HD2      LEU  23  -2.303   4.310  -2.041
  131   HD22  LEU  23          1HD2      LEU  23  -0.858   5.318  -2.074
  132   HD23  LEU  23          2HD2      LEU  23  -1.229   4.267  -3.439
  133    H    ARG  24           H        ARG  24  -5.403   6.015  -6.334
  134    HA   ARG  24           HA       ARG  24  -7.453   4.043  -6.113
  135    HB2  ARG  24           2HB      ARG  24  -7.775   6.558  -6.321
  136    HB3  ARG  24           1HB      ARG  24  -7.410   6.371  -8.036
  137    HG2  ARG  24           2HG      ARG  24  -9.720   6.150  -8.093
  138    HG3  ARG  24           1HG      ARG  24  -9.258   4.462  -7.877
  139    HD2  ARG  24           2HD      ARG  24  -9.566   4.685  -5.441
  140    HD3  ARG  24           1HD      ARG  24 -10.012   6.374  -5.648
  141    HE   ARG  24           HE       ARG  24 -11.716   4.116  -6.052
  142   HH11  ARG  24          1HH2      ARG  24 -10.921   7.277  -7.212
  143   HH12  ARG  24          2HH2      ARG  24 -12.505   7.599  -7.836
  144   HH21  ARG  24          1HH1      ARG  24 -13.796   4.528  -6.868
  145   HH22  ARG  24          2HH1      ARG  24 -14.132   6.041  -7.643
  146    H    ASP  25           H        ASP  25  -5.360   5.123  -8.770
  147    HA   ASP  25           HA       ASP  25  -6.479   3.510 -10.788
  148    HB2  ASP  25           2HB      ASP  25  -4.957   5.367 -11.275
  149    HB3  ASP  25           1HB      ASP  25  -3.637   4.504 -10.489
  150    H    THR  26           H        THR  26  -3.680   2.937  -8.656
  151    HA   THR  26           HA       THR  26  -2.908   0.445  -9.610
  152    HB   THR  26           HB       THR  26  -2.867   1.484  -6.767
  153    HG1  THR  26           1HG      THR  26  -1.604   2.760  -7.985
  154   HG21  THR  26          3HG2      THR  26  -2.586  -0.885  -6.647
  155   HG22  THR  26          1HG2      THR  26  -0.962  -0.202  -6.579
  156   HG23  THR  26          2HG2      THR  26  -1.560  -0.905  -8.081
  157    H    ILE  27           H        ILE  27  -5.353   1.234  -7.156
  158    HA   ILE  27           HA       ILE  27  -6.042  -1.461  -6.561
  159    HB   ILE  27           HB       ILE  27  -7.602   1.113  -6.221
  160   HG12  ILE  27          2HG1      ILE  27  -6.182  -0.540  -4.122
  161   HG13  ILE  27          1HG1      ILE  27  -5.360   0.748  -5.003
  162   HG21  ILE  27          1HG2      ILE  27  -9.226  -0.610  -6.150
  163   HG22  ILE  27          2HG2      ILE  27  -8.795  -0.357  -4.459
  164   HG23  ILE  27          3HG2      ILE  27  -8.128  -1.729  -5.345
  165   HD11  ILE  27          3HD1      ILE  27  -7.969   1.172  -3.530
  166   HD12  ILE  27          1HD1      ILE  27  -6.889   2.404  -4.183
  167   HD13  ILE  27          2HD1      ILE  27  -6.392   1.446  -2.788
  168    H    ASN  28           H        ASN  28  -7.113   0.852  -8.976
  169    HA   ASN  28           HA       ASN  28  -9.234  -0.956  -9.895
  170    HB2  ASN  28           2HB      ASN  28  -8.448   1.867 -10.616
  171    HB3  ASN  28           1HB      ASN  28  -9.639   0.953 -11.542
  172   HD21  ASN  28          1HD2      ASN  28  -9.036   2.550  -8.449
  173   HD22  ASN  28          2HD2      ASN  28 -10.629   2.428  -7.875
  174    H    THR  29           H        THR  29  -6.327  -1.575 -10.152
  175    HA   THR  29           HA       THR  29  -6.386  -2.268 -12.991
  176    HB   THR  29           HB       THR  29  -3.973  -1.486 -13.210
  177    HG1  THR  29           1HG      THR  29  -3.150  -0.309 -11.657
  178   HG21  THR  29          3HG2      THR  29  -6.039   0.681 -12.750
  179   HG22  THR  29          1HG2      THR  29  -5.960  -0.320 -14.201
  180   HG23  THR  29          2HG2      THR  29  -4.630   0.769 -13.808
  181    H    SER  30           H        SER  30  -4.253  -2.290 -10.123
  182    HA   SER  30           HA       SER  30  -3.274  -4.942 -10.807
  183    HB2  SER  30           2HB      SER  30  -1.955  -2.972  -9.702
  184    HB3  SER  30           1HB      SER  30  -2.697  -3.544  -8.211
  185    HG   SER  30           HG       SER  30  -1.226  -5.141 -10.046
  186    H    CYS  31           H        CYS  31  -3.054  -6.401  -8.681
  187    HA   CYS  31           HA       CYS  31  -5.417  -6.388  -7.010
  188    HB2  CYS  31           2HB      CYS  31  -6.297  -7.419  -9.063
  189    HB3  CYS  31           1HB      CYS  31  -5.008  -8.621  -9.015
  190    HG   CYS  31           HG       CYS  31  -7.533  -9.008  -7.616
  191    H    ASP  32           H        ASP  32  -4.782  -7.055  -5.073
  192    HA   ASP  32           HA       ASP  32  -3.297  -9.420  -4.604
  193    HB2  ASP  32           2HB      ASP  32  -1.576  -7.592  -5.484
  194    HB3  ASP  32           1HB      ASP  32  -1.660  -7.048  -3.811
  195    H    ILE  33           H        ILE  33  -2.951  -9.809  -2.330
  196    HA   ILE  33           HA       ILE  33  -4.943  -8.477  -0.691
  197    HB   ILE  33           HB       ILE  33  -3.003 -10.620   0.181
  198   HG12  ILE  33          2HG1      ILE  33  -4.041 -11.475  -1.822
  199   HG13  ILE  33          1HG1      ILE  33  -4.874 -12.207  -0.451
  200   HG21  ILE  33          1HG2      ILE  33  -4.932 -11.189   1.680
  201   HG22  ILE  33          2HG2      ILE  33  -5.767  -9.756   1.078
  202   HG23  ILE  33          3HG2      ILE  33  -4.261  -9.586   1.980
  203   HD11  ILE  33          3HD1      ILE  33  -5.827  -9.980  -2.249
  204   HD12  ILE  33          1HD1      ILE  33  -6.534 -10.232  -0.653
  205   HD13  ILE  33          2HD1      ILE  33  -6.629 -11.504  -1.869
  206    H    GLU  34           H        GLU  34  -1.674  -8.050  -1.389
  207    HA   GLU  34           HA       GLU  34  -1.054  -6.842   1.220
  208    HB2  GLU  34           2HB      GLU  34   0.803  -7.130  -1.140
  209    HB3  GLU  34           1HB      GLU  34   1.227  -6.883   0.554
  210    HG2  GLU  34           2HG      GLU  34   0.078  -9.108   1.031
  211    HG3  GLU  34           1HG      GLU  34   0.034  -9.357  -0.713
  212    H    LEU  35           H        LEU  35  -0.601  -5.979  -2.226
  213    HA   LEU  35           HA       LEU  35  -0.083  -3.272  -1.848
  214    HB2  LEU  35           2HB      LEU  35  -1.313  -4.798  -4.136
  215    HB3  LEU  35           1HB      LEU  35  -1.094  -3.052  -4.220
  216    HG   LEU  35           HG       LEU  35   1.131  -5.022  -3.609
  217   HD11  LEU  35          1HD1      LEU  35   0.688  -3.488  -6.180
  218   HD12  LEU  35          2HD1      LEU  35   0.111  -5.139  -5.949
  219   HD13  LEU  35          3HD1      LEU  35   1.839  -4.791  -5.879
  220   HD21  LEU  35          3HD2      LEU  35   2.358  -2.780  -4.484
  221   HD22  LEU  35          1HD2      LEU  35   1.977  -3.041  -2.784
  222   HD23  LEU  35          2HD2      LEU  35   0.918  -2.046  -3.780
  223    H    LEU  36           H        LEU  36  -3.226  -4.811  -2.560
  224    HA   LEU  36           HA       LEU  36  -4.795  -2.501  -2.471
  225    HB2  LEU  36           2HB      LEU  36  -5.531  -5.316  -1.631
  226    HB3  LEU  36           1HB      LEU  36  -6.680  -4.019  -1.959
  227    HG   LEU  36           HG       LEU  36  -4.685  -5.144  -3.950
  228   HD11  LEU  36          1HD1      LEU  36  -6.531  -6.232  -4.988
  229   HD12  LEU  36          2HD1      LEU  36  -7.702  -5.338  -4.020
  230   HD13  LEU  36          3HD1      LEU  36  -6.701  -6.580  -3.269
  231   HD21  LEU  36          3HD2      LEU  36  -6.373  -3.753  -5.469
  232   HD22  LEU  36          1HD2      LEU  36  -4.995  -2.967  -4.697
  233   HD23  LEU  36          2HD2      LEU  36  -6.602  -2.838  -3.980
  234    H    ALA  37           H        ALA  37  -4.002  -4.775   0.155
  235    HA   ALA  37           HA       ALA  37  -5.395  -3.372   2.180
  236    HB1  ALA  37           1HB      ALA  37  -3.050  -5.277   2.308
  237    HB2  ALA  37           2HB      ALA  37  -4.752  -5.658   2.565
  238    HB3  ALA  37           3HB      ALA  37  -3.886  -4.659   3.733
  239    H    ALA  38           H        ALA  38  -2.148  -3.101   0.859
  240    HA   ALA  38           HA       ALA  38  -1.207  -1.268   2.868
  241    HB1  ALA  38           1HB      ALA  38   0.786  -1.160   1.606
  242    HB2  ALA  38           2HB      ALA  38  -0.036  -1.598   0.109
  243    HB3  ALA  38           3HB      ALA  38   0.206  -2.809   1.368
  244    H    CYS  39           H        CYS  39  -2.774  -1.019  -0.253
  245    HA   CYS  39           HA       CYS  39  -2.276   1.769  -0.643
  246    HB2  CYS  39           2HB      CYS  39  -2.960  -0.020  -2.383
  247    HB3  CYS  39           1HB      CYS  39  -4.606   0.274  -1.824
  248    HG   CYS  39           HG       CYS  39  -3.901   1.922  -3.838
  249    H    ARG  40           H        ARG  40  -5.161  -0.052   0.398
  250    HA   ARG  40           HA       ARG  40  -6.865   2.091   0.865
  251    HB2  ARG  40           2HB      ARG  40  -6.647  -0.552   2.318
  252    HB3  ARG  40           1HB      ARG  40  -7.990   0.575   2.512
  253    HG2  ARG  40           2HG      ARG  40  -8.607   0.372   0.200
  254    HG3  ARG  40           1HG      ARG  40  -7.127  -0.510  -0.179
  255    HD2  ARG  40           2HD      ARG  40  -8.915  -2.122  -0.014
  256    HD3  ARG  40           1HD      ARG  40  -7.888  -2.315   1.405
  257    HE   ARG  40           HE       ARG  40  -9.793  -0.579   2.267
  258   HH11  ARG  40          1HH2      ARG  40  -9.860  -3.618   0.614
  259   HH12  ARG  40          2HH2      ARG  40 -11.374  -4.111   1.294
  260   HH21  ARG  40          1HH1      ARG  40 -11.780  -1.219   3.162
  261   HH22  ARG  40          2HH1      ARG  40 -12.461  -2.753   2.736
  262    H    GLU  41           H        GLU  41  -4.237   0.852   2.840
  263    HA   GLU  41           HA       GLU  41  -4.838   2.074   5.280
  264    HB2  GLU  41           2HB      GLU  41  -2.252   1.314   3.943
  265    HB3  GLU  41           1HB      GLU  41  -2.249   2.135   5.503
  266    HG2  GLU  41           2HG      GLU  41  -3.935  -0.322   5.030
  267    HG3  GLU  41           1HG      GLU  41  -2.248  -0.450   5.518
  268    H    GLU  42           H        GLU  42  -2.847   3.335   2.596
  269    HA   GLU  42           HA       GLU  42  -2.455   5.891   3.792
  270    HB2  GLU  42           2HB      GLU  42  -2.350   5.390   0.825
  271    HB3  GLU  42           1HB      GLU  42  -1.377   6.496   1.794
  272    HG2  GLU  42           2HG      GLU  42  -1.238   3.472   1.792
  273    HG3  GLU  42           1HG      GLU  42   0.002   4.591   1.227
  274    H    PHE  43           H        PHE  43  -4.739   4.640   1.389
  275    HA   PHE  43           HA       PHE  43  -5.982   6.960   0.570
  276    HB2  PHE  43           2HB      PHE  43  -6.460   4.575  -0.179
  277    HB3  PHE  43           1HB      PHE  43  -7.498   4.438   1.240
  278    HD1  PHE  43           1HD      PHE  43  -9.418   6.069   1.528
  279    HD2  PHE  43           2HD      PHE  43  -7.189   5.730  -2.128
  280    HE1  PHE  43           1HE      PHE  43 -11.244   7.221   0.308
  281    HE2  PHE  43           2HE      PHE  43  -9.015   6.883  -3.348
  282    HZ   PHE  43           HZ       PHE  43 -11.042   7.629  -2.130
  283    H    HIS  44           H        HIS  44  -6.423   5.182   3.584
  284    HA   HIS  44           HA       HIS  44  -8.661   6.711   4.492
  285    HB2  HIS  44           2HB      HIS  44  -6.702   4.894   5.898
  286    HB3  HIS  44           1HB      HIS  44  -8.034   5.693   6.733
  287    HD2  HIS  44           2HD      HIS  44  -8.879   4.464   3.149
  288    HE1  HIS  44           1HE      HIS  44 -10.555   1.681   5.846
  289    HE2  HIS  44           2HE      HIS  44 -10.462   2.404   3.413
  290    H    ARG  45           H        ARG  45  -5.167   6.993   4.839
  291    HA   ARG  45           HA       ARG  45  -5.136   8.913   6.909
  292    HB2  ARG  45           2HB      ARG  45  -3.176   8.257   4.709
  293    HB3  ARG  45           1HB      ARG  45  -2.855   9.491   5.929
  294    HG2  ARG  45           2HG      ARG  45  -3.174   7.820   7.713
  295    HG3  ARG  45           1HG      ARG  45  -3.503   6.583   6.499
  296    HD2  ARG  45           2HD      ARG  45  -1.105   6.689   7.420
  297    HD3  ARG  45           1HD      ARG  45  -1.286   6.646   5.668
  298    HE   ARG  45           HE       ARG  45  -1.146   9.315   6.808
  299   HH11  ARG  45          1HH2      ARG  45   0.542   6.597   5.490
  300   HH12  ARG  45          2HH2      ARG  45   1.929   7.516   5.009
  301   HH21  ARG  45          1HH1      ARG  45   0.670  10.528   6.182
  302   HH22  ARG  45          2HH1      ARG  45   2.003   9.741   5.400
  303    H    ARG  46           H        ARG  46  -5.831   9.164   3.517
  304    HA   ARG  46           HA       ARG  46  -5.307  11.953   3.230
  305    HB2  ARG  46           2HB      ARG  46  -7.356  10.466   1.604
  306    HB3  ARG  46           1HB      ARG  46  -6.272  11.766   1.104
  307    HG2  ARG  46           2HG      ARG  46  -5.531   8.901   1.738
  308    HG3  ARG  46           1HG      ARG  46  -5.397   9.719   0.184
  309    HD2  ARG  46           2HD      ARG  46  -3.848  11.385   1.478
  310    HD3  ARG  46           1HD      ARG  46  -3.727  10.085   2.658
  311    HE   ARG  46           HE       ARG  46  -2.534   8.803   1.084
  312   HH11  ARG  46          1HH2      ARG  46  -3.756  11.758  -0.246
  313   HH12  ARG  46          2HH2      ARG  46  -2.772  11.685  -1.670
  314   HH21  ARG  46          1HH1      ARG  46  -1.242   8.705  -0.782
  315   HH22  ARG  46          2HH1      ARG  46  -1.351   9.957  -1.973
  316    H    LEU  47           H        LEU  47  -8.255  10.079   3.904
  317    HA   LEU  47           HA       LEU  47 -10.057  12.235   3.963
  318    HB2  LEU  47           2HB      LEU  47 -10.034   9.508   5.233
  319    HB3  LEU  47           1HB      LEU  47 -11.327  10.651   5.596
  320    HG   LEU  47           HG       LEU  47 -11.914  10.823   3.250
  321   HD11  LEU  47          1HD1      LEU  47  -9.807  10.721   2.147
  322   HD12  LEU  47          2HD1      LEU  47 -10.667   9.271   1.625
  323   HD13  LEU  47          3HD1      LEU  47  -9.420   9.158   2.868
  324   HD21  LEU  47          3HD2      LEU  47 -11.441   7.896   3.885
  325   HD22  LEU  47          1HD2      LEU  47 -12.705   8.571   2.859
  326   HD23  LEU  47          2HD2      LEU  47 -12.740   8.850   4.601
  327    H    LYS  48           H        LYS  48  -8.058  10.798   6.516
  328    HA   LYS  48           HA       LYS  48  -8.982  12.096   8.752
  329    HB2  LYS  48           2HB      LYS  48  -6.141  11.461   7.938
  330    HB3  LYS  48           1HB      LYS  48  -6.574  12.057   9.541
  331    HG2  LYS  48           2HG      LYS  48  -8.070   9.702   8.431
  332    HG3  LYS  48           1HG      LYS  48  -6.443   9.446   9.058
  333    HD2  LYS  48           2HD      LYS  48  -8.402  11.014  10.713
  334    HD3  LYS  48           1HD      LYS  48  -8.533   9.257  10.670
  335    HE2  LYS  48           2HE      LYS  48  -5.894  10.611  11.220
  336    HE3  LYS  48           1HE      LYS  48  -7.048  10.289  12.513
  337    HZ1  LYS  48           3HZ      LYS  48  -6.408   8.104  10.680
  338    HZ2  LYS  48           1HZ      LYS  48  -6.774   8.056  12.335
  339    HZ3  LYS  48           2HZ      LYS  48  -5.229   8.543  11.822
  340    H    VAL  49           H        VAL  49  -6.121  13.301   7.003
  341    HA   VAL  49           HA       VAL  49  -6.845  16.037   7.818
  342    HB   VAL  49           HB       VAL  49  -4.577  15.222   8.381
  343   HG11  VAL  49          1HG1      VAL  49  -3.006  14.607   6.712
  344   HG12  VAL  49          2HG1      VAL  49  -4.016  15.237   5.411
  345   HG13  VAL  49          3HG1      VAL  49  -4.487  13.763   6.259
  346   HG21  VAL  49          3HG2      VAL  49  -5.046  17.639   7.882
  347   HG22  VAL  49          1HG2      VAL  49  -4.545  17.349   6.217
  348   HG23  VAL  49          2HG2      VAL  49  -3.384  17.167   7.531
  349    H    TYR  50           H        TYR  50  -7.578  17.478   6.387
  350    HA   TYR  50           HA       TYR  50  -8.186  16.738   3.714
  351    HB2  TYR  50           2HB      TYR  50  -8.534  19.359   3.572
  352    HB3  TYR  50           1HB      TYR  50  -9.642  18.353   4.505
  353    HD1  TYR  50           2HD      TYR  50  -9.451  18.216   6.975
  354    HD2  TYR  50           1HD      TYR  50  -7.012  20.888   4.658
  355    HE1  TYR  50           2HE      TYR  50  -8.870  19.471   9.033
  356    HE2  TYR  50           1HE      TYR  50  -6.429  22.142   6.717
  357    HH   TYR  50           HH       TYR  50  -8.084  21.665   9.686
  358    H    HIS  51           H        HIS  51  -5.971  16.024   3.129
  359    HA   HIS  51           HA       HIS  51  -3.916  16.323   2.124
  360    HB2  HIS  51           2HB      HIS  51  -5.619  17.152   0.418
  361    HB3  HIS  51           1HB      HIS  51  -5.191  18.785   0.928
  362    HD2  HIS  51           2HD      HIS  51  -3.799  15.989  -1.347
  363    HE1  HIS  51           1HE      HIS  51  -0.785  18.928  -1.044
  364    HE2  HIS  51           2HE      HIS  51  -1.504  16.825  -2.270
  Start of MODEL   12
    1    H1   GLY   9           H        GLY   9   9.795 -16.122   1.500
    2    HA2  GLY   9           2HA      GLY   9   6.946 -15.630   1.535
    3    HA3  GLY   9           1HA      GLY   9   7.927 -16.202   2.881
    4    H    THR  10           H        THR  10   9.125 -13.424   1.287
    5    HA   THR  10           HA       THR  10   7.761 -11.546   3.069
    6    HB   THR  10           HB       THR  10  10.054 -10.608   3.720
    7    HG1  THR  10           1HG      THR  10  11.260 -11.828   2.240
    8   HG21  THR  10          3HG2      THR  10   8.546 -11.853   5.259
    9   HG22  THR  10          1HG2      THR  10  10.250 -12.149   5.607
   10   HG23  THR  10          2HG2      THR  10   9.302 -13.360   4.744
   11    H    LYS  11           H        LYS  11   7.189  -9.871   1.855
   12    HA   LYS  11           HA       LYS  11   9.021  -8.460   0.188
   13    HB2  LYS  11           2HB      LYS  11   8.520 -10.446  -1.258
   14    HB3  LYS  11           1HB      LYS  11   6.830  -9.944  -1.273
   15    HG2  LYS  11           2HG      LYS  11   7.452  -7.785  -2.255
   16    HG3  LYS  11           1HG      LYS  11   9.156  -8.234  -2.200
   17    HD2  LYS  11           2HD      LYS  11   7.244 -10.066  -3.612
   18    HD3  LYS  11           1HD      LYS  11   7.734  -8.579  -4.420
   19    HE2  LYS  11           2HE      LYS  11  10.028  -9.190  -4.400
   20    HE3  LYS  11           1HE      LYS  11   9.763 -10.460  -3.205
   21    HZ1  LYS  11           3HZ      LYS  11   8.144 -11.308  -5.094
   22    HZ2  LYS  11           1HZ      LYS  11   9.790 -11.721  -5.067
   23    HZ3  LYS  11           2HZ      LYS  11   9.246 -10.467  -6.077
   24    H    LYS  12           H        LYS  12   8.339  -6.612   1.173
   25    HA   LYS  12           HA       LYS  12   5.475  -5.906   0.939
   26    HB2  LYS  12           2HB      LYS  12   6.021  -4.195   2.703
   27    HB3  LYS  12           1HB      LYS  12   6.174  -5.867   3.236
   28    HG2  LYS  12           2HG      LYS  12   8.621  -4.633   2.064
   29    HG3  LYS  12           1HG      LYS  12   8.114  -4.018   3.635
   30    HD2  LYS  12           2HD      LYS  12   8.071  -6.324   4.525
   31    HD3  LYS  12           1HD      LYS  12   8.597  -6.936   2.957
   32    HE2  LYS  12           2HE      LYS  12  10.131  -5.141   4.848
   33    HE3  LYS  12           1HE      LYS  12  10.571  -6.760   4.302
   34    HZ1  LYS  12           3HZ      LYS  12  10.720  -5.870   2.032
   35    HZ2  LYS  12           1HZ      LYS  12  11.824  -5.133   3.087
   36    HZ3  LYS  12           2HZ      LYS  12  10.409  -4.310   2.631
   37    H    TYR  13           H        TYR  13   5.687  -3.176   1.281
   38    HA   TYR  13           HA       TYR  13   7.490  -2.142  -0.773
   39    HB2  TYR  13           2HB      TYR  13   4.529  -1.628  -1.023
   40    HB3  TYR  13           1HB      TYR  13   5.802  -1.287  -2.195
   41    HD1  TYR  13           2HD      TYR  13   6.937  -3.153  -3.398
   42    HD2  TYR  13           1HD      TYR  13   3.554  -3.818  -0.836
   43    HE1  TYR  13           2HE      TYR  13   6.612  -5.395  -4.408
   44    HE2  TYR  13           1HE      TYR  13   3.229  -6.059  -1.846
   45    HH   TYR  13           HH       TYR  13   4.355  -6.998  -4.636
   46    H    ASP  14           H        ASP  14   7.956   0.011  -0.518
   47    HA   ASP  14           HA       ASP  14   6.960   1.247   1.954
   48    HB2  ASP  14           2HB      ASP  14   9.158   2.311   0.188
   49    HB3  ASP  14           1HB      ASP  14   8.888   2.607   1.904
   50    H    LEU  15           H        LEU  15   5.174   2.434   1.696
   51    HA   LEU  15           HA       LEU  15   4.764   3.939  -0.794
   52    HB2  LEU  15           2HB      LEU  15   2.783   3.807   1.463
   53    HB3  LEU  15           1HB      LEU  15   2.490   3.998  -0.264
   54    HG   LEU  15           HG       LEU  15   3.485   1.485   1.114
   55   HD11  LEU  15          1HD1      LEU  15   0.850   2.314  -0.113
   56   HD12  LEU  15          2HD1      LEU  15   1.148   1.697   1.513
   57   HD13  LEU  15          3HD1      LEU  15   1.279   0.621   0.122
   58   HD21  LEU  15          3HD2      LEU  15   4.500   1.644  -1.082
   59   HD22  LEU  15          1HD2      LEU  15   2.968   2.136  -1.803
   60   HD23  LEU  15          2HD2      LEU  15   3.166   0.495  -1.190
   61    H    SER  16           H        SER  16   6.780   4.773   1.127
   62    HA   SER  16           HA       SER  16   6.206   6.703   2.937
   63    HB2  SER  16           2HB      SER  16   8.298   7.763   2.390
   64    HB3  SER  16           1HB      SER  16   8.498   6.029   2.161
   65    HG   SER  16           HG       SER  16   9.201   7.600   0.427
   66    H    LYS  17           H        LYS  17   6.034   7.050  -0.577
   67    HA   LYS  17           HA       LYS  17   4.318   9.407  -0.222
   68    HB2  LYS  17           2HB      LYS  17   6.907   9.341  -1.760
   69    HB3  LYS  17           1HB      LYS  17   5.621  10.474  -2.175
   70    HG2  LYS  17           2HG      LYS  17   5.668  11.449   0.033
   71    HG3  LYS  17           1HG      LYS  17   6.779  10.207   0.611
   72    HD2  LYS  17           2HD      LYS  17   8.519  10.998  -0.899
   73    HD3  LYS  17           1HD      LYS  17   7.412  12.178  -1.600
   74    HE2  LYS  17           2HE      LYS  17   7.150  13.129   0.758
   75    HE3  LYS  17           1HE      LYS  17   8.531  12.128   1.208
   76    HZ1  LYS  17           3HZ      LYS  17   9.579  14.042   0.596
   77    HZ2  LYS  17           1HZ      LYS  17   8.420  14.453  -0.573
   78    HZ3  LYS  17           2HZ      LYS  17   9.562  13.240  -0.903
   79    H    TRP  18           H        TRP  18   2.602   9.320  -1.528
   80    HA   TRP  18           HA       TRP  18   2.767   7.908  -4.094
   81    HB2  TRP  18           2HB      TRP  18   1.147   7.052  -1.736
   82    HB3  TRP  18           1HB      TRP  18   0.397   6.931  -3.325
   83    HD1  TRP  18           HD       TRP  18   3.673   5.860  -1.573
   84    HE1  TRP  18           1HE      TRP  18   4.442   3.627  -2.604
   85    HE3  TRP  18           3HE      TRP  18   0.105   5.280  -5.177
   86    HZ2  TRP  18           2HZ      TRP  18   3.647   1.829  -4.682
   87    HZ3  TRP  18           3HZ      TRP  18   0.133   3.299  -6.666
   88    HH2  TRP  18           HH       TRP  18   1.897   1.573  -6.423
   89    H    LYS  19           H        LYS  19   0.690   8.221  -5.349
   90    HA   LYS  19           HA       LYS  19  -0.285  10.977  -4.902
   91    HB2  LYS  19           2HB      LYS  19   0.005   9.294  -7.392
   92    HB3  LYS  19           1HB      LYS  19  -0.962  10.765  -7.360
   93    HG2  LYS  19           2HG      LYS  19   1.154  11.512  -8.088
   94    HG3  LYS  19           1HG      LYS  19   1.148  11.898  -6.370
   95    HD2  LYS  19           2HD      LYS  19   2.505  10.005  -5.839
   96    HD3  LYS  19           1HD      LYS  19   2.275   9.301  -7.440
   97    HE2  LYS  19           2HE      LYS  19   3.622  10.968  -8.478
   98    HE3  LYS  19           1HE      LYS  19   3.595  11.991  -7.041
   99    HZ1  LYS  19           3HZ      LYS  19   5.387  10.958  -6.296
  100    HZ2  LYS  19           1HZ      LYS  19   5.440  10.009  -7.700
  101    HZ3  LYS  19           2HZ      LYS  19   4.584   9.461  -6.339
  102    H    TYR  20           H        TYR  20  -2.448  11.417  -4.816
  103    HA   TYR  20           HA       TYR  20  -4.232   9.539  -3.832
  104    HB2  TYR  20           2HB      TYR  20  -4.627  11.940  -3.647
  105    HB3  TYR  20           1HB      TYR  20  -4.846  12.059  -5.393
  106    HD1  TYR  20           2HD      TYR  20  -6.231  10.514  -2.299
  107    HD2  TYR  20           1HD      TYR  20  -6.927  11.525  -6.416
  108    HE1  TYR  20           2HE      TYR  20  -8.625   9.918  -2.041
  109    HE2  TYR  20           1HE      TYR  20  -9.320  10.930  -6.158
  110    HH   TYR  20           HH       TYR  20 -10.749  10.361  -3.078
  111    H    ALA  21           H        ALA  21  -3.406  10.299  -7.144
  112    HA   ALA  21           HA       ALA  21  -5.624   8.835  -8.283
  113    HB1  ALA  21           1HB      ALA  21  -4.425  10.794  -9.380
  114    HB2  ALA  21           2HB      ALA  21  -4.676   9.378 -10.400
  115    HB3  ALA  21           3HB      ALA  21  -3.090   9.684  -9.691
  116    H    GLU  22           H        GLU  22  -2.151   8.290  -7.792
  117    HA   GLU  22           HA       GLU  22  -1.974   5.805  -9.103
  118    HB2  GLU  22           2HB      GLU  22  -0.381   7.041  -6.857
  119    HB3  GLU  22           1HB      GLU  22   0.017   5.463  -7.539
  120    HG2  GLU  22           2HG      GLU  22  -0.334   7.909  -9.279
  121    HG3  GLU  22           1HG      GLU  22   1.219   7.499  -8.551
  122    H    LEU  23           H        LEU  23  -2.606   6.603  -5.696
  123    HA   LEU  23           HA       LEU  23  -2.754   3.994  -4.692
  124    HB2  LEU  23           2HB      LEU  23  -4.309   6.440  -3.818
  125    HB3  LEU  23           1HB      LEU  23  -4.090   4.974  -2.865
  126    HG   LEU  23           HG       LEU  23  -1.767   6.599  -3.915
  127   HD11  LEU  23          1HD1      LEU  23  -3.203   7.987  -2.430
  128   HD12  LEU  23          2HD1      LEU  23  -1.633   7.640  -1.705
  129   HD13  LEU  23          3HD1      LEU  23  -3.062   6.752  -1.178
  130   HD21  LEU  23          3HD2      LEU  23  -0.712   5.424  -1.856
  131   HD22  LEU  23          1HD2      LEU  23  -1.022   4.441  -3.285
  132   HD23  LEU  23          2HD2      LEU  23  -2.123   4.367  -1.909
  133    H    ARG  24           H        ARG  24  -5.337   6.085  -5.972
  134    HA   ARG  24           HA       ARG  24  -7.392   4.126  -5.678
  135    HB2  ARG  24           2HB      ARG  24  -7.975   6.467  -5.780
  136    HB3  ARG  24           1HB      ARG  24  -7.228   6.628  -7.370
  137    HG2  ARG  24           2HG      ARG  24  -8.998   5.659  -8.449
  138    HG3  ARG  24           1HG      ARG  24  -9.273   4.488  -7.160
  139    HD2  ARG  24           2HD      ARG  24 -10.572   5.980  -5.905
  140    HD3  ARG  24           1HD      ARG  24  -9.895   7.395  -6.704
  141    HE   ARG  24           HE       ARG  24 -11.494   7.153  -8.369
  142   HH11  ARG  24          1HH2      ARG  24 -11.210   4.266  -6.483
  143   HH12  ARG  24          2HH2      ARG  24 -12.577   3.491  -7.212
  144   HH21  ARG  24          1HH1      ARG  24 -13.288   6.142  -9.330
  145   HH22  ARG  24          2HH1      ARG  24 -13.753   4.552  -8.823
  146    H    ASP  25           H        ASP  25  -5.294   5.115  -8.352
  147    HA   ASP  25           HA       ASP  25  -6.526   3.558 -10.363
  148    HB2  ASP  25           2HB      ASP  25  -4.980   5.343 -10.930
  149    HB3  ASP  25           1HB      ASP  25  -3.668   4.512 -10.096
  150    H    THR  26           H        THR  26  -3.721   2.885  -8.268
  151    HA   THR  26           HA       THR  26  -3.031   0.382  -9.251
  152    HB   THR  26           HB       THR  26  -2.986   1.137  -6.326
  153    HG1  THR  26           1HG      THR  26  -1.757   2.698  -6.963
  154   HG21  THR  26          3HG2      THR  26  -2.394  -1.211  -7.006
  155   HG22  THR  26          1HG2      THR  26  -1.070  -0.336  -6.239
  156   HG23  THR  26          2HG2      THR  26  -1.094  -0.542  -7.990
  157    H    ILE  27           H        ILE  27  -5.564   1.265  -6.953
  158    HA   ILE  27           HA       ILE  27  -6.282  -1.453  -6.349
  159    HB   ILE  27           HB       ILE  27  -7.771   1.148  -5.915
  160   HG12  ILE  27          2HG1      ILE  27  -6.270  -0.585  -3.932
  161   HG13  ILE  27          1HG1      ILE  27  -5.539   0.800  -4.744
  162   HG21  ILE  27          1HG2      ILE  27  -8.970  -0.319  -4.177
  163   HG22  ILE  27          2HG2      ILE  27  -8.310  -1.699  -5.054
  164   HG23  ILE  27          3HG2      ILE  27  -9.405  -0.580  -5.866
  165   HD11  ILE  27          3HD1      ILE  27  -7.046   2.329  -3.726
  166   HD12  ILE  27          1HD1      ILE  27  -6.571   1.233  -2.430
  167   HD13  ILE  27          2HD1      ILE  27  -8.135   1.039  -3.220
  168    H    ASN  28           H        ASN  28  -7.259   0.954  -8.699
  169    HA   ASN  28           HA       ASN  28  -9.474  -0.730  -9.640
  170    HB2  ASN  28           2HB      ASN  28  -8.574   2.077 -10.286
  171    HB3  ASN  28           1HB      ASN  28  -9.806   1.242 -11.231
  172   HD21  ASN  28          1HD2      ASN  28  -9.064   1.906  -7.754
  173   HD22  ASN  28          2HD2      ASN  28 -10.683   2.178  -7.320
  174    H    THR  29           H        THR  29  -6.442  -1.206  -9.967
  175    HA   THR  29           HA       THR  29  -6.620  -1.967 -12.796
  176    HB   THR  29           HB       THR  29  -4.292  -1.127 -13.180
  177    HG1  THR  29           1HG      THR  29  -4.332  -0.811 -10.617
  178   HG21  THR  29          3HG2      THR  29  -6.286   1.006 -12.369
  179   HG22  THR  29          1HG2      THR  29  -6.313   0.136 -13.903
  180   HG23  THR  29          2HG2      THR  29  -4.958   1.196 -13.513
  181    H    SER  30           H        SER  30  -4.483  -1.983  -9.936
  182    HA   SER  30           HA       SER  30  -3.431  -4.598 -10.673
  183    HB2  SER  30           2HB      SER  30  -2.172  -2.590  -9.533
  184    HB3  SER  30           1HB      SER  30  -2.858  -3.256  -8.053
  185    HG   SER  30           HG       SER  30  -1.434  -4.783  -9.976
  186    H    CYS  31           H        CYS  31  -3.184  -6.126  -8.642
  187    HA   CYS  31           HA       CYS  31  -5.487  -6.174  -6.889
  188    HB2  CYS  31           2HB      CYS  31  -6.403  -8.273  -7.684
  189    HB3  CYS  31           1HB      CYS  31  -6.385  -7.118  -9.015
  190    HG   CYS  31           HG       CYS  31  -4.045  -8.333  -9.730
  191    H    ASP  32           H        ASP  32  -4.787  -6.931  -5.003
  192    HA   ASP  32           HA       ASP  32  -3.279  -9.313  -4.703
  193    HB2  ASP  32           2HB      ASP  32  -1.590  -7.459  -5.557
  194    HB3  ASP  32           1HB      ASP  32  -1.636  -6.951  -3.871
  195    H    ILE  33           H        ILE  33  -2.800  -9.781  -2.451
  196    HA   ILE  33           HA       ILE  33  -4.770  -8.587  -0.684
  197    HB   ILE  33           HB       ILE  33  -2.743 -10.774  -0.152
  198   HG12  ILE  33          2HG1      ILE  33  -5.696 -11.041  -0.771
  199   HG13  ILE  33          1HG1      ILE  33  -4.444 -11.185  -2.006
  200   HG21  ILE  33          1HG2      ILE  33  -4.530 -11.320   1.634
  201   HG22  ILE  33          2HG2      ILE  33  -5.112  -9.676   1.367
  202   HG23  ILE  33          3HG2      ILE  33  -3.469  -9.947   1.946
  203   HD11  ILE  33          3HD1      ILE  33  -4.488 -12.846   0.527
  204   HD12  ILE  33          1HD1      ILE  33  -3.447 -13.070  -0.878
  205   HD13  ILE  33          2HD1      ILE  33  -5.177 -13.388  -1.004
  206    H    GLU  34           H        GLU  34  -1.598  -7.928  -1.528
  207    HA   GLU  34           HA       GLU  34  -0.918  -6.808   1.115
  208    HB2  GLU  34           2HB      GLU  34   0.912  -6.974  -1.274
  209    HB3  GLU  34           1HB      GLU  34   1.343  -6.815   0.428
  210    HG2  GLU  34           2HG      GLU  34   0.365  -9.071   0.849
  211    HG3  GLU  34           1HG      GLU  34   0.068  -9.232  -0.881
  212    H    LEU  35           H        LEU  35  -0.598  -5.888  -2.328
  213    HA   LEU  35           HA       LEU  35  -0.121  -3.176  -1.935
  214    HB2  LEU  35           2HB      LEU  35  -1.454  -4.663  -4.198
  215    HB3  LEU  35           1HB      LEU  35  -1.170  -2.925  -4.259
  216    HG   LEU  35           HG       LEU  35   0.992  -4.997  -3.769
  217   HD11  LEU  35          1HD1      LEU  35   1.630  -4.743  -6.052
  218   HD12  LEU  35          2HD1      LEU  35   0.550  -3.366  -6.277
  219   HD13  LEU  35          3HD1      LEU  35  -0.117  -4.987  -6.080
  220   HD21  LEU  35          3HD2      LEU  35   1.936  -3.076  -2.907
  221   HD22  LEU  35          1HD2      LEU  35   0.899  -2.010  -3.855
  222   HD23  LEU  35          2HD2      LEU  35   2.289  -2.789  -4.609
  223    H    LEU  36           H        LEU  36  -3.252  -4.787  -2.519
  224    HA   LEU  36           HA       LEU  36  -4.865  -2.506  -2.351
  225    HB2  LEU  36           2HB      LEU  36  -5.520  -5.344  -1.518
  226    HB3  LEU  36           1HB      LEU  36  -6.700  -4.068  -1.811
  227    HG   LEU  36           HG       LEU  36  -4.732  -5.139  -3.857
  228   HD11  LEU  36          1HD1      LEU  36  -6.577  -6.272  -4.852
  229   HD12  LEU  36          2HD1      LEU  36  -7.742  -5.412  -3.849
  230   HD13  LEU  36          3HD1      LEU  36  -6.690  -6.631  -3.130
  231   HD21  LEU  36          3HD2      LEU  36  -6.718  -2.888  -3.831
  232   HD22  LEU  36          1HD2      LEU  36  -6.483  -3.789  -5.330
  233   HD23  LEU  36          2HD2      LEU  36  -5.120  -2.963  -4.577
  234    H    ALA  37           H        ALA  37  -3.926  -4.800   0.206
  235    HA   ALA  37           HA       ALA  37  -5.272  -3.449   2.301
  236    HB1  ALA  37           1HB      ALA  37  -4.080  -4.883   3.781
  237    HB2  ALA  37           2HB      ALA  37  -2.780  -5.124   2.615
  238    HB3  ALA  37           3HB      ALA  37  -4.369  -5.833   2.324
  239    H    ALA  38           H        ALA  38  -2.085  -3.114   0.865
  240    HA   ALA  38           HA       ALA  38  -1.074  -1.335   2.888
  241    HB1  ALA  38           1HB      ALA  38   0.866  -1.178   1.560
  242    HB2  ALA  38           2HB      ALA  38  -0.012  -1.552   0.077
  243    HB3  ALA  38           3HB      ALA  38   0.281  -2.816   1.270
  244    H    CYS  39           H        CYS  39  -2.695  -0.996  -0.211
  245    HA   CYS  39           HA       CYS  39  -2.279   1.822  -0.469
  246    HB2  CYS  39           2HB      CYS  39  -2.815   0.309  -2.377
  247    HB3  CYS  39           1HB      CYS  39  -4.438   0.108  -1.717
  248    HG   CYS  39           HG       CYS  39  -3.900   3.042  -2.002
  249    H    ARG  40           H        ARG  40  -5.088  -0.143   0.515
  250    HA   ARG  40           HA       ARG  40  -6.886   1.888   1.066
  251    HB2  ARG  40           2HB      ARG  40  -6.471  -0.786   2.404
  252    HB3  ARG  40           1HB      ARG  40  -7.825   0.278   2.794
  253    HG2  ARG  40           2HG      ARG  40  -8.630   0.207   0.520
  254    HG3  ARG  40           1HG      ARG  40  -7.185  -0.649  -0.018
  255    HD2  ARG  40           2HD      ARG  40  -8.894  -2.306   0.211
  256    HD3  ARG  40           1HD      ARG  40  -7.823  -2.506   1.595
  257    HE   ARG  40           HE       ARG  40 -10.569  -1.511   1.647
  258   HH11  ARG  40          1HH2      ARG  40  -7.541  -1.960   3.266
  259   HH12  ARG  40          2HH2      ARG  40  -8.212  -1.809   4.855
  260   HH21  ARG  40          1HH1      ARG  40 -11.453  -1.314   3.728
  261   HH22  ARG  40          2HH1      ARG  40 -10.427  -1.444   5.117
  262    H    GLU  41           H        GLU  41  -4.218   0.691   3.037
  263    HA   GLU  41           HA       GLU  41  -4.811   1.917   5.468
  264    HB2  GLU  41           2HB      GLU  41  -2.213   1.229   4.108
  265    HB3  GLU  41           1HB      GLU  41  -2.231   2.025   5.681
  266    HG2  GLU  41           2HG      GLU  41  -3.851  -0.469   5.171
  267    HG3  GLU  41           1HG      GLU  41  -2.160  -0.559   5.656
  268    H    GLU  42           H        GLU  42  -2.971   3.217   2.705
  269    HA   GLU  42           HA       GLU  42  -2.602   5.790   3.911
  270    HB2  GLU  42           2HB      GLU  42  -2.459   5.199   0.956
  271    HB3  GLU  42           1HB      GLU  42  -1.582   6.428   1.870
  272    HG2  GLU  42           2HG      GLU  42  -1.210   3.427   2.029
  273    HG3  GLU  42           1HG      GLU  42  -0.057   4.607   1.412
  274    H    PHE  43           H        PHE  43  -4.824   4.474   1.472
  275    HA   PHE  43           HA       PHE  43  -6.119   6.763   0.651
  276    HB2  PHE  43           2HB      PHE  43  -6.523   4.341  -0.083
  277    HB3  PHE  43           1HB      PHE  43  -7.615   4.225   1.298
  278    HD1  PHE  43           2HD      PHE  43  -9.668   5.579   1.408
  279    HD2  PHE  43           1HD      PHE  43  -7.063   5.728  -2.004
  280    HE1  PHE  43           2HE      PHE  43 -11.449   6.701   0.096
  281    HE2  PHE  43           1HE      PHE  43  -8.842   6.851  -3.315
  282    HZ   PHE  43           HZ       PHE  43 -11.036   7.338  -2.265
  283    H    HIS  44           H        HIS  44  -7.014   4.732   3.453
  284    HA   HIS  44           HA       HIS  44  -9.134   6.281   4.391
  285    HB2  HIS  44           2HB      HIS  44  -7.140   4.541   5.846
  286    HB3  HIS  44           1HB      HIS  44  -8.507   5.304   6.657
  287    HD2  HIS  44           2HD      HIS  44  -9.160   3.951   3.057
  288    HE1  HIS  44           1HE      HIS  44 -10.977   1.277   5.772
  289    HE2  HIS  44           2HE      HIS  44 -10.742   1.889   3.320
  290    H    ARG  45           H        ARG  45  -5.657   6.636   4.900
  291    HA   ARG  45           HA       ARG  45  -5.888   8.740   6.832
  292    HB2  ARG  45           2HB      ARG  45  -3.617   7.718   5.129
  293    HB3  ARG  45           1HB      ARG  45  -3.434   9.104   6.204
  294    HG2  ARG  45           2HG      ARG  45  -3.893   7.808   8.137
  295    HG3  ARG  45           1HG      ARG  45  -4.545   6.473   7.186
  296    HD2  ARG  45           2HD      ARG  45  -2.104   6.307   8.142
  297    HD3  ARG  45           1HD      ARG  45  -2.437   5.747   6.506
  298    HE   ARG  45           HE       ARG  45  -1.124   7.483   5.705
  299   HH11  ARG  45          1HH2      ARG  45  -2.040   8.039   8.995
  300   HH12  ARG  45          2HH2      ARG  45  -1.024   9.428   9.188
  301   HH21  ARG  45          1HH1      ARG  45   0.210   9.304   5.950
  302   HH22  ARG  45          2HH1      ARG  45   0.250  10.145   7.464
  303    H    ARG  46           H        ARG  46  -5.273   8.625   3.334
  304    HA   ARG  46           HA       ARG  46  -4.792  11.304   2.825
  305    HB2  ARG  46           2HB      ARG  46  -6.407   9.377   1.136
  306    HB3  ARG  46           1HB      ARG  46  -5.685  10.880   0.567
  307    HG2  ARG  46           2HG      ARG  46  -3.833   9.023   1.965
  308    HG3  ARG  46           1HG      ARG  46  -4.437   8.461   0.408
  309    HD2  ARG  46           2HD      ARG  46  -3.710  10.602  -0.620
  310    HD3  ARG  46           1HD      ARG  46  -3.061  11.110   0.935
  311    HE   ARG  46           HE       ARG  46  -1.923   8.625   0.326
  312   HH11  ARG  46          1HH2      ARG  46  -2.025  11.860  -0.895
  313   HH12  ARG  46          2HH2      ARG  46  -0.444  11.794  -1.595
  314   HH21  ARG  46          1HH1      ARG  46   0.151   8.528  -0.592
  315   HH22  ARG  46          2HH1      ARG  46   0.789   9.907  -1.425
  316    H    LEU  47           H        LEU  47  -7.853   9.657   3.403
  317    HA   LEU  47           HA       LEU  47  -9.576  11.780   2.675
  318    HB2  LEU  47           2HB      LEU  47  -9.806   9.265   4.251
  319    HB3  LEU  47           1HB      LEU  47 -11.033  10.494   4.551
  320    HG   LEU  47           HG       LEU  47 -11.415  10.610   2.060
  321   HD11  LEU  47          1HD1      LEU  47 -10.508   8.890   0.639
  322   HD12  LEU  47          2HD1      LEU  47  -9.800   8.049   2.017
  323   HD13  LEU  47          3HD1      LEU  47  -9.152   9.608   1.508
  324   HD21  LEU  47          3HD2      LEU  47 -11.787   7.829   3.202
  325   HD22  LEU  47          1HD2      LEU  47 -12.798   8.640   2.006
  326   HD23  LEU  47          2HD2      LEU  47 -12.779   9.208   3.677
  327    H    LYS  48           H        LYS  48  -7.733  11.090   5.565
  328    HA   LYS  48           HA       LYS  48  -8.986  12.612   7.489
  329    HB2  LYS  48           2HB      LYS  48  -6.866  11.231   7.732
  330    HB3  LYS  48           1HB      LYS  48  -5.992  12.614   7.075
  331    HG2  LYS  48           2HG      LYS  48  -5.844  13.088   9.343
  332    HG3  LYS  48           1HG      LYS  48  -7.337  13.938   8.946
  333    HD2  LYS  48           2HD      LYS  48  -8.027  12.716  10.800
  334    HD3  LYS  48           1HD      LYS  48  -8.447  11.594   9.506
  335    HE2  LYS  48           2HE      LYS  48  -7.272  10.259  11.067
  336    HE3  LYS  48           1HE      LYS  48  -6.072  10.627   9.829
  337    HZ1  LYS  48           3HZ      LYS  48  -6.117  12.677  11.770
  338    HZ2  LYS  48           1HZ      LYS  48  -4.835  11.659  11.326
  339    HZ3  LYS  48           2HZ      LYS  48  -5.920  11.175  12.539
  340    H    VAL  49           H        VAL  49  -6.113  13.920   5.860
  341    HA   VAL  49           HA       VAL  49  -7.182  16.617   6.152
  342    HB   VAL  49           HB       VAL  49  -4.893  17.187   5.107
  343   HG11  VAL  49          1HG1      VAL  49  -5.180  15.743   7.756
  344   HG12  VAL  49          2HG1      VAL  49  -5.276  17.481   7.470
  345   HG13  VAL  49          3HG1      VAL  49  -3.736  16.641   7.291
  346   HG21  VAL  49          3HG2      VAL  49  -4.656  14.785   4.236
  347   HG22  VAL  49          1HG2      VAL  49  -4.302  14.327   5.902
  348   HG23  VAL  49          2HG2      VAL  49  -3.246  15.458   5.054
  349    H    TYR  50           H        TYR  50  -6.482  18.073   4.140
  350    HA   TYR  50           HA       TYR  50  -7.207  18.744   2.060
  351    HB2  TYR  50           2HB      TYR  50  -6.470  16.005   1.068
  352    HB3  TYR  50           1HB      TYR  50  -6.223  17.573   0.297
  353    HD1  TYR  50           2HD      TYR  50  -4.911  19.252   2.146
  354    HD2  TYR  50           1HD      TYR  50  -4.447  15.008   1.662
  355    HE1  TYR  50           2HE      TYR  50  -2.641  19.386   3.136
  356    HE2  TYR  50           1HE      TYR  50  -2.178  15.143   2.653
  357    HH   TYR  50           HH       TYR  50  -0.932  16.672   4.187
  358    H    HIS  51           H        HIS  51  -9.167  17.369   3.796
  359    HA   HIS  51           HA       HIS  51 -10.806  15.676   2.183
  360    HB2  HIS  51           2HB      HIS  51 -10.829  15.752   4.697
  361    HB3  HIS  51           1HB      HIS  51 -11.648  17.308   4.585
  362    HD2  HIS  51           2HD      HIS  51 -13.083  14.297   5.581
  363    HE1  HIS  51           1HE      HIS  51 -15.518  15.102   2.226
  364    HE2  HIS  51           2HE      HIS  51 -15.320  13.732   4.355
  Start of MODEL   13
    1    H1   GLY   9           H        GLY   9   9.672 -12.372  10.183
    2    HA2  GLY   9           2HA      GLY   9   9.500 -10.300   9.137
    3    HA3  GLY   9           1HA      GLY   9  11.040 -10.602   8.338
    4    H    THR  10           H        THR  10   9.322  -9.507   6.722
    5    HA   THR  10           HA       THR  10   8.540 -11.676   4.910
    6    HB   THR  10           HB       THR  10   6.505 -11.124   6.207
    7    HG1  THR  10           1HG      THR  10   5.297 -11.078   4.434
    8   HG21  THR  10          3HG2      THR  10   6.677  -8.380   4.959
    9   HG22  THR  10          1HG2      THR  10   7.274  -8.709   6.585
   10   HG23  THR  10          2HG2      THR  10   5.566  -8.939   6.209
   11    H    LYS  11           H        LYS  11   7.161  -9.941   3.127
   12    HA   LYS  11           HA       LYS  11   9.218  -7.979   2.341
   13    HB2  LYS  11           2HB      LYS  11   9.530 -10.179   1.128
   14    HB3  LYS  11           1HB      LYS  11   7.953  -9.905   0.389
   15    HG2  LYS  11           2HG      LYS  11   8.747  -7.763  -0.535
   16    HG3  LYS  11           1HG      LYS  11  10.325  -8.023   0.210
   17    HD2  LYS  11           2HD      LYS  11  10.422 -10.221  -1.090
   18    HD3  LYS  11           1HD      LYS  11   9.031  -9.631  -2.000
   19    HE2  LYS  11           2HE      LYS  11  11.830  -8.530  -1.908
   20    HE3  LYS  11           1HE      LYS  11  10.837  -8.911  -3.314
   21    HZ1  LYS  11           3HZ      LYS  11   9.362  -7.077  -2.686
   22    HZ2  LYS  11           1HZ      LYS  11  10.941  -6.543  -3.002
   23    HZ3  LYS  11           2HZ      LYS  11  10.397  -6.686  -1.398
   24    H    LYS  12           H        LYS  12   7.941  -6.226   2.783
   25    HA   LYS  12           HA       LYS  12   5.309  -6.070   1.448
   26    HB2  LYS  12           2HB      LYS  12   4.951  -4.106   2.975
   27    HB3  LYS  12           1HB      LYS  12   5.141  -5.647   3.808
   28    HG2  LYS  12           2HG      LYS  12   7.647  -4.116   3.314
   29    HG3  LYS  12           1HG      LYS  12   6.535  -3.422   4.492
   30    HD2  LYS  12           2HD      LYS  12   6.491  -5.569   5.716
   31    HD3  LYS  12           1HD      LYS  12   7.619  -6.255   4.547
   32    HE2  LYS  12           2HE      LYS  12   9.326  -4.638   5.167
   33    HE3  LYS  12           1HE      LYS  12   8.197  -3.807   6.237
   34    HZ1  LYS  12           3HZ      LYS  12   9.824  -6.021   6.802
   35    HZ2  LYS  12           1HZ      LYS  12   8.205  -6.510   6.926
   36    HZ3  LYS  12           2HZ      LYS  12   8.767  -5.194   7.844
   37    H    TYR  13           H        TYR  13   5.022  -3.324   1.379
   38    HA   TYR  13           HA       TYR  13   7.173  -2.455  -0.467
   39    HB2  TYR  13           2HB      TYR  13   4.238  -1.783  -0.743
   40    HB3  TYR  13           1HB      TYR  13   5.532  -1.440  -1.893
   41    HD1  TYR  13           1HD      TYR  13   3.431  -4.091  -0.404
   42    HD2  TYR  13           2HD      TYR  13   6.446  -3.172  -3.322
   43    HE1  TYR  13           1HE      TYR  13   3.084  -6.307  -1.460
   44    HE2  TYR  13           2HE      TYR  13   6.098  -5.388  -4.378
   45    HH   TYR  13           HH       TYR  13   3.788  -7.107  -4.325
   46    H    ASP  14           H        ASP  14   7.753  -0.292  -0.405
   47    HA   ASP  14           HA       ASP  14   6.947   1.133   2.036
   48    HB2  ASP  14           2HB      ASP  14   8.898   2.617   1.425
   49    HB3  ASP  14           1HB      ASP  14   9.317   0.941   1.777
   50    H    LEU  15           H        LEU  15   5.220   2.403   1.785
   51    HA   LEU  15           HA       LEU  15   4.833   3.847  -0.754
   52    HB2  LEU  15           2HB      LEU  15   2.869   3.809   1.525
   53    HB3  LEU  15           1HB      LEU  15   2.563   4.026  -0.199
   54    HG   LEU  15           HG       LEU  15   3.477   1.461   1.140
   55   HD11  LEU  15          1HD1      LEU  15   1.214   0.698   0.194
   56   HD12  LEU  15          2HD1      LEU  15   0.849   2.411  -0.014
   57   HD13  LEU  15          3HD1      LEU  15   1.161   1.766   1.597
   58   HD21  LEU  15          3HD2      LEU  15   2.936   2.180  -1.755
   59   HD22  LEU  15          1HD2      LEU  15   3.043   0.518  -1.174
   60   HD23  LEU  15          2HD2      LEU  15   4.446   1.581  -1.068
   61    H    SER  16           H        SER  16   6.923   4.709   0.936
   62    HA   SER  16           HA       SER  16   6.562   6.615   2.815
   63    HB2  SER  16           2HB      SER  16   8.337   7.160   0.440
   64    HB3  SER  16           1HB      SER  16   8.585   7.632   2.119
   65    HG   SER  16           HG       SER  16   9.728   5.680   1.224
   66    H    LYS  17           H        LYS  17   5.840   6.970  -0.621
   67    HA   LYS  17           HA       LYS  17   4.106   9.222  -0.035
   68    HB2  LYS  17           2HB      LYS  17   5.192  10.760  -1.601
   69    HB3  LYS  17           1HB      LYS  17   6.298  10.320  -0.301
   70    HG2  LYS  17           2HG      LYS  17   7.764   9.810  -1.965
   71    HG3  LYS  17           1HG      LYS  17   6.802   8.347  -2.168
   72    HD2  LYS  17           2HD      LYS  17   5.337   9.654  -3.776
   73    HD3  LYS  17           1HD      LYS  17   6.531  10.950  -3.692
   74    HE2  LYS  17           2HE      LYS  17   6.952   9.482  -5.633
   75    HE3  LYS  17           1HE      LYS  17   8.280   9.402  -4.475
   76    HZ1  LYS  17           3HZ      LYS  17   7.620   7.330  -3.733
   77    HZ2  LYS  17           1HZ      LYS  17   7.328   7.225  -5.400
   78    HZ3  LYS  17           2HZ      LYS  17   6.038   7.492  -4.327
   79    H    TRP  18           H        TRP  18   2.375   9.143  -1.317
   80    HA   TRP  18           HA       TRP  18   2.583   7.934  -3.991
   81    HB2  TRP  18           2HB      TRP  18   0.960   6.922  -1.690
   82    HB3  TRP  18           1HB      TRP  18   0.248   6.850  -3.301
   83    HD1  TRP  18           HD       TRP  18   3.566   5.840  -1.578
   84    HE1  TRP  18           1HE      TRP  18   4.401   3.659  -2.666
   85    HE3  TRP  18           3HE      TRP  18  -0.027   5.207  -5.151
   86    HZ2  TRP  18           2HZ      TRP  18   3.644   1.877  -4.769
   87    HZ3  TRP  18           3HZ      TRP  18   0.054   3.257  -6.681
   88    HH2  TRP  18           HH       TRP  18   1.882   1.593  -6.495
   89    H    LYS  19           H        LYS  19   0.497   8.279  -5.224
   90    HA   LYS  19           HA       LYS  19  -0.603  10.945  -4.554
   91    HB2  LYS  19           2HB      LYS  19  -0.235   9.584  -7.235
   92    HB3  LYS  19           1HB      LYS  19  -1.076  11.115  -7.004
   93    HG2  LYS  19           2HG      LYS  19   1.040  11.926  -7.468
   94    HG3  LYS  19           1HG      LYS  19   1.188  11.748  -5.722
   95    HD2  LYS  19           2HD      LYS  19   2.242   9.558  -6.001
   96    HD3  LYS  19           1HD      LYS  19   2.023   9.651  -7.748
   97    HE2  LYS  19           2HE      LYS  19   3.656  11.603  -6.102
   98    HE3  LYS  19           1HE      LYS  19   4.327  10.285  -7.062
   99    HZ1  LYS  19           3HZ      LYS  19   3.642  12.840  -7.919
  100    HZ2  LYS  19           1HZ      LYS  19   2.534  11.776  -8.638
  101    HZ3  LYS  19           2HZ      LYS  19   4.203  11.541  -8.860
  102    H    TYR  20           H        TYR  20  -2.798  11.283  -4.630
  103    HA   TYR  20           HA       TYR  20  -4.531   9.242  -3.916
  104    HB2  TYR  20           2HB      TYR  20  -5.092  11.586  -3.579
  105    HB3  TYR  20           1HB      TYR  20  -5.163  11.847  -5.323
  106    HD1  TYR  20           1HD      TYR  20  -6.919  10.681  -6.688
  107    HD2  TYR  20           2HD      TYR  20  -6.921  10.600  -2.394
  108    HE1  TYR  20           1HE      TYR  20  -9.290   9.955  -6.704
  109    HE2  TYR  20           2HE      TYR  20  -9.293   9.874  -2.409
  110    HH   TYR  20           HH       TYR  20 -11.096   9.552  -5.462
  111    H    ALA  21           H        ALA  21  -3.560  10.326  -7.103
  112    HA   ALA  21           HA       ALA  21  -5.599   8.900  -8.532
  113    HB1  ALA  21           1HB      ALA  21  -4.458  10.843  -9.514
  114    HB2  ALA  21           2HB      ALA  21  -4.238   9.410 -10.519
  115    HB3  ALA  21           3HB      ALA  21  -2.928   9.967  -9.477
  116    H    GLU  22           H        GLU  22  -2.237   8.251  -7.632
  117    HA   GLU  22           HA       GLU  22  -2.015   5.800  -9.069
  118    HB2  GLU  22           2HB      GLU  22  -0.473   6.912  -6.716
  119    HB3  GLU  22           1HB      GLU  22  -0.044   5.422  -7.553
  120    HG2  GLU  22           2HG      GLU  22  -0.398   8.045  -9.011
  121    HG3  GLU  22           1HG      GLU  22   1.154   7.538  -8.344
  122    H    LEU  23           H        LEU  23  -2.857   6.605  -5.720
  123    HA   LEU  23           HA       LEU  23  -3.033   3.943  -4.771
  124    HB2  LEU  23           2HB      LEU  23  -4.488   6.412  -3.796
  125    HB3  LEU  23           1HB      LEU  23  -4.282   4.912  -2.895
  126    HG   LEU  23           HG       LEU  23  -1.935   6.500  -3.949
  127   HD11  LEU  23          1HD1      LEU  23  -1.733   7.502  -1.730
  128   HD12  LEU  23          2HD1      LEU  23  -3.172   6.641  -1.184
  129   HD13  LEU  23          3HD1      LEU  23  -3.310   7.900  -2.411
  130   HD21  LEU  23          3HD2      LEU  23  -2.324   4.250  -1.966
  131   HD22  LEU  23          1HD2      LEU  23  -0.876   5.255  -1.941
  132   HD23  LEU  23          2HD2      LEU  23  -1.259   4.299  -3.372
  133    H    ARG  24           H        ARG  24  -5.517   6.195  -5.972
  134    HA   ARG  24           HA       ARG  24  -7.663   4.334  -5.718
  135    HB2  ARG  24           2HB      ARG  24  -7.900   6.839  -5.821
  136    HB3  ARG  24           1HB      ARG  24  -7.524   6.743  -7.540
  137    HG2  ARG  24           2HG      ARG  24  -9.930   6.754  -7.320
  138    HG3  ARG  24           1HG      ARG  24  -9.443   5.131  -7.799
  139    HD2  ARG  24           2HD      ARG  24  -9.956   4.219  -5.733
  140    HD3  ARG  24           1HD      ARG  24  -9.640   5.722  -4.870
  141    HE   ARG  24           HE       ARG  24 -11.863   6.293  -5.182
  142   HH11  ARG  24          1HH2      ARG  24 -10.913   3.791  -7.373
  143   HH12  ARG  24          2HH2      ARG  24 -12.513   3.527  -7.984
  144   HH21  ARG  24          1HH1      ARG  24 -13.964   5.953  -5.975
  145   HH22  ARG  24          2HH1      ARG  24 -14.240   4.752  -7.191
  146    H    ASP  25           H        ASP  25  -5.417   5.159  -8.301
  147    HA   ASP  25           HA       ASP  25  -6.803   3.678 -10.333
  148    HB2  ASP  25           2HB      ASP  25  -5.329   5.525 -10.934
  149    HB3  ASP  25           1HB      ASP  25  -3.954   4.689 -10.213
  150    H    THR  26           H        THR  26  -3.936   3.061  -8.314
  151    HA   THR  26           HA       THR  26  -3.162   0.611  -9.367
  152    HB   THR  26           HB       THR  26  -3.092   1.510  -6.475
  153    HG1  THR  26           1HG      THR  26  -2.011   2.719  -8.285
  154   HG21  THR  26          3HG2      THR  26  -1.747  -0.749  -7.965
  155   HG22  THR  26          1HG2      THR  26  -2.720  -0.844  -6.498
  156   HG23  THR  26          2HG2      THR  26  -1.117  -0.112  -6.445
  157    H    ILE  27           H        ILE  27  -5.579   1.282  -6.847
  158    HA   ILE  27           HA       ILE  27  -6.220  -1.445  -6.350
  159    HB   ILE  27           HB       ILE  27  -7.805   1.089  -5.867
  160   HG12  ILE  27          2HG1      ILE  27  -6.261  -0.643  -3.916
  161   HG13  ILE  27          1HG1      ILE  27  -5.558   0.770  -4.707
  162   HG21  ILE  27          1HG2      ILE  27  -8.265  -1.794  -5.084
  163   HG22  ILE  27          2HG2      ILE  27  -9.394  -0.675  -5.846
  164   HG23  ILE  27          3HG2      ILE  27  -8.949  -0.460  -4.153
  165   HD11  ILE  27          3HD1      ILE  27  -6.581   1.171  -2.396
  166   HD12  ILE  27          1HD1      ILE  27  -8.150   0.911  -3.158
  167   HD13  ILE  27          2HD1      ILE  27  -7.127   2.247  -3.683
  168    H    ASN  28           H        ASN  28  -7.341   0.937  -8.666
  169    HA   ASN  28           HA       ASN  28  -9.476  -0.847  -9.602
  170    HB2  ASN  28           2HB      ASN  28  -8.723   2.005 -10.238
  171    HB3  ASN  28           1HB      ASN  28  -9.927   1.116 -11.171
  172   HD21  ASN  28          1HD2      ASN  28  -9.183   2.206  -7.832
  173   HD22  ASN  28          2HD2      ASN  28 -10.800   2.224  -7.319
  174    H    THR  29           H        THR  29  -6.536  -1.379  -9.943
  175    HA   THR  29           HA       THR  29  -6.665  -2.021 -12.791
  176    HB   THR  29           HB       THR  29  -4.311  -1.140 -13.101
  177    HG1  THR  29           1HG      THR  29  -4.081  -0.900 -10.737
  178   HG21  THR  29          3HG2      THR  29  -6.384   0.966 -12.439
  179   HG22  THR  29          1HG2      THR  29  -6.403   0.003 -13.917
  180   HG23  THR  29          2HG2      THR  29  -5.060   1.101 -13.598
  181    H    SER  30           H        SER  30  -4.468  -2.030  -9.973
  182    HA   SER  30           HA       SER  30  -3.420  -4.636 -10.754
  183    HB2  SER  30           2HB      SER  30  -2.110  -2.627  -9.696
  184    HB3  SER  30           1HB      SER  30  -2.741  -3.257  -8.175
  185    HG   SER  30           HG       SER  30  -0.659  -4.112  -9.494
  186    H    CYS  31           H        CYS  31  -3.053  -6.128  -8.693
  187    HA   CYS  31           HA       CYS  31  -5.299  -6.196  -6.870
  188    HB2  CYS  31           2HB      CYS  31  -6.189  -8.329  -7.598
  189    HB3  CYS  31           1HB      CYS  31  -6.237  -7.199  -8.953
  190    HG   CYS  31           HG       CYS  31  -4.567  -9.745  -8.837
  191    H    ASP  32           H        ASP  32  -4.529  -6.900  -4.995
  192    HA   ASP  32           HA       ASP  32  -2.962  -9.241  -4.690
  193    HB2  ASP  32           2HB      ASP  32  -1.344  -7.350  -5.619
  194    HB3  ASP  32           1HB      ASP  32  -1.344  -6.841  -3.934
  195    H    ILE  33           H        ILE  33  -2.907  -9.892  -2.568
  196    HA   ILE  33           HA       ILE  33  -4.683  -8.598  -0.750
  197    HB   ILE  33           HB       ILE  33  -2.665 -10.794  -0.216
  198   HG12  ILE  33          2HG1      ILE  33  -5.620 -11.054  -0.827
  199   HG13  ILE  33          1HG1      ILE  33  -4.375 -11.195  -2.070
  200   HG21  ILE  33          1HG2      ILE  33  -5.020  -9.672   1.306
  201   HG22  ILE  33          2HG2      ILE  33  -3.381  -9.976   1.884
  202   HG23  ILE  33          3HG2      ILE  33  -4.468 -11.327   1.567
  203   HD11  ILE  33          3HD1      ILE  33  -4.420 -12.865   0.458
  204   HD12  ILE  33          1HD1      ILE  33  -3.364 -13.076  -0.940
  205   HD13  ILE  33          2HD1      ILE  33  -5.093 -13.402  -1.081
  206    H    GLU  34           H        GLU  34  -1.521  -7.932  -1.602
  207    HA   GLU  34           HA       GLU  34  -0.820  -6.839   1.048
  208    HB2  GLU  34           2HB      GLU  34   0.906  -7.155  -1.419
  209    HB3  GLU  34           1HB      GLU  34   1.450  -6.673   0.189
  210    HG2  GLU  34           2HG      GLU  34   0.081  -9.308  -0.407
  211    HG3  GLU  34           1HG      GLU  34   1.831  -9.108  -0.330
  212    H    LEU  35           H        LEU  35  -0.437  -5.853  -2.370
  213    HA   LEU  35           HA       LEU  35  -0.027  -3.141  -1.907
  214    HB2  LEU  35           2HB      LEU  35  -1.302  -4.553  -4.255
  215    HB3  LEU  35           1HB      LEU  35  -0.913  -2.836  -4.256
  216    HG   LEU  35           HG       LEU  35   1.104  -5.035  -3.710
  217   HD11  LEU  35          1HD1      LEU  35   0.725  -3.395  -6.233
  218   HD12  LEU  35          2HD1      LEU  35   0.172  -5.060  -6.043
  219   HD13  LEU  35          3HD1      LEU  35   1.895  -4.689  -5.976
  220   HD21  LEU  35          3HD2      LEU  35   2.578  -2.930  -4.459
  221   HD22  LEU  35          1HD2      LEU  35   2.074  -3.143  -2.784
  222   HD23  LEU  35          2HD2      LEU  35   1.191  -2.040  -3.836
  223    H    LEU  36           H        LEU  36  -3.105  -4.813  -2.595
  224    HA   LEU  36           HA       LEU  36  -4.773  -2.570  -2.482
  225    HB2  LEU  36           2HB      LEU  36  -5.371  -5.423  -1.660
  226    HB3  LEU  36           1HB      LEU  36  -6.583  -4.176  -1.954
  227    HG   LEU  36           HG       LEU  36  -4.567  -5.171  -3.991
  228   HD11  LEU  36          1HD1      LEU  36  -6.150  -6.905  -3.747
  229   HD12  LEU  36          2HD1      LEU  36  -6.782  -5.955  -5.090
  230   HD13  LEU  36          3HD1      LEU  36  -7.479  -5.777  -3.481
  231   HD21  LEU  36          3HD2      LEU  36  -6.371  -3.863  -5.459
  232   HD22  LEU  36          1HD2      LEU  36  -5.017  -3.014  -4.714
  233   HD23  LEU  36          2HD2      LEU  36  -6.607  -2.975  -3.953
  234    H    ALA  37           H        ALA  37  -3.835  -4.821   0.112
  235    HA   ALA  37           HA       ALA  37  -5.260  -3.466   2.163
  236    HB1  ALA  37           1HB      ALA  37  -4.108  -4.885   3.684
  237    HB2  ALA  37           2HB      ALA  37  -2.766  -5.120   2.564
  238    HB3  ALA  37           3HB      ALA  37  -4.336  -5.846   2.224
  239    H    ALA  38           H        ALA  38  -2.057  -3.115   0.783
  240    HA   ALA  38           HA       ALA  38  -1.083  -1.318   2.809
  241    HB1  ALA  38           1HB      ALA  38   0.027  -1.504   0.018
  242    HB2  ALA  38           2HB      ALA  38   0.282  -2.806   1.180
  243    HB3  ALA  38           3HB      ALA  38   0.877  -1.182   1.530
  244    H    CYS  39           H        CYS  39  -2.709  -1.019  -0.283
  245    HA   CYS  39           HA       CYS  39  -2.304   1.796  -0.583
  246    HB2  CYS  39           2HB      CYS  39  -2.892   0.143  -2.424
  247    HB3  CYS  39           1HB      CYS  39  -4.539   0.161  -1.792
  248    HG   CYS  39           HG       CYS  39  -3.288   2.350  -3.472
  249    H    ARG  40           H        ARG  40  -5.105  -0.165   0.438
  250    HA   ARG  40           HA       ARG  40  -6.918   1.848   0.968
  251    HB2  ARG  40           2HB      ARG  40  -6.441  -0.778   2.381
  252    HB3  ARG  40           1HB      ARG  40  -7.802   0.276   2.764
  253    HG2  ARG  40           2HG      ARG  40  -8.697   0.086   0.559
  254    HG3  ARG  40           1HG      ARG  40  -7.215  -0.648  -0.055
  255    HD2  ARG  40           2HD      ARG  40  -8.966  -2.351   0.290
  256    HD3  ARG  40           1HD      ARG  40  -7.594  -2.625   1.360
  257    HE   ARG  40           HE       ARG  40  -9.647  -1.016   2.581
  258   HH11  ARG  40          1HH2      ARG  40  -8.609  -4.222   1.788
  259   HH12  ARG  40          2HH2      ARG  40  -9.489  -4.974   3.076
  260   HH21  ARG  40          1HH1      ARG  40 -10.803  -1.998   4.274
  261   HH22  ARG  40          2HH1      ARG  40 -10.730  -3.716   4.484
  262    H    GLU  41           H        GLU  41  -4.111   0.876   2.823
  263    HA   GLU  41           HA       GLU  41  -4.750   2.205   5.243
  264    HB2  GLU  41           2HB      GLU  41  -2.142   1.361   3.978
  265    HB3  GLU  41           1HB      GLU  41  -2.200   2.187   5.536
  266    HG2  GLU  41           2HG      GLU  41  -3.856  -0.278   4.984
  267    HG3  GLU  41           1HG      GLU  41  -2.202  -0.387   5.582
  268    H    GLU  42           H        GLU  42  -2.924   3.230   2.366
  269    HA   GLU  42           HA       GLU  42  -2.313   5.832   3.363
  270    HB2  GLU  42           2HB      GLU  42  -2.272   4.548   0.641
  271    HB3  GLU  42           1HB      GLU  42  -2.002   6.282   0.816
  272    HG2  GLU  42           2HG      GLU  42  -0.464   4.264   2.450
  273    HG3  GLU  42           1HG      GLU  42   0.082   4.778   0.854
  274    H    PHE  43           H        PHE  43  -4.776   4.610   1.102
  275    HA   PHE  43           HA       PHE  43  -6.054   6.958   0.438
  276    HB2  PHE  43           2HB      PHE  43  -6.560   4.566  -0.340
  277    HB3  PHE  43           1HB      PHE  43  -7.573   4.437   1.099
  278    HD1  PHE  43           2HD      PHE  43  -7.082   6.249  -2.096
  279    HD2  PHE  43           1HD      PHE  43  -9.672   5.604   1.269
  280    HE1  PHE  43           2HE      PHE  43  -8.909   7.445  -3.273
  281    HE2  PHE  43           1HE      PHE  43 -11.499   6.799   0.092
  282    HZ   PHE  43           HZ       PHE  43 -11.117   7.721  -2.179
  283    H    HIS  44           H        HIS  44  -6.658   4.900   3.278
  284    HA   HIS  44           HA       HIS  44  -8.740   6.369   4.414
  285    HB2  HIS  44           2HB      HIS  44  -7.744   4.090   5.125
  286    HB3  HIS  44           1HB      HIS  44  -6.601   5.043   6.071
  287    HD2  HIS  44           2HD      HIS  44  -9.618   7.124   6.400
  288    HE1  HIS  44           1HE      HIS  44 -10.189   4.157   9.348
  289    HE2  HIS  44           2HE      HIS  44 -10.971   6.426   8.519
  290    H    ARG  45           H        ARG  45  -5.233   6.778   4.702
  291    HA   ARG  45           HA       ARG  45  -5.322   8.846   6.652
  292    HB2  ARG  45           2HB      ARG  45  -3.222   8.038   4.635
  293    HB3  ARG  45           1HB      ARG  45  -2.978   9.324   5.817
  294    HG2  ARG  45           2HG      ARG  45  -3.202   7.822   7.652
  295    HG3  ARG  45           1HG      ARG  45  -3.862   6.549   6.625
  296    HD2  ARG  45           2HD      ARG  45  -1.374   6.369   7.323
  297    HD3  ARG  45           1HD      ARG  45  -1.777   6.099   5.630
  298    HE   ARG  45           HE       ARG  45  -1.229   8.813   5.874
  299   HH11  ARG  45          1HH2      ARG  45   0.367   5.788   6.397
  300   HH12  ARG  45          2HH2      ARG  45   1.947   6.401   6.037
  301   HH21  ARG  45          1HH1      ARG  45   0.840   9.626   5.402
  302   HH22  ARG  45          2HH1      ARG  45   2.214   8.574   5.475
  303    H    ARG  46           H        ARG  46  -5.131   8.874   3.103
  304    HA   ARG  46           HA       ARG  46  -4.833  11.613   2.694
  305    HB2  ARG  46           2HB      ARG  46  -6.465   9.690   1.017
  306    HB3  ARG  46           1HB      ARG  46  -5.809  11.236   0.483
  307    HG2  ARG  46           2HG      ARG  46  -3.929   9.208   1.651
  308    HG3  ARG  46           1HG      ARG  46  -4.500   8.977  -0.001
  309    HD2  ARG  46           2HD      ARG  46  -3.534  10.991  -0.746
  310    HD3  ARG  46           1HD      ARG  46  -3.391  11.635   0.887
  311    HE   ARG  46           HE       ARG  46  -1.831   9.249   0.520
  312   HH11  ARG  46          1HH2      ARG  46  -1.984  12.665  -0.008
  313   HH12  ARG  46          2HH2      ARG  46  -0.264  12.878  -0.034
  314   HH21  ARG  46          1HH1      ARG  46   0.424   9.520   0.487
  315   HH22  ARG  46          2HH1      ARG  46   1.099  11.096   0.246
  316    H    LEU  47           H        LEU  47  -7.720   9.722   3.410
  317    HA   LEU  47           HA       LEU  47  -9.610  11.791   2.937
  318    HB2  LEU  47           2HB      LEU  47  -9.609   9.127   4.265
  319    HB3  LEU  47           1HB      LEU  47 -10.885  10.243   4.744
  320    HG   LEU  47           HG       LEU  47 -11.401  10.575   2.293
  321   HD11  LEU  47          1HD1      LEU  47  -9.113   9.739   1.557
  322   HD12  LEU  47          2HD1      LEU  47 -10.479   9.065   0.670
  323   HD13  LEU  47          3HD1      LEU  47  -9.683   8.112   1.921
  324   HD21  LEU  47          3HD2      LEU  47 -12.691   9.022   3.743
  325   HD22  LEU  47          1HD2      LEU  47 -11.574   7.724   3.318
  326   HD23  LEU  47          2HD2      LEU  47 -12.602   8.445   2.080
  327    H    LYS  48           H        LYS  48  -7.917  10.674   5.851
  328    HA   LYS  48           HA       LYS  48  -9.176  12.304   7.733
  329    HB2  LYS  48           2HB      LYS  48  -7.609  10.485   8.312
  330    HB3  LYS  48           1HB      LYS  48  -6.272  11.448   7.685
  331    HG2  LYS  48           2HG      LYS  48  -6.538  13.108   9.375
  332    HG3  LYS  48           1HG      LYS  48  -8.118  12.481   9.843
  333    HD2  LYS  48           2HD      LYS  48  -7.120  10.459  10.731
  334    HD3  LYS  48           1HD      LYS  48  -5.533  10.922  10.117
  335    HE2  LYS  48           2HE      LYS  48  -5.812  11.395  12.561
  336    HE3  LYS  48           1HE      LYS  48  -5.458  12.840  11.612
  337    HZ1  LYS  48           3HZ      LYS  48  -7.380  13.729  12.212
  338    HZ2  LYS  48           1HZ      LYS  48  -7.616  12.434  13.281
  339    HZ3  LYS  48           2HZ      LYS  48  -8.250  12.361  11.706
  340    H    VAL  49           H        VAL  49  -5.816  13.074   7.319
  341    HA   VAL  49           HA       VAL  49  -4.739  15.099   7.162
  342    HB   VAL  49           HB       VAL  49  -6.901  15.701   5.141
  343   HG11  VAL  49          1HG1      VAL  49  -4.049  16.649   5.531
  344   HG12  VAL  49          2HG1      VAL  49  -5.517  17.624   5.629
  345   HG13  VAL  49          3HG1      VAL  49  -4.995  16.966   4.077
  346   HG21  VAL  49          3HG2      VAL  49  -5.882  13.471   4.754
  347   HG22  VAL  49          1HG2      VAL  49  -4.281  14.211   4.786
  348   HG23  VAL  49          2HG2      VAL  49  -5.417  14.622   3.501
  349    H    TYR  50           H        TYR  50  -4.909  16.302   8.952
  350    HA   TYR  50           HA       TYR  50  -7.363  17.918   9.333
  351    HB2  TYR  50           2HB      TYR  50  -6.831  17.921  11.729
  352    HB3  TYR  50           1HB      TYR  50  -6.999  16.271  11.130
  353    HD1  TYR  50           1HD      TYR  50  -4.951  14.911  10.627
  354    HD2  TYR  50           2HD      TYR  50  -4.743  18.733  12.576
  355    HE1  TYR  50           1HE      TYR  50  -2.648  14.396  11.391
  356    HE2  TYR  50           2HE      TYR  50  -2.441  18.219  13.340
  357    HH   TYR  50           HH       TYR  50  -0.902  15.095  12.559
  358    H    HIS  51           H        HIS  51  -4.934  18.523   7.723
  359    HA   HIS  51           HA       HIS  51  -3.399  20.215   7.406
  360    HB2  HIS  51           2HB      HIS  51  -5.554  21.704   8.925
  361    HB3  HIS  51           1HB      HIS  51  -4.268  22.463   7.987
  362    HD2  HIS  51           2HD      HIS  51  -7.819  21.587   7.366
  363    HE1  HIS  51           1HE      HIS  51  -5.964  20.940   3.629
  364    HE2  HIS  51           2HE      HIS  51  -8.196  21.205   4.810
  Start of MODEL   14
    1    H1   GLY   9           H        GLY   9  10.166 -15.366   5.545
    2    HA2  GLY   9           2HA      GLY   9   9.562 -13.831   7.952
    3    HA3  GLY   9           1HA      GLY   9  10.558 -13.015   6.750
    4    H    THR  10           H        THR  10   9.191 -11.514   5.932
    5    HA   THR  10           HA       THR  10   6.774 -12.502   4.561
    6    HB   THR  10           HB       THR  10   5.512 -10.568   5.324
    7    HG1  THR  10           1HG      THR  10   7.993  -9.755   6.043
    8   HG21  THR  10          3HG2      THR  10   6.847 -11.836   7.723
    9   HG22  THR  10          1HG2      THR  10   5.656 -12.675   6.729
   10   HG23  THR  10          2HG2      THR  10   5.199 -11.218   7.612
   11    H    LYS  11           H        LYS  11   5.977  -9.920   3.707
   12    HA   LYS  11           HA       LYS  11   8.179  -8.655   2.334
   13    HB2  LYS  11           2HB      LYS  11   7.796 -10.678   0.938
   14    HB3  LYS  11           1HB      LYS  11   6.127 -10.163   0.697
   15    HG2  LYS  11           2HG      LYS  11   6.877  -8.098  -0.370
   16    HG3  LYS  11           1HG      LYS  11   8.561  -8.516  -0.050
   17    HD2  LYS  11           2HD      LYS  11   8.323 -10.536  -1.456
   18    HD3  LYS  11           1HD      LYS  11   6.648 -10.101  -1.789
   19    HE2  LYS  11           2HE      LYS  11   8.026  -9.346  -3.644
   20    HE3  LYS  11           1HE      LYS  11   7.456  -7.934  -2.754
   21    HZ1  LYS  11           3HZ      LYS  11  10.135  -9.194  -2.638
   22    HZ2  LYS  11           1HZ      LYS  11   9.606  -8.061  -1.492
   23    HZ3  LYS  11           2HZ      LYS  11   9.744  -7.613  -3.125
   24    H    LYS  12           H        LYS  12   7.695  -6.571   2.111
   25    HA   LYS  12           HA       LYS  12   4.877  -5.767   1.772
   26    HB2  LYS  12           2HB      LYS  12   6.779  -4.364   3.656
   27    HB3  LYS  12           1HB      LYS  12   5.051  -4.075   3.454
   28    HG2  LYS  12           2HG      LYS  12   4.968  -5.438   5.318
   29    HG3  LYS  12           1HG      LYS  12   4.921  -6.678   4.069
   30    HD2  LYS  12           2HD      LYS  12   6.656  -7.516   5.347
   31    HD3  LYS  12           1HD      LYS  12   7.585  -6.463   4.280
   32    HE2  LYS  12           2HE      LYS  12   8.377  -5.789   6.363
   33    HE3  LYS  12           1HE      LYS  12   7.058  -4.642   6.125
   34    HZ1  LYS  12           3HZ      LYS  12   5.849  -6.818   7.225
   35    HZ2  LYS  12           1HZ      LYS  12   6.277  -5.400   8.050
   36    HZ3  LYS  12           2HZ      LYS  12   7.328  -6.735   8.060
   37    H    TYR  13           H        TYR  13   5.461  -2.978   1.943
   38    HA   TYR  13           HA       TYR  13   7.479  -2.443  -0.099
   39    HB2  TYR  13           2HB      TYR  13   4.673  -1.479  -0.604
   40    HB3  TYR  13           1HB      TYR  13   6.030  -1.578  -1.728
   41    HD1  TYR  13           2HD      TYR  13   6.828  -3.814  -2.532
   42    HD2  TYR  13           1HD      TYR  13   3.248  -3.360  -0.202
   43    HE1  TYR  13           2HE      TYR  13   6.089  -6.077  -3.226
   44    HE2  TYR  13           1HE      TYR  13   2.509  -5.623  -0.899
   45    HH   TYR  13           HH       TYR  13   4.577  -7.687  -2.931
   46    H    ASP  14           H        ASP  14   7.838  -0.137  -0.415
   47    HA   ASP  14           HA       ASP  14   7.214   1.384   2.036
   48    HB2  ASP  14           2HB      ASP  14   9.620   0.996   1.352
   49    HB3  ASP  14           1HB      ASP  14   9.307   2.022  -0.047
   50    H    LEU  15           H        LEU  15   5.459   2.610   1.793
   51    HA   LEU  15           HA       LEU  15   4.969   3.940  -0.794
   52    HB2  LEU  15           2HB      LEU  15   3.032   3.879   1.510
   53    HB3  LEU  15           1HB      LEU  15   2.698   4.060  -0.212
   54    HG   LEU  15           HG       LEU  15   3.724   1.545   1.144
   55   HD11  LEU  15          1HD1      LEU  15   1.039   2.366   0.013
   56   HD12  LEU  15          2HD1      LEU  15   1.400   1.815   1.650
   57   HD13  LEU  15          3HD1      LEU  15   1.474   0.680   0.301
   58   HD21  LEU  15          3HD2      LEU  15   4.629   1.672  -1.095
   59   HD22  LEU  15          1HD2      LEU  15   3.076   2.194  -1.746
   60   HD23  LEU  15          2HD2      LEU  15   3.270   0.550  -1.139
   61    H    SER  16           H        SER  16   7.046   4.918   0.824
   62    HA   SER  16           HA       SER  16   6.685   6.840   2.674
   63    HB2  SER  16           2HB      SER  16   8.885   6.515   1.860
   64    HB3  SER  16           1HB      SER  16   8.417   6.906   0.207
   65    HG   SER  16           HG       SER  16   8.687   8.607   2.449
   66    H    LYS  17           H        LYS  17   5.834   7.138  -0.741
   67    HA   LYS  17           HA       LYS  17   3.985   9.278  -0.119
   68    HB2  LYS  17           2HB      LYS  17   4.964  10.913  -1.649
   69    HB3  LYS  17           1HB      LYS  17   6.107  10.512  -0.369
   70    HG2  LYS  17           2HG      LYS  17   7.577  10.162  -2.077
   71    HG3  LYS  17           1HG      LYS  17   6.744   8.621  -2.257
   72    HD2  LYS  17           2HD      LYS  17   6.644   9.478  -4.430
   73    HD3  LYS  17           1HD      LYS  17   5.090   9.986  -3.770
   74    HE2  LYS  17           2HE      LYS  17   6.311  12.156  -3.073
   75    HE3  LYS  17           1HE      LYS  17   7.581  11.640  -4.181
   76    HZ1  LYS  17           3HZ      LYS  17   6.378  12.412  -5.850
   77    HZ2  LYS  17           1HZ      LYS  17   5.140  12.877  -4.788
   78    HZ3  LYS  17           2HZ      LYS  17   5.129  11.323  -5.475
   79    H    TRP  18           H        TRP  18   2.258   9.110  -1.400
   80    HA   TRP  18           HA       TRP  18   2.547   7.902  -4.075
   81    HB2  TRP  18           2HB      TRP  18   0.892   6.910  -1.787
   82    HB3  TRP  18           1HB      TRP  18   0.227   6.782  -3.414
   83    HD1  TRP  18           HD       TRP  18   3.558   5.930  -1.625
   84    HE1  TRP  18           1HE      TRP  18   4.458   3.732  -2.623
   85    HE3  TRP  18           3HE      TRP  18  -0.015   5.043  -5.163
   86    HZ2  TRP  18           2HZ      TRP  18   3.753   1.843  -4.653
   87    HZ3  TRP  18           3HZ      TRP  18   0.123   3.037  -6.612
   88    HH2  TRP  18           HH       TRP  18   2.000   1.436  -6.361
   89    H    LYS  19           H        LYS  19   0.553   8.234  -5.400
   90    HA   LYS  19           HA       LYS  19  -0.606  10.890  -4.807
   91    HB2  LYS  19           2HB      LYS  19  -0.113   9.422  -7.403
   92    HB3  LYS  19           1HB      LYS  19  -1.131  10.857  -7.299
   93    HG2  LYS  19           2HG      LYS  19   0.991  11.726  -7.859
   94    HG3  LYS  19           1HG      LYS  19   0.893  11.966  -6.116
   95    HD2  LYS  19           2HD      LYS  19   2.293  10.081  -5.680
   96    HD3  LYS  19           1HD      LYS  19   2.149   9.499  -7.338
   97    HE2  LYS  19           2HE      LYS  19   3.316  11.563  -8.121
   98    HE3  LYS  19           1HE      LYS  19   3.547  12.032  -6.436
   99    HZ1  LYS  19           3HZ      LYS  19   4.904  10.175  -6.043
  100    HZ2  LYS  19           1HZ      LYS  19   5.442  10.808  -7.521
  101    HZ3  LYS  19           2HZ      LYS  19   4.456   9.423  -7.499
  102    H    TYR  20           H        TYR  20  -2.803  11.212  -4.881
  103    HA   TYR  20           HA       TYR  20  -4.526   9.183  -4.100
  104    HB2  TYR  20           2HB      TYR  20  -5.052  11.578  -3.877
  105    HB3  TYR  20           1HB      TYR  20  -5.232  11.702  -5.627
  106    HD1  TYR  20           1HD      TYR  20  -7.020  10.335  -6.787
  107    HD2  TYR  20           2HD      TYR  20  -6.811  10.729  -2.514
  108    HE1  TYR  20           1HE      TYR  20  -9.372   9.571  -6.601
  109    HE2  TYR  20           2HE      TYR  20  -9.163   9.965  -2.328
  110    HH   TYR  20           HH       TYR  20 -10.808   8.461  -4.821
  111    H    ALA  21           H        ALA  21  -3.708  10.306  -7.342
  112    HA   ALA  21           HA       ALA  21  -5.680   8.763  -8.709
  113    HB1  ALA  21           1HB      ALA  21  -4.435  10.774  -9.626
  114    HB2  ALA  21           2HB      ALA  21  -4.535   9.387 -10.711
  115    HB3  ALA  21           3HB      ALA  21  -3.041   9.713  -9.832
  116    H    GLU  22           H        GLU  22  -2.251   8.247  -7.942
  117    HA   GLU  22           HA       GLU  22  -1.969   5.785  -9.305
  118    HB2  GLU  22           2HB      GLU  22  -0.486   6.991  -6.965
  119    HB3  GLU  22           1HB      GLU  22  -0.023   5.461  -7.711
  120    HG2  GLU  22           2HG      GLU  22  -0.384   7.985  -9.331
  121    HG3  GLU  22           1HG      GLU  22   1.157   7.566  -8.587
  122    H    LEU  23           H        LEU  23  -2.846   6.573  -5.959
  123    HA   LEU  23           HA       LEU  23  -2.986   3.907  -5.014
  124    HB2  LEU  23           2HB      LEU  23  -4.463   6.372  -4.061
  125    HB3  LEU  23           1HB      LEU  23  -4.304   4.866  -3.161
  126    HG   LEU  23           HG       LEU  23  -1.885   6.375  -4.151
  127   HD11  LEU  23          1HD1      LEU  23  -1.783   7.249  -1.751
  128   HD12  LEU  23          2HD1      LEU  23  -3.476   6.775  -1.610
  129   HD13  LEU  23          3HD1      LEU  23  -2.996   7.994  -2.792
  130   HD21  LEU  23          3HD2      LEU  23  -1.359   4.150  -3.450
  131   HD22  LEU  23          1HD2      LEU  23  -2.420   4.263  -2.045
  132   HD23  LEU  23          2HD2      LEU  23  -0.918   5.185  -2.095
  133    H    ARG  24           H        ARG  24  -5.467   6.104  -6.306
  134    HA   ARG  24           HA       ARG  24  -7.604   4.230  -6.054
  135    HB2  ARG  24           2HB      ARG  24  -7.944   6.686  -6.206
  136    HB3  ARG  24           1HB      ARG  24  -7.383   6.639  -7.876
  137    HG2  ARG  24           2HG      ARG  24  -9.825   6.603  -7.839
  138    HG3  ARG  24           1HG      ARG  24  -9.226   5.053  -8.423
  139    HD2  ARG  24           2HD      ARG  24  -9.843   3.930  -6.487
  140    HD3  ARG  24           1HD      ARG  24  -9.715   5.371  -5.483
  141    HE   ARG  24           HE       ARG  24 -11.931   5.837  -5.976
  142   HH11  ARG  24          1HH2      ARG  24 -10.613   3.568  -8.230
  143   HH12  ARG  24          2HH2      ARG  24 -12.126   3.253  -9.011
  144   HH21  ARG  24          1HH1      ARG  24 -13.921   5.430  -6.995
  145   HH22  ARG  24          2HH1      ARG  24 -14.000   4.308  -8.313
  146    H    ASP  25           H        ASP  25  -5.266   4.984  -8.568
  147    HA   ASP  25           HA       ASP  25  -6.563   3.455 -10.618
  148    HB2  ASP  25           2HB      ASP  25  -3.811   4.651 -10.321
  149    HB3  ASP  25           1HB      ASP  25  -4.265   3.682 -11.719
  150    H    THR  26           H        THR  26  -3.751   2.902  -8.499
  151    HA   THR  26           HA       THR  26  -2.979   0.404  -9.433
  152    HB   THR  26           HB       THR  26  -2.938   1.462  -6.597
  153    HG1  THR  26           1HG      THR  26  -1.581   2.717  -7.627
  154   HG21  THR  26          3HG2      THR  26  -2.646  -0.894  -6.438
  155   HG22  THR  26          1HG2      THR  26  -1.016  -0.221  -6.422
  156   HG23  THR  26          2HG2      THR  26  -1.655  -0.943  -7.898
  157    H    ILE  27           H        ILE  27  -5.527   1.248  -7.128
  158    HA   ILE  27           HA       ILE  27  -6.178  -1.469  -6.482
  159    HB   ILE  27           HB       ILE  27  -7.750   1.094  -6.125
  160   HG12  ILE  27          2HG1      ILE  27  -6.239  -0.536  -4.068
  161   HG13  ILE  27          1HG1      ILE  27  -5.504   0.815  -4.933
  162   HG21  ILE  27          1HG2      ILE  27  -8.218  -1.752  -5.232
  163   HG22  ILE  27          2HG2      ILE  27  -9.344  -0.654  -6.028
  164   HG23  ILE  27          3HG2      ILE  27  -8.896  -0.388  -4.345
  165   HD11  ILE  27          3HD1      ILE  27  -8.129   1.126  -3.474
  166   HD12  ILE  27          1HD1      ILE  27  -7.006   2.384  -3.991
  167   HD13  ILE  27          2HD1      ILE  27  -6.585   1.326  -2.644
  168    H    ASN  28           H        ASN  28  -7.244   0.863  -8.880
  169    HA   ASN  28           HA       ASN  28  -9.395  -0.904  -9.793
  170    HB2  ASN  28           2HB      ASN  28  -8.528   1.880 -10.579
  171    HB3  ASN  28           1HB      ASN  28  -9.779   0.986 -11.443
  172   HD21  ASN  28          1HD2      ASN  28  -8.994   1.559  -7.956
  173   HD22  ASN  28          2HD2      ASN  28 -10.584   1.967  -7.525
  174    H    THR  29           H        THR  29  -6.256  -1.123 -10.122
  175    HA   THR  29           HA       THR  29  -6.419  -2.038 -12.925
  176    HB   THR  29           HB       THR  29  -4.087  -1.199 -13.267
  177    HG1  THR  29           1HG      THR  29  -4.128   0.687 -11.396
  178   HG21  THR  29          3HG2      THR  29  -6.240   0.816 -12.574
  179   HG22  THR  29          1HG2      THR  29  -5.929   0.096 -14.153
  180   HG23  THR  29          2HG2      THR  29  -4.761   1.215 -13.449
  181    H    SER  30           H        SER  30  -4.317  -2.002 -10.039
  182    HA   SER  30           HA       SER  30  -3.247  -4.622 -10.706
  183    HB2  SER  30           2HB      SER  30  -2.046  -2.592  -9.536
  184    HB3  SER  30           1HB      SER  30  -2.768  -3.265  -8.077
  185    HG   SER  30           HG       SER  30  -0.861  -4.355  -9.822
  186    H    CYS  31           H        CYS  31  -3.079  -6.167  -8.702
  187    HA   CYS  31           HA       CYS  31  -5.422  -6.205  -7.003
  188    HB2  CYS  31           2HB      CYS  31  -6.302  -7.128  -9.128
  189    HB3  CYS  31           1HB      CYS  31  -5.058  -8.378  -9.077
  190    HG   CYS  31           HG       CYS  31  -6.589  -8.424  -6.490
  191    H    ASP  32           H        ASP  32  -4.774  -6.969  -5.108
  192    HA   ASP  32           HA       ASP  32  -3.302  -9.368  -4.770
  193    HB2  ASP  32           2HB      ASP  32  -1.570  -7.532  -5.571
  194    HB3  ASP  32           1HB      ASP  32  -1.660  -7.025  -3.887
  195    H    ILE  33           H        ILE  33  -2.907  -9.852  -2.508
  196    HA   ILE  33           HA       ILE  33  -4.905  -8.616  -0.797
  197    HB   ILE  33           HB       ILE  33  -2.972 -10.878  -0.233
  198   HG12  ILE  33          2HG1      ILE  33  -5.916 -11.024  -0.932
  199   HG13  ILE  33          1HG1      ILE  33  -4.637 -11.209  -2.132
  200   HG21  ILE  33          1HG2      ILE  33  -5.324  -9.698   1.246
  201   HG22  ILE  33          2HG2      ILE  33  -3.713 -10.067   1.861
  202   HG23  ILE  33          3HG2      ILE  33  -4.837 -11.375   1.497
  203   HD11  ILE  33          3HD1      ILE  33  -4.841 -12.890   0.381
  204   HD12  ILE  33          1HD1      ILE  33  -3.738 -13.134  -0.975
  205   HD13  ILE  33          2HD1      ILE  33  -5.470 -13.391  -1.190
  206    H    GLU  34           H        GLU  34  -1.713  -8.009  -1.544
  207    HA   GLU  34           HA       GLU  34  -1.082  -6.946   1.139
  208    HB2  GLU  34           2HB      GLU  34   0.806  -7.205  -1.204
  209    HB3  GLU  34           1HB      GLU  34   1.210  -6.977   0.497
  210    HG2  GLU  34           2HG      GLU  34   0.197  -9.191   1.007
  211    HG3  GLU  34           1HG      GLU  34  -0.106  -9.424  -0.714
  212    H    LEU  35           H        LEU  35  -0.598  -6.014  -2.285
  213    HA   LEU  35           HA       LEU  35  -0.058  -3.320  -1.848
  214    HB2  LEU  35           2HB      LEU  35  -1.308  -4.772  -4.176
  215    HB3  LEU  35           1HB      LEU  35  -1.029  -3.033  -4.215
  216    HG   LEU  35           HG       LEU  35   1.127  -5.078  -3.616
  217   HD11  LEU  35          1HD1      LEU  35   0.719  -3.532  -6.185
  218   HD12  LEU  35          2HD1      LEU  35   0.137  -5.181  -5.958
  219   HD13  LEU  35          3HD1      LEU  35   1.865  -4.838  -5.885
  220   HD21  LEU  35          3HD2      LEU  35   2.015  -3.121  -2.773
  221   HD22  LEU  35          1HD2      LEU  35   1.005  -2.096  -3.791
  222   HD23  LEU  35          2HD2      LEU  35   2.432  -2.880  -4.468
  223    H    LEU  36           H        LEU  36  -3.211  -4.836  -2.570
  224    HA   LEU  36           HA       LEU  36  -4.769  -2.520  -2.470
  225    HB2  LEU  36           2HB      LEU  36  -5.510  -5.334  -1.628
  226    HB3  LEU  36           1HB      LEU  36  -6.657  -4.034  -1.940
  227    HG   LEU  36           HG       LEU  36  -4.687  -5.159  -3.955
  228   HD11  LEU  36          1HD1      LEU  36  -7.703  -5.338  -4.021
  229   HD12  LEU  36          2HD1      LEU  36  -6.720  -6.576  -3.241
  230   HD13  LEU  36          3HD1      LEU  36  -6.532  -6.258  -4.965
  231   HD21  LEU  36          3HD2      LEU  36  -6.596  -2.845  -3.958
  232   HD22  LEU  36          1HD2      LEU  36  -6.388  -3.759  -5.452
  233   HD23  LEU  36          2HD2      LEU  36  -5.001  -2.980  -4.695
  234    H    ALA  37           H        ALA  37  -3.956  -4.792   0.149
  235    HA   ALA  37           HA       ALA  37  -5.331  -3.382   2.185
  236    HB1  ALA  37           1HB      ALA  37  -4.211  -4.810   3.718
  237    HB2  ALA  37           2HB      ALA  37  -2.866  -5.073   2.607
  238    HB3  ALA  37           3HB      ALA  37  -4.446  -5.780   2.265
  239    H    ALA  38           H        ALA  38  -2.104  -3.125   0.826
  240    HA   ALA  38           HA       ALA  38  -1.117  -1.316   2.833
  241    HB1  ALA  38           1HB      ALA  38  -0.004  -1.626   0.049
  242    HB2  ALA  38           2HB      ALA  38   0.260  -2.846   1.294
  243    HB3  ALA  38           3HB      ALA  38   0.852  -1.202   1.531
  244    H    CYS  39           H        CYS  39  -2.672  -1.021  -0.302
  245    HA   CYS  39           HA       CYS  39  -2.205   1.781  -0.616
  246    HB2  CYS  39           2HB      CYS  39  -2.723   0.273  -2.512
  247    HB3  CYS  39           1HB      CYS  39  -4.346   0.040  -1.864
  248    HG   CYS  39           HG       CYS  39  -3.300   2.634  -3.197
  249    H    ARG  40           H        ARG  40  -5.069  -0.112   0.358
  250    HA   ARG  40           HA       ARG  40  -6.842   1.954   0.835
  251    HB2  ARG  40           2HB      ARG  40  -6.476  -0.689   2.249
  252    HB3  ARG  40           1HB      ARG  40  -7.813   0.403   2.605
  253    HG2  ARG  40           2HG      ARG  40  -8.685   0.230   0.400
  254    HG3  ARG  40           1HG      ARG  40  -7.199  -0.498  -0.213
  255    HD2  ARG  40           2HD      ARG  40  -9.240  -2.048   0.271
  256    HD3  ARG  40           1HD      ARG  40  -7.641  -2.565   0.797
  257    HE   ARG  40           HE       ARG  40  -9.107  -1.060   2.792
  258   HH11  ARG  40          1HH2      ARG  40  -8.447  -4.149   1.376
  259   HH12  ARG  40          2HH2      ARG  40  -8.888  -5.045   2.792
  260   HH21  ARG  40          1HH1      ARG  40  -9.685  -2.229   4.652
  261   HH22  ARG  40          2HH1      ARG  40  -9.588  -3.958   4.646
  262    H    GLU  41           H        GLU  41  -4.236   0.751   2.888
  263    HA   GLU  41           HA       GLU  41  -4.835   2.068   5.268
  264    HB2  GLU  41           2HB      GLU  41  -2.233   1.274   3.977
  265    HB3  GLU  41           1HB      GLU  41  -2.264   2.099   5.535
  266    HG2  GLU  41           2HG      GLU  41  -3.465   0.341   6.572
  267    HG3  GLU  41           1HG      GLU  41  -3.937  -0.361   5.026
  268    H    GLU  42           H        GLU  42  -2.842   3.231   2.543
  269    HA   GLU  42           HA       GLU  42  -2.392   5.809   3.664
  270    HB2  GLU  42           2HB      GLU  42  -2.358   5.235   0.708
  271    HB3  GLU  42           1HB      GLU  42  -1.345   6.346   1.631
  272    HG2  GLU  42           2HG      GLU  42  -1.256   3.321   1.684
  273    HG3  GLU  42           1HG      GLU  42  -0.007   4.410   1.085
  274    H    PHE  43           H        PHE  43  -4.730   4.559   1.303
  275    HA   PHE  43           HA       PHE  43  -5.947   6.887   0.477
  276    HB2  PHE  43           2HB      PHE  43  -6.462   4.478  -0.218
  277    HB3  PHE  43           1HB      PHE  43  -7.521   4.413   1.192
  278    HD1  PHE  43           2HD      PHE  43  -9.378   6.137   1.414
  279    HD2  PHE  43           1HD      PHE  43  -7.152   5.564  -2.214
  280    HE1  PHE  43           2HE      PHE  43 -11.156   7.303   0.139
  281    HE2  PHE  43           1HE      PHE  43  -8.930   6.727  -3.491
  282    HZ   PHE  43           HZ       PHE  43 -10.933   7.599  -2.314
  283    H    HIS  44           H        HIS  44  -6.323   5.188   3.535
  284    HA   HIS  44           HA       HIS  44  -8.550   6.730   4.455
  285    HB2  HIS  44           2HB      HIS  44  -6.568   4.906   5.803
  286    HB3  HIS  44           1HB      HIS  44  -7.773   5.801   6.729
  287    HD2  HIS  44           2HD      HIS  44  -7.555   2.456   5.035
  288    HE1  HIS  44           1HE      HIS  44 -11.654   3.450   4.901
  289    HE2  HIS  44           2HE      HIS  44  -9.971   1.574   4.592
  290    H    ARG  45           H        ARG  45  -5.048   7.008   4.717
  291    HA   ARG  45           HA       ARG  45  -4.930   8.998   6.703
  292    HB2  ARG  45           2HB      ARG  45  -3.056   8.527   4.371
  293    HB3  ARG  45           1HB      ARG  45  -2.691   9.489   5.804
  294    HG2  ARG  45           2HG      ARG  45  -3.126   7.453   7.208
  295    HG3  ARG  45           1HG      ARG  45  -3.293   6.520   5.720
  296    HD2  ARG  45           2HD      ARG  45  -1.001   6.361   6.659
  297    HD3  ARG  45           1HD      ARG  45  -1.011   7.104   5.062
  298    HE   ARG  45           HE       ARG  45  -1.174   9.227   6.792
  299   HH11  ARG  45          1HH2      ARG  45   0.922   6.503   6.378
  300   HH12  ARG  45          2HH2      ARG  45   2.325   7.316   6.987
  301   HH21  ARG  45          1HH1      ARG  45   0.661  10.298   7.591
  302   HH22  ARG  45          2HH1      ARG  45   2.178   9.465   7.673
  303    H    ARG  46           H        ARG  46  -5.675   9.142   3.298
  304    HA   ARG  46           HA       ARG  46  -5.280  11.947   2.960
  305    HB2  ARG  46           2HB      ARG  46  -7.268  10.376   1.347
  306    HB3  ARG  46           1HB      ARG  46  -6.185  11.667   0.828
  307    HG2  ARG  46           2HG      ARG  46  -5.381   8.849   1.607
  308    HG3  ARG  46           1HG      ARG  46  -5.355   9.534  -0.016
  309    HD2  ARG  46           2HD      ARG  46  -3.735  11.267   0.822
  310    HD3  ARG  46           1HD      ARG  46  -3.662  10.388   2.346
  311    HE   ARG  46           HE       ARG  46  -3.040   8.438   0.627
  312   HH11  ARG  46          1HH2      ARG  46  -2.023  11.745   0.803
  313   HH12  ARG  46          2HH2      ARG  46  -0.466  11.445   0.106
  314   HH21  ARG  46          1HH1      ARG  46  -0.998   8.042  -0.283
  315   HH22  ARG  46          2HH1      ARG  46   0.114   9.349  -0.507
  316    H    LEU  47           H        LEU  47  -8.018   9.935   3.900
  317    HA   LEU  47           HA       LEU  47  -9.941  12.056   3.871
  318    HB2  LEU  47           2HB      LEU  47 -10.226   9.592   5.566
  319    HB3  LEU  47           1HB      LEU  47 -11.464  10.483   4.680
  320    HG   LEU  47           HG       LEU  47  -9.277   8.752   3.493
  321   HD11  LEU  47          1HD1      LEU  47 -11.139   7.460   4.372
  322   HD12  LEU  47          2HD1      LEU  47 -11.257   7.489   2.613
  323   HD13  LEU  47          3HD1      LEU  47 -12.300   8.529   3.584
  324   HD21  LEU  47          3HD2      LEU  47 -10.561   9.300   1.334
  325   HD22  LEU  47          1HD2      LEU  47  -9.539  10.581   1.986
  326   HD23  LEU  47          2HD2      LEU  47 -11.284  10.633   2.234
  327    H    LYS  48           H        LYS  48  -7.838  10.621   6.313
  328    HA   LYS  48           HA       LYS  48  -8.833  11.625   8.658
  329    HB2  LYS  48           2HB      LYS  48  -6.783  10.217   8.428
  330    HB3  LYS  48           1HB      LYS  48  -5.905  11.651   7.896
  331    HG2  LYS  48           2HG      LYS  48  -6.302  12.763  10.004
  332    HG3  LYS  48           1HG      LYS  48  -7.393  11.483  10.529
  333    HD2  LYS  48           2HD      LYS  48  -5.317  11.027  11.611
  334    HD3  LYS  48           1HD      LYS  48  -5.415   9.880  10.276
  335    HE2  LYS  48           2HE      LYS  48  -3.896  11.147   8.943
  336    HE3  LYS  48           1HE      LYS  48  -4.025  12.553  10.000
  337    HZ1  LYS  48           3HZ      LYS  48  -1.981  11.099  10.249
  338    HZ2  LYS  48           1HZ      LYS  48  -3.004   9.957  10.977
  339    HZ3  LYS  48           2HZ      LYS  48  -2.819  11.495  11.674
  340    H    VAL  49           H        VAL  49  -6.087  13.302   7.153
  341    HA   VAL  49           HA       VAL  49  -6.331  15.719   8.398
  342    HB   VAL  49           HB       VAL  49  -4.468  15.180   6.912
  343   HG11  VAL  49          1HG1      VAL  49  -6.112  14.146   5.169
  344   HG12  VAL  49          2HG1      VAL  49  -4.670  14.973   4.580
  345   HG13  VAL  49          3HG1      VAL  49  -6.231  15.791   4.545
  346   HG21  VAL  49          3HG2      VAL  49  -4.188  17.369   5.944
  347   HG22  VAL  49          1HG2      VAL  49  -5.125  17.579   7.423
  348   HG23  VAL  49          2HG2      VAL  49  -5.931  17.614   5.855
  349    H    TYR  50           H        TYR  50  -7.969  17.080   8.597
  350    HA   TYR  50           HA       TYR  50  -9.341  18.208   6.389
  351    HB2  TYR  50           2HB      TYR  50 -10.415  15.915   6.490
  352    HB3  TYR  50           1HB      TYR  50 -11.059  16.376   8.066
  353    HD1  TYR  50           2HD      TYR  50 -11.080  17.171   4.447
  354    HD2  TYR  50           1HD      TYR  50 -12.857  17.961   8.277
  355    HE1  TYR  50           2HE      TYR  50 -12.929  18.393   3.336
  356    HE2  TYR  50           1HE      TYR  50 -14.707  19.184   7.165
  357    HH   TYR  50           HH       TYR  50 -14.834  20.486   4.708
  358    H    HIS  51           H        HIS  51  -8.679  20.070   7.546
  359    HA   HIS  51           HA       HIS  51  -8.976  21.831   8.989
  360    HB2  HIS  51           2HB      HIS  51 -11.381  21.387   8.169
  361    HB3  HIS  51           1HB      HIS  51 -11.634  20.620   9.736
  362    HD2  HIS  51           2HD      HIS  51  -9.888  22.865  11.528
  363    HE1  HIS  51           1HE      HIS  51 -12.690  25.607   9.968
  364    HE2  HIS  51           2HE      HIS  51 -10.950  25.235  11.778
  Start of MODEL   15
    1    H1   GLY   9           H        GLY   9  10.455 -13.630   7.336
    2    HA2  GLY   9           2HA      GLY   9   9.651 -14.893   4.861
    3    HA3  GLY   9           1HA      GLY   9   8.920 -15.132   6.446
    4    H    THR  10           H        THR  10   9.406 -12.195   4.489
    5    HA   THR  10           HA       THR  10   6.683 -11.928   3.721
    6    HB   THR  10           HB       THR  10   6.348 -11.490   6.111
    7    HG1  THR  10           1HG      THR  10   5.540  -9.317   5.839
    8   HG21  THR  10          3HG2      THR  10   8.293  -9.199   5.735
    9   HG22  THR  10          1HG2      THR  10   8.700 -10.720   6.528
   10   HG23  THR  10          2HG2      THR  10   7.477  -9.661   7.229
   11    H    LYS  11           H        LYS  11   6.407 -10.269   2.261
   12    HA   LYS  11           HA       LYS  11   8.720  -8.478   1.809
   13    HB2  LYS  11           2HB      LYS  11   8.432 -10.503   0.187
   14    HB3  LYS  11           1HB      LYS  11   7.087  -9.573  -0.467
   15    HG2  LYS  11           2HG      LYS  11   8.815  -8.776  -1.798
   16    HG3  LYS  11           1HG      LYS  11   8.875  -7.608  -0.479
   17    HD2  LYS  11           2HD      LYS  11  10.653  -8.901   0.615
   18    HD3  LYS  11           1HD      LYS  11  10.569 -10.119  -0.659
   19    HE2  LYS  11           2HE      LYS  11  12.423  -8.402  -0.931
   20    HE3  LYS  11           1HE      LYS  11  11.342  -8.563  -2.315
   21    HZ1  LYS  11           3HZ      LYS  11  10.098  -6.654  -1.526
   22    HZ2  LYS  11           1HZ      LYS  11  11.727  -6.246  -1.755
   23    HZ3  LYS  11           2HZ      LYS  11  11.130  -6.503  -0.185
   24    H    LYS  12           H        LYS  12   7.793  -6.652   2.649
   25    HA   LYS  12           HA       LYS  12   5.103  -5.866   1.828
   26    HB2  LYS  12           2HB      LYS  12   5.644  -3.851   3.303
   27    HB3  LYS  12           1HB      LYS  12   5.555  -5.414   4.111
   28    HG2  LYS  12           2HG      LYS  12   8.220  -4.581   3.042
   29    HG3  LYS  12           1HG      LYS  12   7.631  -3.740   4.473
   30    HD2  LYS  12           2HD      LYS  12   7.452  -6.734   4.423
   31    HD3  LYS  12           1HD      LYS  12   9.030  -5.997   4.690
   32    HE2  LYS  12           2HE      LYS  12   7.483  -6.511   6.750
   33    HE3  LYS  12           1HE      LYS  12   8.372  -4.990   6.693
   34    HZ1  LYS  12           3HZ      LYS  12   6.203  -4.243   5.426
   35    HZ2  LYS  12           1HZ      LYS  12   6.304  -4.202   7.118
   36    HZ3  LYS  12           2HZ      LYS  12   5.515  -5.494   6.347
   37    H    TYR  13           H        TYR  13   5.278  -3.156   1.676
   38    HA   TYR  13           HA       TYR  13   7.210  -2.555  -0.467
   39    HB2  TYR  13           2HB      TYR  13   4.256  -1.917  -0.648
   40    HB3  TYR  13           1HB      TYR  13   5.487  -1.596  -1.869
   41    HD1  TYR  13           2HD      TYR  13   6.464  -3.409  -3.194
   42    HD2  TYR  13           1HD      TYR  13   3.445  -4.185  -0.237
   43    HE1  TYR  13           2HE      TYR  13   6.127  -5.678  -4.133
   44    HE2  TYR  13           1HE      TYR  13   3.108  -6.455  -1.177
   45    HH   TYR  13           HH       TYR  13   4.138  -8.056  -2.523
   46    H    ASP  14           H        ASP  14   7.759  -0.373  -0.651
   47    HA   ASP  14           HA       ASP  14   7.143   1.227   1.734
   48    HB2  ASP  14           2HB      ASP  14   9.011   2.678   0.844
   49    HB3  ASP  14           1HB      ASP  14   9.484   1.040   1.290
   50    H    LEU  15           H        LEU  15   5.383   2.462   1.538
   51    HA   LEU  15           HA       LEU  15   4.857   3.808  -1.041
   52    HB2  LEU  15           2HB      LEU  15   2.883   3.614   1.222
   53    HB3  LEU  15           1HB      LEU  15   2.576   3.847  -0.497
   54    HG   LEU  15           HG       LEU  15   3.650   1.311   0.778
   55   HD11  LEU  15          1HD1      LEU  15   1.333   1.470   1.299
   56   HD12  LEU  15          2HD1      LEU  15   1.407   0.444  -0.133
   57   HD13  LEU  15          3HD1      LEU  15   0.942   2.139  -0.286
   58   HD21  LEU  15          3HD2      LEU  15   4.541   1.568  -1.469
   59   HD22  LEU  15          1HD2      LEU  15   2.955   2.025  -2.088
   60   HD23  LEU  15          2HD2      LEU  15   3.241   0.380  -1.528
   61    H    SER  16           H        SER  16   6.816   4.661   0.982
   62    HA   SER  16           HA       SER  16   6.179   6.606   2.738
   63    HB2  SER  16           2HB      SER  16   8.488   6.113   2.265
   64    HB3  SER  16           1HB      SER  16   8.330   6.708   0.615
   65    HG   SER  16           HG       SER  16   9.240   8.162   2.327
   66    H    LYS  17           H        LYS  17   6.276   7.049  -0.790
   67    HA   LYS  17           HA       LYS  17   4.516   9.399  -0.466
   68    HB2  LYS  17           2HB      LYS  17   6.552   9.418  -2.650
   69    HB3  LYS  17           1HB      LYS  17   5.835  10.765  -1.767
   70    HG2  LYS  17           2HG      LYS  17   7.103   9.898   0.284
   71    HG3  LYS  17           1HG      LYS  17   8.001   8.876  -0.837
   72    HD2  LYS  17           2HD      LYS  17   7.825  11.897  -0.878
   73    HD3  LYS  17           1HD      LYS  17   9.250  10.926  -0.504
   74    HE2  LYS  17           2HE      LYS  17   8.900   9.898  -2.866
   75    HE3  LYS  17           1HE      LYS  17   7.879  11.305  -3.161
   76    HZ1  LYS  17           3HZ      LYS  17  10.444  11.355  -3.633
   77    HZ2  LYS  17           1HZ      LYS  17  10.521  11.743  -1.984
   78    HZ3  LYS  17           2HZ      LYS  17   9.630  12.726  -3.047
   79    H    TRP  18           H        TRP  18   2.760   9.320  -1.720
   80    HA   TRP  18           HA       TRP  18   2.815   7.860  -4.259
   81    HB2  TRP  18           2HB      TRP  18   1.263   7.055  -1.839
   82    HB3  TRP  18           1HB      TRP  18   0.448   6.943  -3.398
   83    HD1  TRP  18           HD       TRP  18   3.761   5.803  -1.762
   84    HE1  TRP  18           1HE      TRP  18   4.442   3.551  -2.812
   85    HE3  TRP  18           3HE      TRP  18   0.051   5.287  -5.233
   86    HZ2  TRP  18           2HZ      TRP  18   3.533   1.762  -4.848
   87    HZ3  TRP  18           3HZ      TRP  18  -0.020   3.299  -6.710
   88    HH2  TRP  18           HH       TRP  18   1.714   1.535  -6.523
   89    H    LYS  19           H        LYS  19   0.704   8.205  -5.451
   90    HA   LYS  19           HA       LYS  19  -0.280  10.949  -4.928
   91    HB2  LYS  19           2HB      LYS  19   0.007   9.426  -7.529
   92    HB3  LYS  19           1HB      LYS  19  -0.784  10.994  -7.378
   93    HG2  LYS  19           2HG      LYS  19   1.349  11.708  -7.911
   94    HG3  LYS  19           1HG      LYS  19   1.511  11.631  -6.159
   95    HD2  LYS  19           2HD      LYS  19   2.473   9.372  -6.334
   96    HD3  LYS  19           1HD      LYS  19   2.277   9.416  -8.087
   97    HE2  LYS  19           2HE      LYS  19   3.715  11.527  -8.055
   98    HE3  LYS  19           1HE      LYS  19   4.094  11.126  -6.381
   99    HZ1  LYS  19           3HZ      LYS  19   5.403   9.437  -6.995
  100    HZ2  LYS  19           1HZ      LYS  19   5.454  10.214  -8.500
  101    HZ3  LYS  19           2HZ      LYS  19   4.366   8.934  -8.244
  102    H    TYR  20           H        TYR  20  -2.453  11.352  -4.941
  103    HA   TYR  20           HA       TYR  20  -4.242   9.400  -4.125
  104    HB2  TYR  20           2HB      TYR  20  -4.519  11.938  -4.046
  105    HB3  TYR  20           1HB      TYR  20  -5.069  11.826  -5.718
  106    HD1  TYR  20           1HD      TYR  20  -7.050  10.336  -6.265
  107    HD2  TYR  20           2HD      TYR  20  -5.954  11.362  -2.240
  108    HE1  TYR  20           1HE      TYR  20  -9.306   9.668  -5.480
  109    HE2  TYR  20           2HE      TYR  20  -8.210  10.695  -1.456
  110    HH   TYR  20           HH       TYR  20 -10.115   9.630  -2.033
  111    H    ALA  21           H        ALA  21  -3.397  10.440  -7.379
  112    HA   ALA  21           HA       ALA  21  -5.481   8.980  -8.696
  113    HB1  ALA  21           1HB      ALA  21  -2.878  10.158  -9.686
  114    HB2  ALA  21           2HB      ALA  21  -4.494  10.841  -9.853
  115    HB3  ALA  21           3HB      ALA  21  -4.059   9.379 -10.738
  116    H    GLU  22           H        GLU  22  -2.185   8.284  -7.700
  117    HA   GLU  22           HA       GLU  22  -1.976   5.824  -9.173
  118    HB2  GLU  22           2HB      GLU  22  -0.368   7.065  -6.940
  119    HB3  GLU  22           1HB      GLU  22  -0.004   5.462  -7.582
  120    HG2  GLU  22           2HG      GLU  22  -0.253   7.917  -9.334
  121    HG3  GLU  22           1HG      GLU  22   1.280   7.378  -8.654
  122    H    LEU  23           H        LEU  23  -2.525   6.638  -5.744
  123    HA   LEU  23           HA       LEU  23  -2.751   4.058  -4.726
  124    HB2  LEU  23           2HB      LEU  23  -4.312   6.518  -3.896
  125    HB3  LEU  23           1HB      LEU  23  -4.094   5.065  -2.924
  126    HG   LEU  23           HG       LEU  23  -1.768   6.689  -3.973
  127   HD11  LEU  23          1HD1      LEU  23  -3.267   8.050  -2.483
  128   HD12  LEU  23          2HD1      LEU  23  -1.657   7.788  -1.814
  129   HD13  LEU  23          3HD1      LEU  23  -3.022   6.845  -1.219
  130   HD21  LEU  23          3HD2      LEU  23  -2.125   4.488  -1.929
  131   HD22  LEU  23          1HD2      LEU  23  -0.706   5.535  -1.920
  132   HD23  LEU  23          2HD2      LEU  23  -1.043   4.520  -3.320
  133    H    ARG  24           H        ARG  24  -5.275   6.142  -6.118
  134    HA   ARG  24           HA       ARG  24  -7.371   4.227  -5.815
  135    HB2  ARG  24           2HB      ARG  24  -7.644   6.736  -6.101
  136    HB3  ARG  24           1HB      ARG  24  -7.276   6.494  -7.809
  137    HG2  ARG  24           2HG      ARG  24  -9.583   6.311  -7.885
  138    HG3  ARG  24           1HG      ARG  24  -9.167   4.623  -7.592
  139    HD2  ARG  24           2HD      ARG  24  -9.361   5.164  -5.097
  140    HD3  ARG  24           1HD      ARG  24 -10.103   6.684  -5.587
  141    HE   ARG  24           HE       ARG  24 -11.308   4.305  -6.746
  142   HH11  ARG  24          1HH2      ARG  24 -11.245   6.610  -4.167
  143   HH12  ARG  24          2HH2      ARG  24 -12.888   6.333  -3.694
  144   HH21  ARG  24          1HH1      ARG  24 -13.465   3.936  -6.133
  145   HH22  ARG  24          2HH1      ARG  24 -14.144   4.820  -4.808
  146    H    ASP  25           H        ASP  25  -5.435   5.277  -8.617
  147    HA   ASP  25           HA       ASP  25  -6.552   3.605 -10.542
  148    HB2  ASP  25           2HB      ASP  25  -4.987   5.375 -11.122
  149    HB3  ASP  25           1HB      ASP  25  -3.687   4.541 -10.271
  150    H    THR  26           H        THR  26  -3.745   2.981  -8.433
  151    HA   THR  26           HA       THR  26  -3.086   0.437  -9.333
  152    HB   THR  26           HB       THR  26  -2.953   1.548  -6.520
  153    HG1  THR  26           1HG      THR  26  -1.792   2.600  -8.284
  154   HG21  THR  26          3HG2      THR  26  -1.096  -0.203  -6.340
  155   HG22  THR  26          1HG2      THR  26  -1.783  -0.930  -7.792
  156   HG23  THR  26          2HG2      THR  26  -2.749  -0.816  -6.321
  157    H    ILE  27           H        ILE  27  -5.477   1.390  -6.887
  158    HA   ILE  27           HA       ILE  27  -6.256  -1.302  -6.280
  159    HB   ILE  27           HB       ILE  27  -7.634   1.341  -5.753
  160   HG12  ILE  27          2HG1      ILE  27  -6.120  -0.457  -3.845
  161   HG13  ILE  27          1HG1      ILE  27  -5.350   0.877  -4.703
  162   HG21  ILE  27          1HG2      ILE  27  -9.324  -0.329  -5.635
  163   HG22  ILE  27          2HG2      ILE  27  -8.794  -0.099  -3.968
  164   HG23  ILE  27          3HG2      ILE  27  -8.229  -1.493  -4.889
  165   HD11  ILE  27          3HD1      ILE  27  -7.853   1.269  -3.056
  166   HD12  ILE  27          1HD1      ILE  27  -6.729   2.498  -3.638
  167   HD13  ILE  27          2HD1      ILE  27  -6.240   1.395  -2.351
  168    H    ASN  28           H        ASN  28  -7.086   1.006  -8.717
  169    HA   ASN  28           HA       ASN  28  -9.479  -0.533  -9.495
  170    HB2  ASN  28           2HB      ASN  28  -8.470   2.210 -10.255
  171    HB3  ASN  28           1HB      ASN  28  -9.810   1.420 -11.084
  172   HD21  ASN  28          1HD2      ASN  28  -8.802   2.039  -7.663
  173   HD22  ASN  28          2HD2      ASN  28 -10.361   2.455  -7.137
  174    H    THR  29           H        THR  29  -6.432  -1.059  -9.948
  175    HA   THR  29           HA       THR  29  -6.775  -1.917 -12.736
  176    HB   THR  29           HB       THR  29  -4.458  -1.123 -13.263
  177    HG1  THR  29           1HG      THR  29  -4.198  -0.819 -10.799
  178   HG21  THR  29          3HG2      THR  29  -5.116   1.201 -13.634
  179   HG22  THR  29          1HG2      THR  29  -6.402   1.050 -12.437
  180   HG23  THR  29          2HG2      THR  29  -6.489   0.138 -13.943
  181    H    SER  30           H        SER  30  -4.607  -1.908  -9.908
  182    HA   SER  30           HA       SER  30  -3.546  -4.524 -10.645
  183    HB2  SER  30           2HB      SER  30  -2.284  -2.494  -9.530
  184    HB3  SER  30           1HB      SER  30  -2.935  -3.174  -8.040
  185    HG   SER  30           HG       SER  30  -0.806  -3.954  -9.278
  186    H    CYS  31           H        CYS  31  -3.322  -6.098  -8.701
  187    HA   CYS  31           HA       CYS  31  -5.577  -6.105  -6.873
  188    HB2  CYS  31           2HB      CYS  31  -6.488  -7.030  -9.030
  189    HB3  CYS  31           1HB      CYS  31  -5.323  -8.347  -8.888
  190    HG   CYS  31           HG       CYS  31  -6.673  -9.370  -7.056
  191    H    ASP  32           H        ASP  32  -4.848  -6.878  -5.010
  192    HA   ASP  32           HA       ASP  32  -3.383  -9.285  -4.741
  193    HB2  ASP  32           2HB      ASP  32  -1.681  -7.445  -5.632
  194    HB3  ASP  32           1HB      ASP  32  -1.659  -6.979  -3.934
  195    H    ILE  33           H        ILE  33  -2.974  -9.822  -2.527
  196    HA   ILE  33           HA       ILE  33  -4.838  -8.550  -0.715
  197    HB   ILE  33           HB       ILE  33  -2.852 -10.730  -0.055
  198   HG12  ILE  33          2HG1      ILE  33  -4.014 -11.485  -2.033
  199   HG13  ILE  33          1HG1      ILE  33  -4.756 -12.288  -0.650
  200   HG21  ILE  33          1HG2      ILE  33  -3.988  -9.802   1.869
  201   HG22  ILE  33          2HG2      ILE  33  -4.715 -11.370   1.516
  202   HG23  ILE  33          3HG2      ILE  33  -5.547  -9.886   1.049
  203   HD11  ILE  33          3HD1      ILE  33  -5.826  -9.981  -2.273
  204   HD12  ILE  33          1HD1      ILE  33  -6.428 -10.310  -0.650
  205   HD13  ILE  33          2HD1      ILE  33  -6.600 -11.524  -1.916
  206    H    GLU  34           H        GLU  34  -1.610  -8.072  -1.566
  207    HA   GLU  34           HA       GLU  34  -0.873  -6.974   1.065
  208    HB2  GLU  34           2HB      GLU  34   0.892  -7.209  -1.371
  209    HB3  GLU  34           1HB      GLU  34   1.382  -7.010   0.313
  210    HG2  GLU  34           2HG      GLU  34   0.035  -9.436  -0.906
  211    HG3  GLU  34           1HG      GLU  34   1.691  -9.337  -0.313
  212    H    LEU  35           H        LEU  35  -0.572  -6.003  -2.371
  213    HA   LEU  35           HA       LEU  35   0.015  -3.322  -1.933
  214    HB2  LEU  35           2HB      LEU  35  -1.429  -4.691  -4.201
  215    HB3  LEU  35           1HB      LEU  35  -1.050  -2.972  -4.227
  216    HG   LEU  35           HG       LEU  35   1.000  -5.173  -3.832
  217   HD11  LEU  35          1HD1      LEU  35   1.607  -4.900  -6.118
  218   HD12  LEU  35          2HD1      LEU  35   0.615  -3.450  -6.288
  219   HD13  LEU  35          3HD1      LEU  35  -0.152  -5.030  -6.121
  220   HD21  LEU  35          3HD2      LEU  35   2.056  -3.321  -2.934
  221   HD22  LEU  35          1HD2      LEU  35   1.080  -2.180  -3.858
  222   HD23  LEU  35          2HD2      LEU  35   2.416  -3.030  -4.634
  223    H    LEU  36           H        LEU  36  -3.193  -4.777  -2.519
  224    HA   LEU  36           HA       LEU  36  -4.709  -2.446  -2.274
  225    HB2  LEU  36           2HB      LEU  36  -5.453  -5.269  -1.469
  226    HB3  LEU  36           1HB      LEU  36  -6.591  -3.944  -1.700
  227    HG   LEU  36           HG       LEU  36  -4.721  -5.026  -3.829
  228   HD11  LEU  36          1HD1      LEU  36  -6.652  -6.063  -4.804
  229   HD12  LEU  36          2HD1      LEU  36  -7.735  -5.254  -3.673
  230   HD13  LEU  36          3HD1      LEU  36  -6.649  -6.520  -3.101
  231   HD21  LEU  36          3HD2      LEU  36  -6.657  -2.737  -3.690
  232   HD22  LEU  36          1HD2      LEU  36  -6.498  -3.612  -5.213
  233   HD23  LEU  36          2HD2      LEU  36  -5.091  -2.829  -4.496
  234    H    ALA  37           H        ALA  37  -3.790  -4.796   0.238
  235    HA   ALA  37           HA       ALA  37  -5.056  -3.453   2.381
  236    HB1  ALA  37           1HB      ALA  37  -2.589  -5.202   2.517
  237    HB2  ALA  37           2HB      ALA  37  -4.238  -5.821   2.438
  238    HB3  ALA  37           3HB      ALA  37  -3.722  -4.863   3.825
  239    H    ALA  38           H        ALA  38  -1.916  -3.106   0.853
  240    HA   ALA  38           HA       ALA  38  -0.829  -1.362   2.864
  241    HB1  ALA  38           1HB      ALA  38   0.136  -1.512   0.018
  242    HB2  ALA  38           2HB      ALA  38   0.445  -2.825   1.154
  243    HB3  ALA  38           3HB      ALA  38   1.065  -1.208   1.486
  244    H    CYS  39           H        CYS  39  -2.481  -0.954  -0.225
  245    HA   CYS  39           HA       CYS  39  -2.096   1.875  -0.383
  246    HB2  CYS  39           2HB      CYS  39  -2.634   0.331  -2.316
  247    HB3  CYS  39           1HB      CYS  39  -4.286   0.261  -1.702
  248    HG   CYS  39           HG       CYS  39  -4.221   2.243  -3.383
  249    H    ARG  40           H        ARG  40  -4.870  -0.162   0.547
  250    HA   ARG  40           HA       ARG  40  -6.729   1.795   1.126
  251    HB2  ARG  40           2HB      ARG  40  -6.198  -0.870   2.439
  252    HB3  ARG  40           1HB      ARG  40  -7.572   0.145   2.882
  253    HG2  ARG  40           2HG      ARG  40  -8.517   0.007   0.709
  254    HG3  ARG  40           1HG      ARG  40  -7.020  -0.611   0.010
  255    HD2  ARG  40           2HD      ARG  40  -8.956  -2.288   0.499
  256    HD3  ARG  40           1HD      ARG  40  -7.311  -2.741   0.938
  257    HE   ARG  40           HE       ARG  40  -7.920  -2.603   3.183
  258   HH11  ARG  40          1HH2      ARG  40 -10.309  -1.174   1.129
  259   HH12  ARG  40          2HH2      ARG  40 -11.481  -0.987   2.389
  260   HH21  ARG  40          1HH1      ARG  40  -9.451  -2.361   4.843
  261   HH22  ARG  40          2HH1      ARG  40 -10.995  -1.659   4.493
  262    H    GLU  41           H        GLU  41  -3.962   0.756   3.030
  263    HA   GLU  41           HA       GLU  41  -4.616   1.996   5.468
  264    HB2  GLU  41           2HB      GLU  41  -1.995   1.282   4.162
  265    HB3  GLU  41           1HB      GLU  41  -2.055   2.073   5.738
  266    HG2  GLU  41           2HG      GLU  41  -3.203   0.261   6.735
  267    HG3  GLU  41           1HG      GLU  41  -3.662  -0.418   5.174
  268    H    GLU  42           H        GLU  42  -2.775   3.212   2.673
  269    HA   GLU  42           HA       GLU  42  -2.393   5.817   3.824
  270    HB2  GLU  42           2HB      GLU  42  -2.225   5.307   0.872
  271    HB3  GLU  42           1HB      GLU  42  -1.212   6.331   1.889
  272    HG2  GLU  42           2HG      GLU  42  -1.220   3.308   1.763
  273    HG3  GLU  42           1HG      GLU  42   0.090   4.392   1.301
  274    H    PHE  43           H        PHE  43  -4.515   4.485   1.297
  275    HA   PHE  43           HA       PHE  43  -5.811   6.768   0.462
  276    HB2  PHE  43           2HB      PHE  43  -6.132   4.369  -0.354
  277    HB3  PHE  43           1HB      PHE  43  -7.270   4.178   0.979
  278    HD1  PHE  43           1HD      PHE  43  -6.546   6.141  -2.094
  279    HD2  PHE  43           2HD      PHE  43  -9.461   5.128   0.896
  280    HE1  PHE  43           1HE      PHE  43  -8.310   7.254  -3.437
  281    HE2  PHE  43           2HE      PHE  43 -11.224   6.241  -0.448
  282    HZ   PHE  43           HZ       PHE  43 -10.648   7.304  -2.614
  283    H    HIS  44           H        HIS  44  -6.251   4.971   3.448
  284    HA   HIS  44           HA       HIS  44  -8.656   6.298   4.249
  285    HB2  HIS  44           2HB      HIS  44  -6.596   4.819   5.901
  286    HB3  HIS  44           1HB      HIS  44  -8.201   5.294   6.452
  287    HD2  HIS  44           2HD      HIS  44  -9.189   4.304   3.127
  288    HE1  HIS  44           1HE      HIS  44  -8.745   0.558   5.024
  289    HE2  HIS  44           2HE      HIS  44  -9.719   1.749   3.004
  290    H    ARG  45           H        ARG  45  -5.219   6.892   4.710
  291    HA   ARG  45           HA       ARG  45  -5.437   8.851   6.741
  292    HB2  ARG  45           2HB      ARG  45  -3.325   8.416   4.617
  293    HB3  ARG  45           1HB      ARG  45  -3.161   9.549   5.960
  294    HG2  ARG  45           2HG      ARG  45  -3.616   7.603   7.522
  295    HG3  ARG  45           1HG      ARG  45  -3.473   6.541   6.122
  296    HD2  ARG  45           2HD      ARG  45  -1.332   6.748   7.377
  297    HD3  ARG  45           1HD      ARG  45  -1.198   7.314   5.715
  298    HE   ARG  45           HE       ARG  45  -1.839   9.397   7.625
  299   HH11  ARG  45          1HH2      ARG  45   0.623   7.559   6.035
  300   HH12  ARG  45          2HH2      ARG  45   1.850   8.765   6.241
  301   HH21  ARG  45          1HH1      ARG  45  -0.235  10.983   7.899
  302   HH22  ARG  45          2HH1      ARG  45   1.364  10.702   7.297
  303    H    ARG  46           H        ARG  46  -5.865   8.975   3.278
  304    HA   ARG  46           HA       ARG  46  -5.626  11.803   2.991
  305    HB2  ARG  46           2HB      ARG  46  -7.348  10.137   1.183
  306    HB3  ARG  46           1HB      ARG  46  -6.288  11.487   0.781
  307    HG2  ARG  46           2HG      ARG  46  -5.410   8.715   1.638
  308    HG3  ARG  46           1HG      ARG  46  -5.275   9.397   0.019
  309    HD2  ARG  46           2HD      ARG  46  -3.833  11.218   0.980
  310    HD3  ARG  46           1HD      ARG  46  -3.859  10.361   2.519
  311    HE   ARG  46           HE       ARG  46  -2.986   8.438   0.852
  312   HH11  ARG  46          1HH2      ARG  46  -2.126  11.768   1.233
  313   HH12  ARG  46          2HH2      ARG  46  -0.481  11.543   0.741
  314   HH21  ARG  46          1HH1      ARG  46  -0.831   8.135   0.207
  315   HH22  ARG  46          2HH1      ARG  46   0.252   9.486   0.160
  316    H    LEU  47           H        LEU  47  -8.347   9.609   3.562
  317    HA   LEU  47           HA       LEU  47 -10.442  11.449   3.293
  318    HB2  LEU  47           2HB      LEU  47 -10.421   9.222   5.328
  319    HB3  LEU  47           1HB      LEU  47 -11.795   9.875   4.436
  320    HG   LEU  47           HG       LEU  47  -9.491   8.267   3.300
  321   HD11  LEU  47          1HD1      LEU  47 -11.460   7.143   4.535
  322   HD12  LEU  47          2HD1      LEU  47 -11.095   6.567   2.910
  323   HD13  LEU  47          3HD1      LEU  47 -12.449   7.667   3.171
  324   HD21  LEU  47          3HD2      LEU  47 -11.712   9.835   1.981
  325   HD22  LEU  47          1HD2      LEU  47 -10.949   8.467   1.173
  326   HD23  LEU  47          2HD2      LEU  47  -9.987   9.873   1.624
  327    H    LYS  48           H        LYS  48  -8.171  10.915   5.895
  328    HA   LYS  48           HA       LYS  48  -9.368  11.998   8.098
  329    HB2  LYS  48           2HB      LYS  48  -6.958  11.178   7.836
  330    HB3  LYS  48           1HB      LYS  48  -6.579  12.808   7.277
  331    HG2  LYS  48           2HG      LYS  48  -7.494  13.738   9.378
  332    HG3  LYS  48           1HG      LYS  48  -7.848  12.104   9.941
  333    HD2  LYS  48           2HD      LYS  48  -5.362  11.601   9.575
  334    HD3  LYS  48           1HD      LYS  48  -5.142  13.344   9.424
  335    HE2  LYS  48           2HE      LYS  48  -4.750  12.939  11.714
  336    HE3  LYS  48           1HE      LYS  48  -6.426  13.491  11.674
  337    HZ1  LYS  48           3HZ      LYS  48  -6.925  10.982  11.402
  338    HZ2  LYS  48           1HZ      LYS  48  -6.568  11.597  12.943
  339    HZ3  LYS  48           2HZ      LYS  48  -5.373  10.770  12.062
  340    H    VAL  49           H        VAL  49  -7.989  13.764   5.353
  341    HA   VAL  49           HA       VAL  49  -9.160  16.263   6.427
  342    HB   VAL  49           HB       VAL  49  -6.745  16.403   6.133
  343   HG11  VAL  49          1HG1      VAL  49  -5.676  15.984   4.015
  344   HG12  VAL  49          2HG1      VAL  49  -7.232  15.774   3.210
  345   HG13  VAL  49          3HG1      VAL  49  -6.674  14.576   4.380
  346   HG21  VAL  49          3HG2      VAL  49  -6.687  18.387   4.809
  347   HG22  VAL  49          1HG2      VAL  49  -8.318  18.322   5.478
  348   HG23  VAL  49          2HG2      VAL  49  -8.030  17.845   3.805
  349    H    TYR  50           H        TYR  50 -10.575  17.419   5.202
  350    HA   TYR  50           HA       TYR  50 -11.359  16.249   2.593
  351    HB2  TYR  50           2HB      TYR  50 -13.161  17.823   4.436
  352    HB3  TYR  50           1HB      TYR  50 -13.620  16.842   3.044
  353    HD1  TYR  50           1HD      TYR  50 -12.280  16.725   6.504
  354    HD2  TYR  50           2HD      TYR  50 -13.869  14.463   3.217
  355    HE1  TYR  50           1HE      TYR  50 -12.494  14.738   7.975
  356    HE2  TYR  50           2HE      TYR  50 -14.082  12.477   4.686
  357    HH   TYR  50           HH       TYR  50 -13.418  11.592   6.686
  358    H    HIS  51           H        HIS  51  -9.365  17.944   2.325
  359    HA   HIS  51           HA       HIS  51 -10.156  20.701   2.165
  360    HB2  HIS  51           2HB      HIS  51  -7.812  20.083   2.510
  361    HB3  HIS  51           1HB      HIS  51  -7.788  19.252   0.956
  362    HD2  HIS  51           2HD      HIS  51  -9.623  22.689   1.025
  363    HE1  HIS  51           1HE      HIS  51  -5.899  23.281  -0.872
  364    HE2  HIS  51           2HE      HIS  51  -8.138  24.351  -0.335
  Start of MODEL   16
    1    H1   GLY   9           H        GLY   9  10.878 -15.748   2.885
    2    HA2  GLY   9           2HA      GLY   9   8.369 -15.301   4.234
    3    HA3  GLY   9           1HA      GLY   9   9.634 -14.108   3.954
    4    H    THR  10           H        THR  10   8.995 -12.474   2.716
    5    HA   THR  10           HA       THR  10   7.634 -12.923   0.211
    6    HB   THR  10           HB       THR  10   5.760 -12.934   1.863
    7    HG1  THR  10           1HG      THR  10   4.884 -10.816   0.789
    8   HG21  THR  10          3HG2      THR  10   6.966 -11.314   3.419
    9   HG22  THR  10          1HG2      THR  10   5.253 -10.990   3.152
   10   HG23  THR  10          2HG2      THR  10   6.473 -10.032   2.313
   11    H    LYS  11           H        LYS  11   6.641 -10.263  -0.008
   12    HA   LYS  11           HA       LYS  11   8.978  -8.535   0.394
   13    HB2  LYS  11           2HB      LYS  11   7.800  -9.259  -2.290
   14    HB3  LYS  11           1HB      LYS  11   8.740  -7.788  -2.038
   15    HG2  LYS  11           2HG      LYS  11  10.634  -9.135  -1.211
   16    HG3  LYS  11           1HG      LYS  11   9.697 -10.608  -1.463
   17    HD2  LYS  11           2HD      LYS  11   9.465  -9.882  -3.902
   18    HD3  LYS  11           1HD      LYS  11  10.699  -8.669  -3.556
   19    HE2  LYS  11           2HE      LYS  11  12.276 -10.405  -2.886
   20    HE3  LYS  11           1HE      LYS  11  11.039 -11.646  -3.093
   21    HZ1  LYS  11           3HZ      LYS  11  11.040 -10.317  -5.466
   22    HZ2  LYS  11           1HZ      LYS  11  11.789 -11.809  -5.166
   23    HZ3  LYS  11           2HZ      LYS  11  12.687 -10.371  -5.056
   24    H    LYS  12           H        LYS  12   8.208  -6.770   1.343
   25    HA   LYS  12           HA       LYS  12   5.420  -5.996   1.014
   26    HB2  LYS  12           2HB      LYS  12   7.592  -4.644   2.630
   27    HB3  LYS  12           1HB      LYS  12   5.853  -4.390   2.770
   28    HG2  LYS  12           2HG      LYS  12   6.006  -5.949   4.435
   29    HG3  LYS  12           1HG      LYS  12   5.984  -7.099   3.099
   30    HD2  LYS  12           2HD      LYS  12   8.435  -7.140   3.057
   31    HD3  LYS  12           1HD      LYS  12   8.495  -5.926   4.337
   32    HE2  LYS  12           2HE      LYS  12   8.782  -7.970   5.486
   33    HE3  LYS  12           1HE      LYS  12   7.074  -7.593   5.716
   34    HZ1  LYS  12           3HZ      LYS  12   6.563  -9.023   3.817
   35    HZ2  LYS  12           1HZ      LYS  12   7.343  -9.881   5.054
   36    HZ3  LYS  12           2HZ      LYS  12   8.207  -9.420   3.666
   37    H    TYR  13           H        TYR  13   5.824  -3.189   1.400
   38    HA   TYR  13           HA       TYR  13   7.317  -2.222  -0.902
   39    HB2  TYR  13           2HB      TYR  13   4.364  -1.625  -0.808
   40    HB3  TYR  13           1HB      TYR  13   5.496  -1.384  -2.141
   41    HD1  TYR  13           1HD      TYR  13   6.243  -3.255  -3.526
   42    HD2  TYR  13           2HD      TYR  13   3.489  -3.848  -0.282
   43    HE1  TYR  13           1HE      TYR  13   5.705  -5.515  -4.394
   44    HE2  TYR  13           2HE      TYR  13   2.952  -6.108  -1.151
   45    HH   TYR  13           HH       TYR  13   3.219  -7.535  -2.847
   46    H    ASP  14           H        ASP  14   7.931  -0.124  -0.661
   47    HA   ASP  14           HA       ASP  14   7.171   1.184   1.857
   48    HB2  ASP  14           2HB      ASP  14   9.334   1.954  -0.112
   49    HB3  ASP  14           1HB      ASP  14   9.123   2.572   1.525
   50    H    LEU  15           H        LEU  15   5.423   2.442   1.704
   51    HA   LEU  15           HA       LEU  15   4.906   3.935  -0.771
   52    HB2  LEU  15           2HB      LEU  15   3.117   3.942   1.646
   53    HB3  LEU  15           1HB      LEU  15   2.689   4.142  -0.054
   54    HG   LEU  15           HG       LEU  15   3.640   1.584   1.272
   55   HD11  LEU  15          1HD1      LEU  15   1.334   1.993   1.799
   56   HD12  LEU  15          2HD1      LEU  15   1.345   0.819   0.482
   57   HD13  LEU  15          3HD1      LEU  15   0.985   2.515   0.151
   58   HD21  LEU  15          3HD2      LEU  15   4.525   1.645  -0.972
   59   HD22  LEU  15          1HD2      LEU  15   3.002   2.258  -1.614
   60   HD23  LEU  15          2HD2      LEU  15   3.100   0.606  -1.006
   61    H    SER  16           H        SER  16   7.134   4.760   0.769
   62    HA   SER  16           HA       SER  16   6.927   6.689   2.655
   63    HB2  SER  16           2HB      SER  16   9.013   5.961   1.393
   64    HB3  SER  16           1HB      SER  16   8.568   7.136   0.160
   65    HG   SER  16           HG       SER  16   9.158   8.692   1.453
   66    H    LYS  17           H        LYS  17   5.994   7.003  -0.726
   67    HA   LYS  17           HA       LYS  17   4.331   9.286  -0.092
   68    HB2  LYS  17           2HB      LYS  17   5.368  10.796  -1.731
   69    HB3  LYS  17           1HB      LYS  17   6.502  10.382  -0.447
   70    HG2  LYS  17           2HG      LYS  17   7.924   9.854  -2.146
   71    HG3  LYS  17           1HG      LYS  17   6.978   8.371  -2.269
   72    HD2  LYS  17           2HD      LYS  17   5.424   9.712  -3.837
   73    HD3  LYS  17           1HD      LYS  17   6.734  10.890  -3.918
   74    HE2  LYS  17           2HE      LYS  17   8.278   9.043  -4.619
   75    HE3  LYS  17           1HE      LYS  17   6.886   7.960  -4.679
   76    HZ1  LYS  17           3HZ      LYS  17   6.134   8.890  -6.560
   77    HZ2  LYS  17           1HZ      LYS  17   7.736   9.413  -6.749
   78    HZ3  LYS  17           2HZ      LYS  17   6.572  10.466  -6.098
   79    H    TRP  18           H        TRP  18   2.547   9.208  -1.306
   80    HA   TRP  18           HA       TRP  18   2.653   7.962  -3.971
   81    HB2  TRP  18           2HB      TRP  18   1.068   7.024  -1.611
   82    HB3  TRP  18           1HB      TRP  18   0.338   6.910  -3.211
   83    HD1  TRP  18           HD       TRP  18   3.661   5.930  -1.483
   84    HE1  TRP  18           1HE      TRP  18   4.484   3.721  -2.523
   85    HE3  TRP  18           3HE      TRP  18   0.053   5.227  -5.025
   86    HZ2  TRP  18           2HZ      TRP  18   3.711   1.894  -4.582
   87    HZ3  TRP  18           3HZ      TRP  18   0.119   3.246  -6.509
   88    HH2  TRP  18           HH       TRP  18   1.941   1.578  -6.293
   89    H    LYS  19           H        LYS  19   0.538   8.305  -5.141
   90    HA   LYS  19           HA       LYS  19  -0.528  10.991  -4.485
   91    HB2  LYS  19           2HB      LYS  19  -0.484   9.692  -7.212
   92    HB3  LYS  19           1HB      LYS  19  -0.810  11.382  -6.823
   93    HG2  LYS  19           2HG      LYS  19   1.830   9.957  -6.364
   94    HG3  LYS  19           1HG      LYS  19   1.493  11.083  -7.679
   95    HD2  LYS  19           2HD      LYS  19   0.827  12.751  -5.808
   96    HD3  LYS  19           1HD      LYS  19   1.682  11.654  -4.723
   97    HE2  LYS  19           2HE      LYS  19   3.715  11.864  -6.098
   98    HE3  LYS  19           1HE      LYS  19   2.866  12.951  -7.195
   99    HZ1  LYS  19           3HZ      LYS  19   4.234  13.653  -4.920
  100    HZ2  LYS  19           1HZ      LYS  19   2.598  13.793  -4.493
  101    HZ3  LYS  19           2HZ      LYS  19   3.201  14.648  -5.833
  102    H    TYR  20           H        TYR  20  -2.724  11.342  -4.562
  103    HA   TYR  20           HA       TYR  20  -4.462   9.317  -3.817
  104    HB2  TYR  20           2HB      TYR  20  -4.856  11.811  -3.656
  105    HB3  TYR  20           1HB      TYR  20  -5.290  11.777  -5.365
  106    HD1  TYR  20           2HD      TYR  20  -6.241  10.658  -1.978
  107    HD2  TYR  20           1HD      TYR  20  -7.340  10.719  -6.131
  108    HE1  TYR  20           2HE      TYR  20  -8.526   9.900  -1.385
  109    HE2  TYR  20           1HE      TYR  20  -9.625   9.961  -5.537
  110    HH   TYR  20           HH       TYR  20 -10.749   9.894  -2.275
  111    H    ALA  21           H        ALA  21  -3.466  10.327  -7.013
  112    HA   ALA  21           HA       ALA  21  -5.526   8.891  -8.416
  113    HB1  ALA  21           1HB      ALA  21  -4.314  10.861  -9.365
  114    HB2  ALA  21           2HB      ALA  21  -4.280   9.446 -10.416
  115    HB3  ALA  21           3HB      ALA  21  -2.860   9.869  -9.460
  116    H    GLU  22           H        GLU  22  -2.135   8.287  -7.576
  117    HA   GLU  22           HA       GLU  22  -1.888   5.832  -8.974
  118    HB2  GLU  22           2HB      GLU  22  -0.395   6.981  -6.611
  119    HB3  GLU  22           1HB      GLU  22   0.047   5.460  -7.387
  120    HG2  GLU  22           2HG      GLU  22  -0.246   8.052  -8.919
  121    HG3  GLU  22           1HG      GLU  22   1.287   7.518  -8.231
  122    H    LEU  23           H        LEU  23  -2.627   6.574  -5.572
  123    HA   LEU  23           HA       LEU  23  -2.836   3.952  -4.625
  124    HB2  LEU  23           2HB      LEU  23  -4.435   6.372  -3.756
  125    HB3  LEU  23           1HB      LEU  23  -4.202   4.897  -2.819
  126    HG   LEU  23           HG       LEU  23  -1.888   6.579  -3.802
  127   HD11  LEU  23          1HD1      LEU  23  -3.086   8.070  -2.389
  128   HD12  LEU  23          2HD1      LEU  23  -1.849   7.359  -1.352
  129   HD13  LEU  23          3HD1      LEU  23  -3.512   6.782  -1.261
  130   HD21  LEU  23          3HD2      LEU  23  -2.246   4.335  -1.806
  131   HD22  LEU  23          1HD2      LEU  23  -0.845   5.403  -1.748
  132   HD23  LEU  23          2HD2      LEU  23  -1.138   4.414  -3.176
  133    H    ARG  24           H        ARG  24  -5.391   6.079  -5.916
  134    HA   ARG  24           HA       ARG  24  -7.435   4.097  -5.745
  135    HB2  ARG  24           2HB      ARG  24  -7.766   6.615  -5.862
  136    HB3  ARG  24           1HB      ARG  24  -7.413   6.493  -7.584
  137    HG2  ARG  24           2HG      ARG  24  -9.724   6.276  -7.624
  138    HG3  ARG  24           1HG      ARG  24  -9.253   4.582  -7.502
  139    HD2  ARG  24           2HD      ARG  24  -9.565   4.648  -5.070
  140    HD3  ARG  24           1HD      ARG  24  -9.965   6.361  -5.150
  141    HE   ARG  24           HE       ARG  24 -11.786   5.232  -6.825
  142   HH11  ARG  24          1HH2      ARG  24 -10.730   4.583  -3.594
  143   HH12  ARG  24          2HH2      ARG  24 -12.262   3.965  -3.070
  144   HH21  ARG  24          1HH1      ARG  24 -13.796   4.421  -6.146
  145   HH22  ARG  24          2HH1      ARG  24 -13.997   3.873  -4.516
  146    H    ASP  25           H        ASP  25  -5.306   5.214  -8.349
  147    HA   ASP  25           HA       ASP  25  -6.465   3.714 -10.437
  148    HB2  ASP  25           2HB      ASP  25  -4.910   5.522 -10.898
  149    HB3  ASP  25           1HB      ASP  25  -3.617   4.662 -10.060
  150    H    THR  26           H        THR  26  -3.691   2.982  -8.321
  151    HA   THR  26           HA       THR  26  -2.990   0.506  -9.365
  152    HB   THR  26           HB       THR  26  -2.967   1.193  -6.422
  153    HG1  THR  26           1HG      THR  26  -1.715   2.755  -7.004
  154   HG21  THR  26          3HG2      THR  26  -1.019  -0.269  -6.381
  155   HG22  THR  26          1HG2      THR  26  -1.106  -0.482  -8.129
  156   HG23  THR  26          2HG2      THR  26  -2.377  -1.136  -7.097
  157    H    ILE  27           H        ILE  27  -5.402   1.260  -6.861
  158    HA   ILE  27           HA       ILE  27  -6.164  -1.437  -6.385
  159    HB   ILE  27           HB       ILE  27  -7.686   1.141  -5.934
  160   HG12  ILE  27          2HG1      ILE  27  -6.196  -0.563  -3.926
  161   HG13  ILE  27          1HG1      ILE  27  -5.423   0.775  -4.778
  162   HG21  ILE  27          1HG2      ILE  27  -8.835  -0.374  -4.184
  163   HG22  ILE  27          2HG2      ILE  27  -8.183  -1.724  -5.115
  164   HG23  ILE  27          3HG2      ILE  27  -9.303  -0.590  -5.871
  165   HD11  ILE  27          3HD1      ILE  27  -6.303   1.522  -2.599
  166   HD12  ILE  27          1HD1      ILE  27  -7.917   0.980  -3.060
  167   HD13  ILE  27          2HD1      ILE  27  -7.156   2.316  -3.924
  168    H    ASN  28           H        ASN  28  -7.146   0.986  -8.717
  169    HA   ASN  28           HA       ASN  28  -9.338  -0.711  -9.689
  170    HB2  ASN  28           2HB      ASN  28  -8.464   2.112 -10.308
  171    HB3  ASN  28           1HB      ASN  28  -9.692   1.272 -11.255
  172   HD21  ASN  28          1HD2      ASN  28  -8.935   2.230  -7.870
  173   HD22  ASN  28          2HD2      ASN  28 -10.558   2.352  -7.388
  174    H    THR  29           H        THR  29  -6.416  -1.353  -9.985
  175    HA   THR  29           HA       THR  29  -6.521  -1.975 -12.838
  176    HB   THR  29           HB       THR  29  -4.118  -1.200 -13.089
  177    HG1  THR  29           1HG      THR  29  -3.230  -0.131 -11.503
  178   HG21  THR  29          3HG2      THR  29  -6.123   0.026 -13.974
  179   HG22  THR  29          1HG2      THR  29  -4.762   1.080 -13.588
  180   HG23  THR  29          2HG2      THR  29  -6.136   0.977 -12.487
  181    H    SER  30           H        SER  30  -4.387  -2.102  -9.975
  182    HA   SER  30           HA       SER  30  -3.423  -4.737 -10.758
  183    HB2  SER  30           2HB      SER  30  -2.077  -2.800  -9.618
  184    HB3  SER  30           1HB      SER  30  -2.791  -3.425  -8.132
  185    HG   SER  30           HG       SER  30  -0.904  -4.535  -9.836
  186    H    CYS  31           H        CYS  31  -3.185  -6.264  -8.694
  187    HA   CYS  31           HA       CYS  31  -5.508  -6.279  -6.968
  188    HB2  CYS  31           2HB      CYS  31  -6.258  -7.255  -9.211
  189    HB3  CYS  31           1HB      CYS  31  -5.188  -8.611  -8.855
  190    HG   CYS  31           HG       CYS  31  -6.742  -9.400  -7.059
  191    H    ASP  32           H        ASP  32  -4.840  -7.025  -5.070
  192    HA   ASP  32           HA       ASP  32  -3.370  -9.419  -4.718
  193    HB2  ASP  32           2HB      ASP  32  -1.655  -7.559  -5.567
  194    HB3  ASP  32           1HB      ASP  32  -1.686  -7.103  -3.867
  195    H    ILE  33           H        ILE  33  -3.095  -9.956  -2.498
  196    HA   ILE  33           HA       ILE  33  -4.983  -8.607  -0.762
  197    HB   ILE  33           HB       ILE  33  -3.153 -10.953  -0.200
  198   HG12  ILE  33          2HG1      ILE  33  -6.101 -10.970  -0.902
  199   HG13  ILE  33          1HG1      ILE  33  -4.830 -11.217  -2.098
  200   HG21  ILE  33          1HG2      ILE  33  -5.041 -11.365   1.531
  201   HG22  ILE  33          2HG2      ILE  33  -5.449  -9.668   1.277
  202   HG23  ILE  33          3HG2      ILE  33  -3.856 -10.108   1.891
  203   HD11  ILE  33          3HD1      ILE  33  -3.983 -13.143  -0.818
  204   HD12  ILE  33          1HD1      ILE  33  -5.679 -13.375  -1.243
  205   HD13  ILE  33          2HD1      ILE  33  -5.239 -12.893   0.396
  206    H    GLU  34           H        GLU  34  -1.785  -8.133  -1.545
  207    HA   GLU  34           HA       GLU  34  -1.042  -7.151   1.135
  208    HB2  GLU  34           2HB      GLU  34   0.731  -7.380  -1.300
  209    HB3  GLU  34           1HB      GLU  34   1.226  -7.178   0.380
  210    HG2  GLU  34           2HG      GLU  34   0.238  -9.385   0.925
  211    HG3  GLU  34           1HG      GLU  34  -0.204  -9.592  -0.769
  212    H    LEU  35           H        LEU  35  -0.601  -6.097  -2.254
  213    HA   LEU  35           HA       LEU  35  -0.039  -3.425  -1.718
  214    HB2  LEU  35           2HB      LEU  35  -1.209  -4.852  -4.085
  215    HB3  LEU  35           1HB      LEU  35  -1.112  -3.095  -4.089
  216    HG   LEU  35           HG       LEU  35   1.251  -4.910  -3.529
  217   HD11  LEU  35          1HD1      LEU  35   1.949  -4.547  -5.804
  218   HD12  LEU  35          2HD1      LEU  35   0.633  -3.408  -6.086
  219   HD13  LEU  35          3HD1      LEU  35   0.283  -5.122  -5.861
  220   HD21  LEU  35          3HD2      LEU  35   2.290  -2.563  -4.386
  221   HD22  LEU  35          1HD2      LEU  35   1.953  -2.885  -2.687
  222   HD23  LEU  35          2HD2      LEU  35   0.804  -1.961  -3.653
  223    H    LEU  36           H        LEU  36  -3.204  -4.869  -2.530
  224    HA   LEU  36           HA       LEU  36  -4.755  -2.569  -2.357
  225    HB2  LEU  36           2HB      LEU  36  -5.486  -5.396  -1.555
  226    HB3  LEU  36           1HB      LEU  36  -6.641  -4.091  -1.818
  227    HG   LEU  36           HG       LEU  36  -4.698  -5.154  -3.893
  228   HD11  LEU  36          1HD1      LEU  36  -6.674  -6.632  -3.194
  229   HD12  LEU  36          2HD1      LEU  36  -6.569  -6.229  -4.907
  230   HD13  LEU  36          3HD1      LEU  36  -7.714  -5.379  -3.872
  231   HD21  LEU  36          3HD2      LEU  36  -6.627  -2.859  -3.804
  232   HD22  LEU  36          1HD2      LEU  36  -6.456  -3.742  -5.321
  233   HD23  LEU  36          2HD2      LEU  36  -5.052  -2.970  -4.589
  234    H    ALA  37           H        ALA  37  -3.917  -4.865   0.233
  235    HA   ALA  37           HA       ALA  37  -5.287  -3.489   2.294
  236    HB1  ALA  37           1HB      ALA  37  -2.812  -5.183   2.651
  237    HB2  ALA  37           2HB      ALA  37  -4.408  -5.873   2.363
  238    HB3  ALA  37           3HB      ALA  37  -4.113  -4.909   3.809
  239    H    ALA  38           H        ALA  38  -2.082  -3.169   0.904
  240    HA   ALA  38           HA       ALA  38  -1.086  -1.388   2.931
  241    HB1  ALA  38           1HB      ALA  38   0.860  -1.222   1.602
  242    HB2  ALA  38           2HB      ALA  38  -0.013  -1.628   0.124
  243    HB3  ALA  38           3HB      ALA  38   0.287  -2.869   1.341
  244    H    CYS  39           H        CYS  39  -2.669  -1.049  -0.190
  245    HA   CYS  39           HA       CYS  39  -2.247   1.768  -0.440
  246    HB2  CYS  39           2HB      CYS  39  -2.838   0.075  -2.285
  247    HB3  CYS  39           1HB      CYS  39  -4.501   0.235  -1.722
  248    HG   CYS  39           HG       CYS  39  -4.084   2.055  -3.573
  249    H    ARG  40           H        ARG  40  -5.064  -0.197   0.519
  250    HA   ARG  40           HA       ARG  40  -6.877   1.831   1.026
  251    HB2  ARG  40           2HB      ARG  40  -6.470  -0.836   2.380
  252    HB3  ARG  40           1HB      ARG  40  -7.825   0.228   2.762
  253    HG2  ARG  40           2HG      ARG  40  -8.597   0.168   0.464
  254    HG3  ARG  40           1HG      ARG  40  -7.165  -0.732  -0.035
  255    HD2  ARG  40           2HD      ARG  40  -8.935  -2.333   0.198
  256    HD3  ARG  40           1HD      ARG  40  -7.869  -2.550   1.584
  257    HE   ARG  40           HE       ARG  40  -9.755  -0.776   2.475
  258   HH11  ARG  40          1HH2      ARG  40  -9.801  -3.886   0.955
  259   HH12  ARG  40          2HH2      ARG  40 -11.273  -4.388   1.717
  260   HH21  ARG  40          1HH1      ARG  40 -11.687  -1.429   3.476
  261   HH22  ARG  40          2HH1      ARG  40 -12.340  -2.997   3.143
  262    H    GLU  41           H        GLU  41  -4.170   0.740   2.982
  263    HA   GLU  41           HA       GLU  41  -4.842   1.993   5.407
  264    HB2  GLU  41           2HB      GLU  41  -2.213   1.237   4.142
  265    HB3  GLU  41           1HB      GLU  41  -2.280   2.041   5.710
  266    HG2  GLU  41           2HG      GLU  41  -3.904  -0.439   5.133
  267    HG3  GLU  41           1HG      GLU  41  -2.245  -0.536   5.717
  268    H    GLU  42           H        GLU  42  -2.799   3.173   2.724
  269    HA   GLU  42           HA       GLU  42  -2.435   5.767   3.850
  270    HB2  GLU  42           2HB      GLU  42  -2.268   5.200   0.900
  271    HB3  GLU  42           1HB      GLU  42  -1.294   6.302   1.875
  272    HG2  GLU  42           2HG      GLU  42  -1.204   3.276   1.896
  273    HG3  GLU  42           1HG      GLU  42   0.068   4.376   1.368
  274    H    PHE  43           H        PHE  43  -4.658   4.426   1.439
  275    HA   PHE  43           HA       PHE  43  -5.900   6.705   0.516
  276    HB2  PHE  43           2HB      PHE  43  -6.342   4.278  -0.142
  277    HB3  PHE  43           1HB      PHE  43  -7.430   4.209   1.247
  278    HD1  PHE  43           1HD      PHE  43  -6.793   5.863  -2.011
  279    HD2  PHE  43           2HD      PHE  43  -9.557   5.329   1.233
  280    HE1  PHE  43           1HE      PHE  43  -8.573   6.955  -3.348
  281    HE2  PHE  43           2HE      PHE  43 -11.337   6.424  -0.104
  282    HZ   PHE  43           HZ       PHE  43 -10.845   7.235  -2.394
  283    H    HIS  44           H        HIS  44  -6.323   5.064   3.596
  284    HA   HIS  44           HA       HIS  44  -8.639   6.477   4.440
  285    HB2  HIS  44           2HB      HIS  44  -7.523   4.305   5.385
  286    HB3  HIS  44           1HB      HIS  44  -6.588   5.430   6.369
  287    HD2  HIS  44           2HD      HIS  44  -9.664   7.338   6.331
  288    HE1  HIS  44           1HE      HIS  44 -10.541   4.352   9.182
  289    HE2  HIS  44           2HE      HIS  44 -11.260   6.606   8.263
  290    H    ARG  45           H        ARG  45  -5.172   7.079   4.784
  291    HA   ARG  45           HA       ARG  45  -5.332   9.214   6.622
  292    HB2  ARG  45           2HB      ARG  45  -3.289   8.508   4.512
  293    HB3  ARG  45           1HB      ARG  45  -3.085   9.856   5.630
  294    HG2  ARG  45           2HG      ARG  45  -3.308   8.317   7.542
  295    HG3  ARG  45           1HG      ARG  45  -3.521   6.964   6.430
  296    HD2  ARG  45           2HD      ARG  45  -1.298   7.166   5.598
  297    HD3  ARG  45           1HD      ARG  45  -1.087   8.751   6.335
  298    HE   ARG  45           HE       ARG  45  -1.577   7.042   8.445
  299   HH11  ARG  45          1HH2      ARG  45   0.675   7.256   5.827
  300   HH12  ARG  45          2HH2      ARG  45   1.965   6.492   6.693
  301   HH21  ARG  45          1HH1      ARG  45   0.110   6.039   9.587
  302   HH22  ARG  45          2HH1      ARG  45   1.646   5.802   8.821
  303    H    ARG  46           H        ARG  46  -5.860   9.052   3.177
  304    HA   ARG  46           HA       ARG  46  -5.613  11.843   2.646
  305    HB2  ARG  46           2HB      ARG  46  -7.377  10.026   1.032
  306    HB3  ARG  46           1HB      ARG  46  -6.347  11.349   0.488
  307    HG2  ARG  46           2HG      ARG  46  -5.403   8.674   1.556
  308    HG3  ARG  46           1HG      ARG  46  -5.329   9.208  -0.120
  309    HD2  ARG  46           2HD      ARG  46  -3.889  11.130   0.639
  310    HD3  ARG  46           1HD      ARG  46  -3.847  10.396   2.239
  311    HE   ARG  46           HE       ARG  46  -2.995   8.359   0.712
  312   HH11  ARG  46          1HH2      ARG  46  -2.192  11.726   0.751
  313   HH12  ARG  46          2HH2      ARG  46  -0.566  11.486   0.206
  314   HH21  ARG  46          1HH1      ARG  46  -0.863   8.038  -0.001
  315   HH22  ARG  46          2HH1      ARG  46   0.186   9.398  -0.220
  316    H    LEU  47           H        LEU  47  -8.334   9.743   3.500
  317    HA   LEU  47           HA       LEU  47 -10.461  11.466   3.074
  318    HB2  LEU  47           2HB      LEU  47  -9.935   9.230   4.980
  319    HB3  LEU  47           1HB      LEU  47 -11.331  10.258   5.300
  320    HG   LEU  47           HG       LEU  47 -12.121   9.865   2.972
  321   HD11  LEU  47          1HD1      LEU  47  -9.918   9.402   1.957
  322   HD12  LEU  47          2HD1      LEU  47 -11.041   8.078   1.651
  323   HD13  LEU  47          3HD1      LEU  47  -9.801   7.913   2.893
  324   HD21  LEU  47          3HD2      LEU  47 -11.572   7.221   4.334
  325   HD22  LEU  47          1HD2      LEU  47 -12.989   7.685   3.390
  326   HD23  LEU  47          2HD2      LEU  47 -12.722   8.387   4.986
  327    H    LYS  48           H        LYS  48  -8.550  11.131   6.069
  328    HA   LYS  48           HA       LYS  48  -9.774  13.493   7.220
  329    HB2  LYS  48           2HB      LYS  48  -7.470  11.778   8.175
  330    HB3  LYS  48           1HB      LYS  48  -8.238  13.065   9.106
  331    HG2  LYS  48           2HG      LYS  48 -10.349  11.893   9.119
  332    HG3  LYS  48           1HG      LYS  48  -9.738  10.679   7.995
  333    HD2  LYS  48           2HD      LYS  48  -8.211   9.808   9.624
  334    HD3  LYS  48           1HD      LYS  48  -8.499  11.168  10.710
  335    HE2  LYS  48           2HE      LYS  48 -10.697  10.431  11.227
  336    HE3  LYS  48           1HE      LYS  48 -10.728   9.313   9.862
  337    HZ1  LYS  48           3HZ      LYS  48  -9.887   7.746  11.153
  338    HZ2  LYS  48           1HZ      LYS  48  -9.903   8.807  12.476
  339    HZ3  LYS  48           2HZ      LYS  48  -8.524   8.704  11.488
  340    H    VAL  49           H        VAL  49  -9.203  15.432   6.475
  341    HA   VAL  49           HA       VAL  49  -6.328  16.004   6.098
  342    HB   VAL  49           HB       VAL  49  -7.344  17.696   4.323
  343   HG11  VAL  49          1HG1      VAL  49  -6.884  14.732   3.891
  344   HG12  VAL  49          2HG1      VAL  49  -5.694  16.025   3.743
  345   HG13  VAL  49          3HG1      VAL  49  -7.014  15.906   2.579
  346   HG21  VAL  49          3HG2      VAL  49  -9.298  16.886   3.209
  347   HG22  VAL  49          1HG2      VAL  49  -9.690  16.889   4.929
  348   HG23  VAL  49          2HG2      VAL  49  -9.274  15.377   4.120
  349    H    TYR  50           H        TYR  50  -5.690  18.139   6.590
  350    HA   TYR  50           HA       TYR  50  -7.368  19.422   8.601
  351    HB2  TYR  50           2HB      TYR  50  -4.631  20.298   7.673
  352    HB3  TYR  50           1HB      TYR  50  -5.424  20.651   9.208
  353    HD1  TYR  50           2HD      TYR  50  -3.995  17.900   7.140
  354    HD2  TYR  50           1HD      TYR  50  -5.274  19.150  11.046
  355    HE1  TYR  50           2HE      TYR  50  -3.019  15.841   8.120
  356    HE2  TYR  50           1HE      TYR  50  -4.296  17.091  12.025
  357    HH   TYR  50           HH       TYR  50  -3.168  15.228  11.633
  358    H    HIS  51           H        HIS  51  -8.684  19.694   6.298
  359    HA   HIS  51           HA       HIS  51  -8.119  21.721   4.524
  360    HB2  HIS  51           2HB      HIS  51 -10.145  20.196   4.538
  361    HB3  HIS  51           1HB      HIS  51 -10.861  21.292   5.721
  362    HD2  HIS  51           2HD      HIS  51 -11.106  20.915   2.059
  363    HE1  HIS  51           1HE      HIS  51 -11.150  25.100   2.604
  364    HE2  HIS  51           2HE      HIS  51 -11.605  23.226   0.952
  Start of MODEL   17
    1    H1   GLY   9           H        GLY   9  10.510 -13.112  -2.777
    2    HA2  GLY   9           2HA      GLY   9   7.893 -13.797  -2.164
    3    HA3  GLY   9           1HA      GLY   9   8.702 -13.550  -0.620
    4    H    THR  10           H        THR  10   7.114 -11.774  -0.420
    5    HA   THR  10           HA       THR  10   8.289  -9.274  -1.378
    6    HB   THR  10           HB       THR  10   5.919  -8.481  -1.983
    7    HG1  THR  10           1HG      THR  10   5.316 -11.064  -2.694
    8   HG21  THR  10          3HG2      THR  10   7.735  -8.924  -3.627
    9   HG22  THR  10          1HG2      THR  10   6.141  -9.318  -4.268
   10   HG23  THR  10          2HG2      THR  10   7.212 -10.606  -3.716
   11    H    LYS  11           H        LYS  11   8.794  -8.657   0.688
   12    HA   LYS  11           HA       LYS  11   6.809  -8.799   2.806
   13    HB2  LYS  11           2HB      LYS  11   9.531  -8.931   2.818
   14    HB3  LYS  11           1HB      LYS  11   9.295  -7.238   3.239
   15    HG2  LYS  11           2HG      LYS  11   9.224  -8.243   5.344
   16    HG3  LYS  11           1HG      LYS  11   7.512  -8.205   4.929
   17    HD2  LYS  11           2HD      LYS  11   7.655 -10.525   4.100
   18    HD3  LYS  11           1HD      LYS  11   9.370 -10.566   4.508
   19    HE2  LYS  11           2HE      LYS  11   8.787 -10.113   6.885
   20    HE3  LYS  11           1HE      LYS  11   7.078 -10.179   6.455
   21    HZ1  LYS  11           3HZ      LYS  11   7.120 -12.383   6.465
   22    HZ2  LYS  11           1HZ      LYS  11   8.668 -12.299   7.155
   23    HZ3  LYS  11           2HZ      LYS  11   8.497 -12.443   5.470
   24    H    LYS  12           H        LYS  12   5.155  -7.413   2.193
   25    HA   LYS  12           HA       LYS  12   4.084  -5.420   1.715
   26    HB2  LYS  12           2HB      LYS  12   6.091  -4.477   3.777
   27    HB3  LYS  12           1HB      LYS  12   4.608  -3.638   3.327
   28    HG2  LYS  12           2HG      LYS  12   3.533  -4.841   4.912
   29    HG3  LYS  12           1HG      LYS  12   3.790  -6.270   3.914
   30    HD2  LYS  12           2HD      LYS  12   4.740  -6.874   5.982
   31    HD3  LYS  12           1HD      LYS  12   6.135  -6.368   5.030
   32    HE2  LYS  12           2HE      LYS  12   6.035  -4.129   6.057
   33    HE3  LYS  12           1HE      LYS  12   4.626  -4.621   6.998
   34    HZ1  LYS  12           3HZ      LYS  12   6.345  -4.983   8.460
   35    HZ2  LYS  12           1HZ      LYS  12   7.423  -5.494   7.254
   36    HZ3  LYS  12           2HZ      LYS  12   6.171  -6.522   7.764
   37    H    TYR  13           H        TYR  13   5.009  -2.776   1.801
   38    HA   TYR  13           HA       TYR  13   7.285  -2.572  -0.010
   39    HB2  TYR  13           2HB      TYR  13   4.670  -1.372  -0.902
   40    HB3  TYR  13           1HB      TYR  13   6.137  -1.651  -1.843
   41    HD1  TYR  13           1HD      TYR  13   3.148  -3.216  -0.362
   42    HD2  TYR  13           2HD      TYR  13   6.696  -3.867  -2.695
   43    HE1  TYR  13           1HE      TYR  13   2.289  -5.437  -1.049
   44    HE2  TYR  13           2HE      TYR  13   5.836  -6.090  -3.382
   45    HH   TYR  13           HH       TYR  13   2.768  -7.005  -3.212
   46    H    ASP  14           H        ASP  14   7.831  -0.279  -0.460
   47    HA   ASP  14           HA       ASP  14   7.290   1.347   1.925
   48    HB2  ASP  14           2HB      ASP  14   9.646   0.852   1.052
   49    HB3  ASP  14           1HB      ASP  14   9.270   1.962  -0.264
   50    H    LEU  15           H        LEU  15   5.558   2.624   1.750
   51    HA   LEU  15           HA       LEU  15   5.007   3.952  -0.833
   52    HB2  LEU  15           2HB      LEU  15   3.114   3.886   1.508
   53    HB3  LEU  15           1HB      LEU  15   2.749   4.098  -0.203
   54    HG   LEU  15           HG       LEU  15   3.773   1.548   1.084
   55   HD11  LEU  15          1HD1      LEU  15   1.474   1.824   1.670
   56   HD12  LEU  15          2HD1      LEU  15   1.481   0.735   0.282
   57   HD13  LEU  15          3HD1      LEU  15   1.066   2.437   0.067
   58   HD21  LEU  15          3HD2      LEU  15   3.225   0.605  -1.204
   59   HD22  LEU  15          1HD2      LEU  15   4.608   1.696  -1.178
   60   HD23  LEU  15          2HD2      LEU  15   3.048   2.265  -1.773
   61    H    SER  16           H        SER  16   7.123   4.894   0.768
   62    HA   SER  16           HA       SER  16   6.797   6.809   2.636
   63    HB2  SER  16           2HB      SER  16   8.486   7.041   0.137
   64    HB3  SER  16           1HB      SER  16   8.654   8.071   1.558
   65    HG   SER  16           HG       SER  16   8.835   5.234   1.540
   66    H    LYS  17           H        LYS  17   5.973   7.147  -0.786
   67    HA   LYS  17           HA       LYS  17   4.152   9.316  -0.144
   68    HB2  LYS  17           2HB      LYS  17   5.172  10.791  -1.937
   69    HB3  LYS  17           1HB      LYS  17   6.096  10.665  -0.441
   70    HG2  LYS  17           2HG      LYS  17   6.854   8.536  -2.267
   71    HG3  LYS  17           1HG      LYS  17   7.016  10.103  -3.057
   72    HD2  LYS  17           2HD      LYS  17   8.328  10.919  -1.099
   73    HD3  LYS  17           1HD      LYS  17   8.234   9.305  -0.396
   74    HE2  LYS  17           2HE      LYS  17   9.704  10.202  -2.863
   75    HE3  LYS  17           1HE      LYS  17  10.302   9.255  -1.502
   76    HZ1  LYS  17           3HZ      LYS  17   8.786   7.457  -2.212
   77    HZ2  LYS  17           1HZ      LYS  17   9.983   7.814  -3.360
   78    HZ3  LYS  17           2HZ      LYS  17   8.393   8.365  -3.592
   79    H    TRP  18           H        TRP  18   2.398   9.160  -1.383
   80    HA   TRP  18           HA       TRP  18   2.604   7.949  -4.060
   81    HB2  TRP  18           2HB      TRP  18   1.016   6.943  -1.730
   82    HB3  TRP  18           1HB      TRP  18   0.300   6.828  -3.335
   83    HD1  TRP  18           HD       TRP  18   3.666   5.937  -1.632
   84    HE1  TRP  18           1HE      TRP  18   4.536   3.752  -2.682
   85    HE3  TRP  18           3HE      TRP  18   0.029   5.126  -5.120
   86    HZ2  TRP  18           2HZ      TRP  18   3.787   1.900  -4.729
   87    HZ3  TRP  18           3HZ      TRP  18   0.130   3.144  -6.605
   88    HH2  TRP  18           HH       TRP  18   2.003   1.530  -6.414
   89    H    LYS  19           H        LYS  19   0.508   8.248  -5.278
   90    HA   LYS  19           HA       LYS  19  -0.635  10.901  -4.622
   91    HB2  LYS  19           2HB      LYS  19  -0.201   9.549  -7.293
   92    HB3  LYS  19           1HB      LYS  19  -1.072  11.066  -7.077
   93    HG2  LYS  19           2HG      LYS  19   0.842  12.262  -6.789
   94    HG3  LYS  19           1HG      LYS  19   1.555  11.035  -5.743
   95    HD2  LYS  19           2HD      LYS  19   2.337   9.759  -7.589
   96    HD3  LYS  19           1HD      LYS  19   1.320  10.642  -8.730
   97    HE2  LYS  19           2HE      LYS  19   3.615  11.434  -8.940
   98    HE3  LYS  19           1HE      LYS  19   2.631  12.711  -8.226
   99    HZ1  LYS  19           3HZ      LYS  19   4.666  11.010  -6.972
  100    HZ2  LYS  19           1HZ      LYS  19   3.384  11.583  -6.018
  101    HZ3  LYS  19           2HZ      LYS  19   4.407  12.683  -6.814
  102    H    TYR  20           H        TYR  20  -2.843  11.220  -4.796
  103    HA   TYR  20           HA       TYR  20  -4.561   9.173  -4.063
  104    HB2  TYR  20           2HB      TYR  20  -5.176  11.519  -3.829
  105    HB3  TYR  20           1HB      TYR  20  -5.202  11.713  -5.581
  106    HD1  TYR  20           1HD      TYR  20  -6.941  10.606  -6.949
  107    HD2  TYR  20           2HD      TYR  20  -6.968  10.392  -2.659
  108    HE1  TYR  20           1HE      TYR  20  -9.295   9.827  -7.003
  109    HE2  TYR  20           2HE      TYR  20  -9.323   9.612  -2.713
  110    HH   TYR  20           HH       TYR  20 -11.245   9.768  -5.534
  111    H    ALA  21           H        ALA  21  -3.592  10.239  -7.270
  112    HA   ALA  21           HA       ALA  21  -5.524   8.702  -8.707
  113    HB1  ALA  21           1HB      ALA  21  -2.842   9.777  -9.610
  114    HB2  ALA  21           2HB      ALA  21  -4.378  10.638  -9.709
  115    HB3  ALA  21           3HB      ALA  21  -4.122   9.179 -10.666
  116    H    GLU  22           H        GLU  22  -2.138   8.175  -7.780
  117    HA   GLU  22           HA       GLU  22  -1.825   5.685  -9.091
  118    HB2  GLU  22           2HB      GLU  22  -0.412   6.901  -6.711
  119    HB3  GLU  22           1HB      GLU  22   0.078   5.382  -7.462
  120    HG2  GLU  22           2HG      GLU  22  -0.232   7.952  -9.028
  121    HG3  GLU  22           1HG      GLU  22   1.294   7.463  -8.294
  122    H    LEU  23           H        LEU  23  -2.750   6.525  -5.760
  123    HA   LEU  23           HA       LEU  23  -2.959   3.869  -4.805
  124    HB2  LEU  23           2HB      LEU  23  -4.452   6.331  -3.870
  125    HB3  LEU  23           1HB      LEU  23  -4.237   4.839  -2.958
  126    HG   LEU  23           HG       LEU  23  -1.892   6.450  -3.983
  127   HD11  LEU  23          1HD1      LEU  23  -3.024   7.985  -2.554
  128   HD12  LEU  23          2HD1      LEU  23  -1.776   7.248  -1.549
  129   HD13  LEU  23          3HD1      LEU  23  -3.452   6.716  -1.407
  130   HD21  LEU  23          3HD2      LEU  23  -2.289   4.245  -1.948
  131   HD22  LEU  23          1HD2      LEU  23  -0.840   5.248  -1.964
  132   HD23  LEU  23          2HD2      LEU  23  -1.233   4.247  -3.360
  133    H    ARG  24           H        ARG  24  -5.405   6.116  -6.091
  134    HA   ARG  24           HA       ARG  24  -7.565   4.264  -5.881
  135    HB2  ARG  24           2HB      ARG  24  -7.739   6.796  -6.050
  136    HB3  ARG  24           1HB      ARG  24  -7.396   6.616  -7.770
  137    HG2  ARG  24           2HG      ARG  24  -9.710   6.527  -7.827
  138    HG3  ARG  24           1HG      ARG  24  -9.353   4.814  -7.620
  139    HD2  ARG  24           2HD      ARG  24  -9.474   5.293  -5.082
  140    HD3  ARG  24           1HD      ARG  24 -10.252   6.805  -5.539
  141    HE   ARG  24           HE       ARG  24 -11.424   4.426  -6.728
  142   HH11  ARG  24          1HH2      ARG  24 -11.370   6.667  -4.091
  143   HH12  ARG  24          2HH2      ARG  24 -13.000   6.345  -3.604
  144   HH21  ARG  24          1HH1      ARG  24 -13.564   4.000  -6.093
  145   HH22  ARG  24          2HH1      ARG  24 -14.242   4.835  -4.737
  146    H    ASP  25           H        ASP  25  -5.238   5.063  -8.398
  147    HA   ASP  25           HA       ASP  25  -6.541   3.569 -10.467
  148    HB2  ASP  25           2HB      ASP  25  -5.012   5.368 -11.042
  149    HB3  ASP  25           1HB      ASP  25  -3.692   4.554 -10.206
  150    H    THR  26           H        THR  26  -3.733   2.943  -8.364
  151    HA   THR  26           HA       THR  26  -3.010   0.441  -9.326
  152    HB   THR  26           HB       THR  26  -2.932   1.487  -6.486
  153    HG1  THR  26           1HG      THR  26  -1.755   2.609  -8.170
  154   HG21  THR  26          3HG2      THR  26  -1.049  -0.248  -6.325
  155   HG22  THR  26          1HG2      THR  26  -1.729  -0.958  -7.788
  156   HG23  THR  26          2HG2      THR  26  -2.698  -0.872  -6.317
  157    H    ILE  27           H        ILE  27  -5.475   1.288  -6.921
  158    HA   ILE  27           HA       ILE  27  -6.199  -1.435  -6.372
  159    HB   ILE  27           HB       ILE  27  -7.672   1.158  -5.842
  160   HG12  ILE  27          2HG1      ILE  27  -6.118  -0.587  -3.914
  161   HG13  ILE  27          1HG1      ILE  27  -5.380   0.769  -4.767
  162   HG21  ILE  27          1HG2      ILE  27  -8.169  -1.706  -5.018
  163   HG22  ILE  27          2HG2      ILE  27  -9.300  -0.564  -5.744
  164   HG23  ILE  27          3HG2      ILE  27  -8.785  -0.351  -4.071
  165   HD11  ILE  27          3HD1      ILE  27  -6.835   2.346  -3.732
  166   HD12  ILE  27          1HD1      ILE  27  -6.314   1.274  -2.433
  167   HD13  ILE  27          2HD1      ILE  27  -7.915   1.080  -3.149
  168    H    ASN  28           H        ASN  28  -7.121   0.965  -8.718
  169    HA   ASN  28           HA       ASN  28  -9.428  -0.631  -9.599
  170    HB2  ASN  28           2HB      ASN  28  -8.450   2.141 -10.288
  171    HB3  ASN  28           1HB      ASN  28  -9.754   1.344 -11.167
  172   HD21  ASN  28          1HD2      ASN  28  -8.872   1.783  -7.682
  173   HD22  ASN  28          2HD2      ASN  28 -10.440   2.217  -7.200
  174    H    THR  29           H        THR  29  -6.428  -1.215  -9.982
  175    HA   THR  29           HA       THR  29  -6.683  -1.988 -12.796
  176    HB   THR  29           HB       THR  29  -4.355  -1.170 -13.258
  177    HG1  THR  29           1HG      THR  29  -4.201  -0.869 -10.766
  178   HG21  THR  29          3HG2      THR  29  -5.033   1.115 -13.681
  179   HG22  THR  29          1HG2      THR  29  -6.294   1.012 -12.452
  180   HG23  THR  29          2HG2      THR  29  -6.430   0.069 -13.936
  181    H    SER  30           H        SER  30  -4.481  -1.973  -9.987
  182    HA   SER  30           HA       SER  30  -3.418  -4.580 -10.725
  183    HB2  SER  30           2HB      SER  30  -2.185  -2.559  -9.572
  184    HB3  SER  30           1HB      SER  30  -2.856  -3.249  -8.098
  185    HG   SER  30           HG       SER  30  -0.849  -4.156  -9.728
  186    H    CYS  31           H        CYS  31  -3.177  -6.142  -8.736
  187    HA   CYS  31           HA       CYS  31  -5.466  -6.207  -6.965
  188    HB2  CYS  31           2HB      CYS  31  -6.259  -7.139  -9.209
  189    HB3  CYS  31           1HB      CYS  31  -5.167  -8.491  -8.913
  190    HG   CYS  31           HG       CYS  31  -6.871  -8.129  -6.478
  191    H    ASP  32           H        ASP  32  -4.756  -6.983  -5.097
  192    HA   ASP  32           HA       ASP  32  -3.271  -9.378  -4.820
  193    HB2  ASP  32           2HB      ASP  32  -1.571  -7.522  -5.674
  194    HB3  ASP  32           1HB      ASP  32  -1.585  -7.057  -3.976
  195    H    ILE  33           H        ILE  33  -2.921  -9.939  -2.609
  196    HA   ILE  33           HA       ILE  33  -4.797  -8.650  -0.816
  197    HB   ILE  33           HB       ILE  33  -2.911 -10.970  -0.325
  198   HG12  ILE  33          2HG1      ILE  33  -5.871 -11.046  -0.969
  199   HG13  ILE  33          1HG1      ILE  33  -4.621 -11.232  -2.200
  200   HG21  ILE  33          1HG2      ILE  33  -5.197  -9.741   1.214
  201   HG22  ILE  33          2HG2      ILE  33  -3.593 -10.190   1.794
  202   HG23  ILE  33          3HG2      ILE  33  -4.779 -11.441   1.423
  203   HD11  ILE  33          3HD1      ILE  33  -3.776 -13.219  -1.183
  204   HD12  ILE  33          1HD1      ILE  33  -5.530 -13.401  -1.199
  205   HD13  ILE  33          2HD1      ILE  33  -4.704 -12.943   0.291
  206    H    GLU  34           H        GLU  34  -1.644  -8.070  -1.669
  207    HA   GLU  34           HA       GLU  34  -0.875  -7.102   1.014
  208    HB2  GLU  34           2HB      GLU  34   0.912  -7.296  -1.408
  209    HB3  GLU  34           1HB      GLU  34   1.382  -7.166   0.285
  210    HG2  GLU  34           2HG      GLU  34   0.275  -9.387   0.692
  211    HG3  GLU  34           1HG      GLU  34   0.028  -9.524  -1.048
  212    H    LEU  35           H        LEU  35  -0.493  -6.071  -2.392
  213    HA   LEU  35           HA       LEU  35   0.081  -3.394  -1.882
  214    HB2  LEU  35           2HB      LEU  35  -1.173  -4.806  -4.223
  215    HB3  LEU  35           1HB      LEU  35  -1.000  -3.055  -4.226
  216    HG   LEU  35           HG       LEU  35   1.292  -4.972  -3.716
  217   HD11  LEU  35          1HD1      LEU  35   0.282  -5.149  -6.025
  218   HD12  LEU  35          2HD1      LEU  35   1.964  -4.619  -6.008
  219   HD13  LEU  35          3HD1      LEU  35   0.672  -3.445  -6.259
  220   HD21  LEU  35          3HD2      LEU  35   0.976  -2.001  -3.853
  221   HD22  LEU  35          1HD2      LEU  35   2.430  -2.683  -4.581
  222   HD23  LEU  35          2HD2      LEU  35   2.080  -2.969  -2.879
  223    H    LEU  36           H        LEU  36  -3.094  -4.868  -2.582
  224    HA   LEU  36           HA       LEU  36  -4.647  -2.565  -2.404
  225    HB2  LEU  36           2HB      LEU  36  -5.350  -5.389  -1.571
  226    HB3  LEU  36           1HB      LEU  36  -6.516  -4.088  -1.811
  227    HG   LEU  36           HG       LEU  36  -4.620  -5.151  -3.928
  228   HD11  LEU  36          1HD1      LEU  36  -6.507  -6.242  -4.892
  229   HD12  LEU  36          2HD1      LEU  36  -7.633  -5.392  -3.835
  230   HD13  LEU  36          3HD1      LEU  36  -6.571  -6.636  -3.175
  231   HD21  LEU  36          3HD2      LEU  36  -5.004  -2.966  -4.613
  232   HD22  LEU  36          1HD2      LEU  36  -6.567  -2.873  -3.803
  233   HD23  LEU  36          2HD2      LEU  36  -6.411  -3.755  -5.322
  234    H    ALA  37           H        ALA  37  -3.750  -4.843   0.183
  235    HA   ALA  37           HA       ALA  37  -5.079  -3.460   2.265
  236    HB1  ALA  37           1HB      ALA  37  -4.384  -5.753   2.588
  237    HB2  ALA  37           2HB      ALA  37  -3.535  -4.746   3.761
  238    HB3  ALA  37           3HB      ALA  37  -2.693  -5.322   2.322
  239    H    ALA  38           H        ALA  38  -1.901  -3.136   0.809
  240    HA   ALA  38           HA       ALA  38  -0.886  -1.314   2.791
  241    HB1  ALA  38           1HB      ALA  38   1.057  -1.223   1.489
  242    HB2  ALA  38           2HB      ALA  38   0.182  -1.530  -0.012
  243    HB3  ALA  38           3HB      ALA  38   0.434  -2.836   1.146
  244    H    CYS  39           H        CYS  39  -2.536  -1.050  -0.295
  245    HA   CYS  39           HA       CYS  39  -2.134   1.762  -0.627
  246    HB2  CYS  39           2HB      CYS  39  -2.725   0.097  -2.450
  247    HB3  CYS  39           1HB      CYS  39  -4.367   0.102  -1.805
  248    HG   CYS  39           HG       CYS  39  -4.515   2.019  -3.443
  249    H    ARG  40           H        ARG  40  -4.922  -0.190   0.438
  250    HA   ARG  40           HA       ARG  40  -6.744   1.818   0.944
  251    HB2  ARG  40           2HB      ARG  40  -6.234  -0.795   2.362
  252    HB3  ARG  40           1HB      ARG  40  -7.580   0.261   2.796
  253    HG2  ARG  40           2HG      ARG  40  -8.605   0.027   0.685
  254    HG3  ARG  40           1HG      ARG  40  -7.126  -0.568  -0.069
  255    HD2  ARG  40           2HD      ARG  40  -8.964  -2.300   0.475
  256    HD3  ARG  40           1HD      ARG  40  -7.312  -2.685   0.950
  257    HE   ARG  40           HE       ARG  40  -8.772  -1.337   3.033
  258   HH11  ARG  40          1HH2      ARG  40  -8.169  -4.358   1.455
  259   HH12  ARG  40          2HH2      ARG  40  -8.568  -5.319   2.838
  260   HH21  ARG  40          1HH1      ARG  40  -9.297  -2.592   4.853
  261   HH22  ARG  40          2HH1      ARG  40  -9.206  -4.319   4.763
  262    H    GLU  41           H        GLU  41  -3.920   0.906   2.808
  263    HA   GLU  41           HA       GLU  41  -4.569   2.265   5.206
  264    HB2  GLU  41           2HB      GLU  41  -1.983   1.376   3.947
  265    HB3  GLU  41           1HB      GLU  41  -1.991   2.306   5.446
  266    HG2  GLU  41           2HG      GLU  41  -3.435   0.628   6.506
  267    HG3  GLU  41           1HG      GLU  41  -3.489  -0.293   5.004
  268    H    GLU  42           H        GLU  42  -2.817   3.283   2.286
  269    HA   GLU  42           HA       GLU  42  -2.230   5.908   3.271
  270    HB2  GLU  42           2HB      GLU  42  -2.117   4.580   0.573
  271    HB3  GLU  42           1HB      GLU  42  -1.885   6.323   0.720
  272    HG2  GLU  42           2HG      GLU  42  -0.339   4.350   2.402
  273    HG3  GLU  42           1HG      GLU  42   0.231   4.881   0.823
  274    H    PHE  43           H        PHE  43  -4.766   4.517   1.234
  275    HA   PHE  43           HA       PHE  43  -6.024   6.846   0.378
  276    HB2  PHE  43           2HB      PHE  43  -6.530   4.427  -0.272
  277    HB3  PHE  43           1HB      PHE  43  -7.514   4.350   1.190
  278    HD1  PHE  43           2HD      PHE  43  -7.170   5.857  -2.150
  279    HD2  PHE  43           1HD      PHE  43  -9.561   5.666   1.411
  280    HE1  PHE  43           2HE      PHE  43  -9.033   6.980  -3.342
  281    HE2  PHE  43           1HE      PHE  43 -11.425   6.789   0.220
  282    HZ   PHE  43           HZ       PHE  43 -11.160   7.444  -2.158
  283    H    HIS  44           H        HIS  44  -6.467   5.027   3.393
  284    HA   HIS  44           HA       HIS  44  -8.613   6.532   4.421
  285    HB2  HIS  44           2HB      HIS  44  -6.446   4.928   5.782
  286    HB3  HIS  44           1HB      HIS  44  -7.795   5.660   6.651
  287    HD2  HIS  44           2HD      HIS  44  -8.795   4.261   3.192
  288    HE1  HIS  44           1HE      HIS  44  -9.972   1.391   6.056
  289    HE2  HIS  44           2HE      HIS  44 -10.154   2.070   3.616
  290    H    ARG  45           H        ARG  45  -5.113   7.004   4.624
  291    HA   ARG  45           HA       ARG  45  -5.085   9.033   6.566
  292    HB2  ARG  45           2HB      ARG  45  -3.229   8.459   4.253
  293    HB3  ARG  45           1HB      ARG  45  -2.909   9.702   5.464
  294    HG2  ARG  45           2HG      ARG  45  -3.050   7.992   7.247
  295    HG3  ARG  45           1HG      ARG  45  -3.333   6.751   6.025
  296    HD2  ARG  45           2HD      ARG  45  -1.162   7.006   5.103
  297    HD3  ARG  45           1HD      ARG  45  -0.901   8.539   5.933
  298    HE   ARG  45           HE       ARG  45  -1.221   6.802   7.991
  299   HH11  ARG  45          1HH2      ARG  45   0.685   6.779   5.104
  300   HH12  ARG  45          2HH2      ARG  45   1.973   5.849   5.795
  301   HH21  ARG  45          1HH1      ARG  45   0.462   5.582   8.906
  302   HH22  ARG  45          2HH1      ARG  45   1.847   5.171   7.949
  303    H    ARG  46           H        ARG  46  -5.877   9.118   3.164
  304    HA   ARG  46           HA       ARG  46  -5.628  11.938   2.819
  305    HB2  ARG  46           2HB      ARG  46  -7.527  10.236   1.226
  306    HB3  ARG  46           1HB      ARG  46  -6.559  11.612   0.698
  307    HG2  ARG  46           2HG      ARG  46  -5.536   8.859   1.444
  308    HG3  ARG  46           1HG      ARG  46  -5.547   9.578  -0.165
  309    HD2  ARG  46           2HD      ARG  46  -4.075  11.418   0.744
  310    HD3  ARG  46           1HD      ARG  46  -3.933  10.489   2.233
  311    HE   ARG  46           HE       ARG  46  -3.156   8.664   0.443
  312   HH11  ARG  46          1HH2      ARG  46  -2.407  12.030   0.752
  313   HH12  ARG  46          2HH2      ARG  46  -0.825  11.882   0.063
  314   HH21  ARG  46          1HH1      ARG  46  -1.079   8.464  -0.455
  315   HH22  ARG  46          2HH1      ARG  46  -0.073   9.865  -0.619
  316    H    LEU  47           H        LEU  47  -8.277   9.805   3.779
  317    HA   LEU  47           HA       LEU  47 -10.300  11.817   3.739
  318    HB2  LEU  47           2HB      LEU  47 -10.059   9.064   4.910
  319    HB3  LEU  47           1HB      LEU  47 -11.407  10.094   5.386
  320    HG   LEU  47           HG       LEU  47 -12.009  10.403   3.006
  321   HD11  LEU  47          1HD1      LEU  47 -10.871   8.816   1.367
  322   HD12  LEU  47          2HD1      LEU  47  -9.636   8.567   2.601
  323   HD13  LEU  47          3HD1      LEU  47  -9.887  10.173   1.917
  324   HD21  LEU  47          3HD2      LEU  47 -12.858   8.140   2.624
  325   HD22  LEU  47          1HD2      LEU  47 -12.974   8.525   4.341
  326   HD23  LEU  47          2HD2      LEU  47 -11.678   7.480   3.757
  327    H    LYS  48           H        LYS  48  -7.912  10.792   6.077
  328    HA   LYS  48           HA       LYS  48  -9.109  12.130   8.320
  329    HB2  LYS  48           2HB      LYS  48  -7.581  10.245   8.653
  330    HB3  LYS  48           1HB      LYS  48  -6.275  11.155   7.890
  331    HG2  LYS  48           2HG      LYS  48  -6.232  12.764   9.652
  332    HG3  LYS  48           1HG      LYS  48  -7.762  12.185  10.312
  333    HD2  LYS  48           2HD      LYS  48  -6.781  10.159  11.087
  334    HD3  LYS  48           1HD      LYS  48  -5.321  10.413  10.129
  335    HE2  LYS  48           2HE      LYS  48  -6.211  12.197  12.415
  336    HE3  LYS  48           1HE      LYS  48  -4.982  10.938  12.545
  337    HZ1  LYS  48           3HZ      LYS  48  -4.887  13.468  11.042
  338    HZ2  LYS  48           1HZ      LYS  48  -3.924  12.158  10.559
  339    HZ3  LYS  48           2HZ      LYS  48  -3.744  12.815  12.116
  340    H    VAL  49           H        VAL  49  -5.952  12.774   6.791
  341    HA   VAL  49           HA       VAL  49  -5.546  15.315   7.755
  342    HB   VAL  49           HB       VAL  49  -3.908  13.984   6.422
  343   HG11  VAL  49          1HG1      VAL  49  -5.272  15.091   3.969
  344   HG12  VAL  49          2HG1      VAL  49  -5.711  13.510   4.615
  345   HG13  VAL  49          3HG1      VAL  49  -4.059  13.815   4.075
  346   HG21  VAL  49          3HG2      VAL  49  -3.542  16.384   6.865
  347   HG22  VAL  49          1HG2      VAL  49  -4.462  16.796   5.418
  348   HG23  VAL  49          2HG2      VAL  49  -2.925  15.943   5.272
  349    H    TYR  50           H        TYR  50  -6.576  17.183   7.552
  350    HA   TYR  50           HA       TYR  50  -8.235  18.663   6.895
  351    HB2  TYR  50           2HB      TYR  50  -6.231  19.035   5.352
  352    HB3  TYR  50           1HB      TYR  50  -7.135  18.134   4.134
  353    HD1  TYR  50           1HD      TYR  50  -7.327  21.089   6.409
  354    HD2  TYR  50           2HD      TYR  50  -8.863  19.169   2.886
  355    HE1  TYR  50           1HE      TYR  50  -8.628  23.127   5.864
  356    HE2  TYR  50           2HE      TYR  50 -10.164  21.209   2.342
  357    HH   TYR  50           HH       TYR  50  -9.808  24.173   4.233
  358    H    HIS  51           H        HIS  51  -9.524  16.393   7.306
  359    HA   HIS  51           HA       HIS  51 -11.369  15.141   6.745
  360    HB2  HIS  51           2HB      HIS  51 -12.416  17.331   6.555
  361    HB3  HIS  51           1HB      HIS  51 -11.816  17.503   4.905
  362    HD2  HIS  51           2HD      HIS  51 -13.973  14.613   6.640
  363    HE1  HIS  51           1HE      HIS  51 -15.611  15.522   2.857
  364    HE2  HIS  51           2HE      HIS  51 -15.848  14.050   4.913
  Start of MODEL   18
    1    H1   GLY   9           H        GLY   9  11.261 -14.719   2.964
    2    HA2  GLY   9           2HA      GLY   9   8.952 -15.760   4.064
    3    HA3  GLY   9           1HA      GLY   9  10.122 -14.804   4.969
    4    H    THR  10           H        THR  10   9.921 -12.319   4.066
    5    HA   THR  10           HA       THR  10   7.112 -11.531   3.886
    6    HB   THR  10           HB       THR  10   7.526  -9.875   5.801
    7    HG1  THR  10           1HG      THR  10   9.862 -11.173   5.717
    8   HG21  THR  10          3HG2      THR  10   6.062 -11.889   5.944
    9   HG22  THR  10          1HG2      THR  10   6.845 -11.509   7.477
   10   HG23  THR  10          2HG2      THR  10   7.456 -12.829   6.477
   11    H    LYS  11           H        LYS  11   6.994 -10.016   2.370
   12    HA   LYS  11           HA       LYS  11   9.117  -7.986   2.182
   13    HB2  LYS  11           2HB      LYS  11   9.622  -9.758   0.522
   14    HB3  LYS  11           1HB      LYS  11   8.027  -9.523  -0.190
   15    HG2  LYS  11           2HG      LYS  11   9.582  -7.027   0.127
   16    HG3  LYS  11           1HG      LYS  11  10.301  -8.188  -0.987
   17    HD2  LYS  11           2HD      LYS  11   8.138  -8.344  -2.195
   18    HD3  LYS  11           1HD      LYS  11   7.459  -7.132  -1.108
   19    HE2  LYS  11           2HE      LYS  11   8.255  -6.142  -3.252
   20    HE3  LYS  11           1HE      LYS  11   9.105  -5.489  -1.851
   21    HZ1  LYS  11           3HZ      LYS  11  10.124  -7.756  -3.467
   22    HZ2  LYS  11           1HZ      LYS  11  10.958  -6.879  -2.278
   23    HZ3  LYS  11           2HZ      LYS  11  10.555  -6.139  -3.753
   24    H    LYS  12           H        LYS  12   8.055  -6.151   2.573
   25    HA   LYS  12           HA       LYS  12   5.320  -5.808   1.526
   26    HB2  LYS  12           2HB      LYS  12   6.816  -4.087   3.517
   27    HB3  LYS  12           1HB      LYS  12   5.101  -4.000   3.117
   28    HG2  LYS  12           2HG      LYS  12   4.919  -5.333   4.985
   29    HG3  LYS  12           1HG      LYS  12   5.231  -6.605   3.805
   30    HD2  LYS  12           2HD      LYS  12   6.828  -7.112   5.421
   31    HD3  LYS  12           1HD      LYS  12   7.766  -6.070   4.353
   32    HE2  LYS  12           2HE      LYS  12   8.132  -5.319   6.621
   33    HE3  LYS  12           1HE      LYS  12   7.122  -4.120   5.816
   34    HZ1  LYS  12           3HZ      LYS  12   5.439  -6.056   6.905
   35    HZ2  LYS  12           1HZ      LYS  12   5.598  -4.433   7.369
   36    HZ3  LYS  12           2HZ      LYS  12   6.551  -5.625   8.115
   37    H    TYR  13           H        TYR  13   5.410  -2.946   1.670
   38    HA   TYR  13           HA       TYR  13   7.380  -2.171  -0.369
   39    HB2  TYR  13           2HB      TYR  13   4.457  -1.518  -0.732
   40    HB3  TYR  13           1HB      TYR  13   5.769  -1.351  -1.899
   41    HD1  TYR  13           2HD      TYR  13   3.611  -3.772  -0.106
   42    HD2  TYR  13           1HD      TYR  13   6.555  -3.229  -3.186
   43    HE1  TYR  13           2HE      TYR  13   3.173  -6.070  -0.930
   44    HE2  TYR  13           1HE      TYR  13   6.117  -5.526  -4.011
   45    HH   TYR  13           HH       TYR  13   3.423  -7.356  -3.004
   46    H    ASP  14           H        ASP  14   7.845   0.033  -0.403
   47    HA   ASP  14           HA       ASP  14   6.985   1.492   1.997
   48    HB2  ASP  14           2HB      ASP  14   8.875   2.957   1.551
   49    HB3  ASP  14           1HB      ASP  14   9.410   1.278   1.516
   50    H    LEU  15           H        LEU  15   5.189   2.658   1.720
   51    HA   LEU  15           HA       LEU  15   4.761   4.056  -0.847
   52    HB2  LEU  15           2HB      LEU  15   2.688   3.808   1.318
   53    HB3  LEU  15           1HB      LEU  15   2.463   4.001  -0.421
   54    HG   LEU  15           HG       LEU  15   3.560   1.526   0.949
   55   HD11  LEU  15          1HD1      LEU  15   1.397   0.555  -0.025
   56   HD12  LEU  15          2HD1      LEU  15   0.876   2.224  -0.256
   57   HD13  LEU  15          3HD1      LEU  15   1.215   1.623   1.367
   58   HD21  LEU  15          3HD2      LEU  15   3.301   0.543  -1.351
   59   HD22  LEU  15          1HD2      LEU  15   4.539   1.794  -1.262
   60   HD23  LEU  15          2HD2      LEU  15   2.962   2.164  -1.956
   61    H    SER  16           H        SER  16   6.646   5.002   1.124
   62    HA   SER  16           HA       SER  16   5.915   6.882   2.930
   63    HB2  SER  16           2HB      SER  16   8.022   7.329   0.806
   64    HB3  SER  16           1HB      SER  16   7.936   8.120   2.376
   65    HG   SER  16           HG       SER  16   7.939   5.315   2.209
   66    H    LYS  17           H        LYS  17   5.855   7.282  -0.591
   67    HA   LYS  17           HA       LYS  17   3.954   9.497  -0.265
   68    HB2  LYS  17           2HB      LYS  17   6.548   9.655  -1.810
   69    HB3  LYS  17           1HB      LYS  17   5.208  10.770  -2.063
   70    HG2  LYS  17           2HG      LYS  17   6.552  10.300   0.617
   71    HG3  LYS  17           1HG      LYS  17   6.938  11.636  -0.466
   72    HD2  LYS  17           2HD      LYS  17   4.298  12.019  -0.366
   73    HD3  LYS  17           1HD      LYS  17   4.473  11.175   1.173
   74    HE2  LYS  17           2HE      LYS  17   6.201  12.795   1.866
   75    HE3  LYS  17           1HE      LYS  17   6.019  13.646   0.332
   76    HZ1  LYS  17           3HZ      LYS  17   3.751  14.142   0.869
   77    HZ2  LYS  17           1HZ      LYS  17   4.732  14.647   2.157
   78    HZ3  LYS  17           2HZ      LYS  17   3.828  13.215   2.290
   79    H    TRP  18           H        TRP  18   2.305   9.317  -1.644
   80    HA   TRP  18           HA       TRP  18   2.682   7.923  -4.203
   81    HB2  TRP  18           2HB      TRP  18   0.977   7.028  -1.926
   82    HB3  TRP  18           1HB      TRP  18   0.296   6.885  -3.545
   83    HD1  TRP  18           HD       TRP  18   3.580   5.948  -1.714
   84    HE1  TRP  18           1HE      TRP  18   4.431   3.721  -2.694
   85    HE3  TRP  18           3HE      TRP  18   0.055   5.167  -5.325
   86    HZ2  TRP  18           2HZ      TRP  18   3.711   1.854  -4.736
   87    HZ3  TRP  18           3HZ      TRP  18   0.158   3.157  -6.770
   88    HH2  TRP  18           HH       TRP  18   1.981   1.500  -6.480
   89    H    LYS  19           H        LYS  19   0.784   8.227  -5.649
   90    HA   LYS  19           HA       LYS  19  -0.330  10.933  -5.271
   91    HB2  LYS  19           2HB      LYS  19   0.144   9.212  -7.707
   92    HB3  LYS  19           1HB      LYS  19  -0.877  10.649  -7.762
   93    HG2  LYS  19           2HG      LYS  19   1.320  11.353  -8.414
   94    HG3  LYS  19           1HG      LYS  19   1.073  11.943  -6.772
   95    HD2  LYS  19           2HD      LYS  19   2.465  10.277  -5.837
   96    HD3  LYS  19           1HD      LYS  19   2.391   9.276  -7.287
   97    HE2  LYS  19           2HE      LYS  19   4.564  10.416  -7.143
   98    HE3  LYS  19           1HE      LYS  19   3.652  11.000  -8.535
   99    HZ1  LYS  19           3HZ      LYS  19   3.466  12.370  -5.930
  100    HZ2  LYS  19           1HZ      LYS  19   3.146  12.980  -7.480
  101    HZ3  LYS  19           2HZ      LYS  19   4.750  12.704  -6.993
  102    H    TYR  20           H        TYR  20  -2.509  11.332  -5.353
  103    HA   TYR  20           HA       TYR  20  -4.305   9.425  -4.421
  104    HB2  TYR  20           2HB      TYR  20  -4.679  11.884  -4.370
  105    HB3  TYR  20           1HB      TYR  20  -4.975  11.847  -6.108
  106    HD1  TYR  20           1HD      TYR  20  -6.206  10.665  -2.813
  107    HD2  TYR  20           2HD      TYR  20  -7.042  11.021  -7.011
  108    HE1  TYR  20           1HE      TYR  20  -8.562  10.013  -2.400
  109    HE2  TYR  20           2HE      TYR  20  -9.398  10.370  -6.597
  110    HH   TYR  20           HH       TYR  20 -10.646   9.032  -4.798
  111    H    ALA  21           H        ALA  21  -3.398  10.247  -7.714
  112    HA   ALA  21           HA       ALA  21  -5.487   8.729  -8.965
  113    HB1  ALA  21           1HB      ALA  21  -2.849   9.713 -10.076
  114    HB2  ALA  21           2HB      ALA  21  -4.379  10.589 -10.126
  115    HB3  ALA  21           3HB      ALA  21  -4.193   9.084 -11.027
  116    H    GLU  22           H        GLU  22  -2.022   8.169  -8.363
  117    HA   GLU  22           HA       GLU  22  -1.850   5.631  -9.556
  118    HB2  GLU  22           2HB      GLU  22  -0.299   6.867  -7.275
  119    HB3  GLU  22           1HB      GLU  22   0.119   5.319  -8.011
  120    HG2  GLU  22           2HG      GLU  22  -0.200   7.862  -9.616
  121    HG3  GLU  22           1HG      GLU  22   1.348   7.339  -8.952
  122    H    LEU  23           H        LEU  23  -2.729   6.608  -6.271
  123    HA   LEU  23           HA       LEU  23  -2.889   4.003  -5.169
  124    HB2  LEU  23           2HB      LEU  23  -4.325   6.551  -4.385
  125    HB3  LEU  23           1HB      LEU  23  -4.250   5.091  -3.400
  126    HG   LEU  23           HG       LEU  23  -1.735   6.419  -4.402
  127   HD11  LEU  23          1HD1      LEU  23  -1.718   7.423  -1.999
  128   HD12  LEU  23          2HD1      LEU  23  -3.463   7.166  -2.050
  129   HD13  LEU  23          3HD1      LEU  23  -2.693   8.221  -3.233
  130   HD21  LEU  23          3HD2      LEU  23  -0.893   5.365  -2.228
  131   HD22  LEU  23          1HD2      LEU  23  -1.363   4.232  -3.494
  132   HD23  LEU  23          2HD2      LEU  23  -2.447   4.537  -2.135
  133    H    ARG  24           H        ARG  24  -5.414   6.174  -6.444
  134    HA   ARG  24           HA       ARG  24  -7.520   4.276  -6.170
  135    HB2  ARG  24           2HB      ARG  24  -7.718   6.819  -6.403
  136    HB3  ARG  24           1HB      ARG  24  -7.475   6.568  -8.131
  137    HG2  ARG  24           2HG      ARG  24  -9.788   6.454  -8.037
  138    HG3  ARG  24           1HG      ARG  24  -9.389   4.753  -7.801
  139    HD2  ARG  24           2HD      ARG  24  -9.541   5.045  -5.362
  140    HD3  ARG  24           1HD      ARG  24  -9.903   6.754  -5.581
  141    HE   ARG  24           HE       ARG  24 -11.720   4.949  -6.951
  142   HH11  ARG  24          1HH2      ARG  24 -10.954   6.712  -4.074
  143   HH12  ARG  24          2HH2      ARG  24 -12.589   6.763  -3.503
  144   HH21  ARG  24          1HH1      ARG  24 -13.866   5.010  -6.209
  145   HH22  ARG  24          2HH1      ARG  24 -14.238   5.799  -4.713
  146    H    ASP  25           H        ASP  25  -5.210   5.014  -8.703
  147    HA   ASP  25           HA       ASP  25  -6.533   3.485 -10.743
  148    HB2  ASP  25           2HB      ASP  25  -5.015   5.298 -11.343
  149    HB3  ASP  25           1HB      ASP  25  -3.681   4.474 -10.538
  150    H    THR  26           H        THR  26  -3.726   2.924  -8.626
  151    HA   THR  26           HA       THR  26  -2.965   0.415  -9.546
  152    HB   THR  26           HB       THR  26  -2.935   1.437  -6.697
  153    HG1  THR  26           1HG      THR  26  -1.483   2.702  -7.492
  154   HG21  THR  26          3HG2      THR  26  -1.575  -0.876  -8.082
  155   HG22  THR  26          1HG2      THR  26  -2.555  -0.910  -6.615
  156   HG23  THR  26          2HG2      THR  26  -0.950  -0.177  -6.588
  157    H    ILE  27           H        ILE  27  -5.518   1.290  -7.262
  158    HA   ILE  27           HA       ILE  27  -6.182  -1.424  -6.598
  159    HB   ILE  27           HB       ILE  27  -7.736   1.152  -6.250
  160   HG12  ILE  27          2HG1      ILE  27  -6.216  -0.488  -4.205
  161   HG13  ILE  27          1HG1      ILE  27  -5.505   0.886  -5.051
  162   HG21  ILE  27          1HG2      ILE  27  -9.339  -0.595  -6.155
  163   HG22  ILE  27          2HG2      ILE  27  -8.904  -0.307  -4.472
  164   HG23  ILE  27          3HG2      ILE  27  -8.222  -1.686  -5.333
  165   HD11  ILE  27          3HD1      ILE  27  -8.132   1.146  -3.590
  166   HD12  ILE  27          1HD1      ILE  27  -7.014   2.420  -4.073
  167   HD13  ILE  27          2HD1      ILE  27  -6.595   1.335  -2.747
  168    H    ASN  28           H        ASN  28  -7.267   0.921  -8.983
  169    HA   ASN  28           HA       ASN  28  -9.409  -0.854  -9.898
  170    HB2  ASN  28           2HB      ASN  28  -8.548   1.904 -10.795
  171    HB3  ASN  28           1HB      ASN  28  -9.908   1.011 -11.473
  172   HD21  ASN  28          1HD2      ASN  28  -8.821   1.401  -8.055
  173   HD22  ASN  28          2HD2      ASN  28 -10.303   2.015  -7.504
  174    H    THR  29           H        THR  29  -6.505  -1.519 -10.166
  175    HA   THR  29           HA       THR  29  -6.607  -2.279 -12.981
  176    HB   THR  29           HB       THR  29  -4.249  -1.465 -13.336
  177    HG1  THR  29           1HG      THR  29  -3.311  -0.314 -11.832
  178   HG21  THR  29          3HG2      THR  29  -6.347  -0.268 -14.120
  179   HG22  THR  29          1HG2      THR  29  -4.926   0.759 -13.924
  180   HG23  THR  29          2HG2      THR  29  -6.193   0.763 -12.698
  181    H    SER  30           H        SER  30  -4.396  -2.182 -10.174
  182    HA   SER  30           HA       SER  30  -3.403  -4.843 -10.798
  183    HB2  SER  30           2HB      SER  30  -2.095  -2.807  -9.782
  184    HB3  SER  30           1HB      SER  30  -2.768  -3.378  -8.258
  185    HG   SER  30           HG       SER  30  -1.534  -5.160 -10.059
  186    H    CYS  31           H        CYS  31  -3.122  -6.267  -8.686
  187    HA   CYS  31           HA       CYS  31  -5.406  -6.222  -6.909
  188    HB2  CYS  31           2HB      CYS  31  -6.345  -7.273  -8.955
  189    HB3  CYS  31           1HB      CYS  31  -5.098  -8.518  -8.857
  190    HG   CYS  31           HG       CYS  31  -6.699  -9.680  -7.359
  191    H    ASP  32           H        ASP  32  -4.687  -6.875  -4.996
  192    HA   ASP  32           HA       ASP  32  -3.178  -9.238  -4.582
  193    HB2  ASP  32           2HB      ASP  32  -1.512  -7.380  -5.531
  194    HB3  ASP  32           1HB      ASP  32  -1.517  -6.867  -3.846
  195    H    ILE  33           H        ILE  33  -3.150  -9.812  -2.431
  196    HA   ILE  33           HA       ILE  33  -4.930  -8.393  -0.695
  197    HB   ILE  33           HB       ILE  33  -3.046 -10.684  -0.081
  198   HG12  ILE  33          2HG1      ILE  33  -6.009 -10.768  -0.709
  199   HG13  ILE  33          1HG1      ILE  33  -4.764 -11.035  -1.930
  200   HG21  ILE  33          1HG2      ILE  33  -4.871 -11.064   1.712
  201   HG22  ILE  33          2HG2      ILE  33  -5.339  -9.393   1.401
  202   HG23  ILE  33          3HG2      ILE  33  -3.720  -9.759   1.992
  203   HD11  ILE  33          3HD1      ILE  33  -4.842 -12.603   0.653
  204   HD12  ILE  33          1HD1      ILE  33  -3.947 -12.978  -0.820
  205   HD13  ILE  33          2HD1      ILE  33  -5.704 -13.131  -0.791
  206    H    GLU  34           H        GLU  34  -1.708  -7.946  -1.488
  207    HA   GLU  34           HA       GLU  34  -0.983  -6.831   1.140
  208    HB2  GLU  34           2HB      GLU  34   0.804  -7.044  -1.281
  209    HB3  GLU  34           1HB      GLU  34   1.271  -6.890   0.414
  210    HG2  GLU  34           2HG      GLU  34  -0.111  -9.275  -0.849
  211    HG3  GLU  34           1HG      GLU  34   1.569  -9.207  -0.320
  212    H    LEU  35           H        LEU  35  -0.606  -5.879  -2.290
  213    HA   LEU  35           HA       LEU  35  -0.095  -3.178  -1.843
  214    HB2  LEU  35           2HB      LEU  35  -1.414  -4.578  -4.172
  215    HB3  LEU  35           1HB      LEU  35  -1.005  -2.865  -4.190
  216    HG   LEU  35           HG       LEU  35   0.984  -5.092  -3.655
  217   HD11  LEU  35          1HD1      LEU  35   0.064  -5.107  -5.981
  218   HD12  LEU  35          2HD1      LEU  35   1.782  -4.715  -5.925
  219   HD13  LEU  35          3HD1      LEU  35   0.592  -3.434  -6.164
  220   HD21  LEU  35          3HD2      LEU  35   2.486  -3.001  -4.397
  221   HD22  LEU  35          1HD2      LEU  35   1.994  -3.227  -2.721
  222   HD23  LEU  35          2HD2      LEU  35   1.115  -2.099  -3.752
  223    H    LEU  36           H        LEU  36  -3.230  -4.720  -2.585
  224    HA   LEU  36           HA       LEU  36  -4.813  -2.421  -2.427
  225    HB2  LEU  36           2HB      LEU  36  -5.543  -5.259  -1.663
  226    HB3  LEU  36           1HB      LEU  36  -6.689  -3.959  -1.983
  227    HG   LEU  36           HG       LEU  36  -4.654  -5.016  -3.971
  228   HD11  LEU  36          1HD1      LEU  36  -6.306  -6.702  -3.741
  229   HD12  LEU  36          2HD1      LEU  36  -6.836  -5.757  -5.132
  230   HD13  LEU  36          3HD1      LEU  36  -7.605  -5.522  -3.564
  231   HD21  LEU  36          3HD2      LEU  36  -6.660  -2.781  -3.992
  232   HD22  LEU  36          1HD2      LEU  36  -6.356  -3.659  -5.491
  233   HD23  LEU  36          2HD2      LEU  36  -5.035  -2.829  -4.673
  234    H    ALA  37           H        ALA  37  -3.964  -4.760   0.119
  235    HA   ALA  37           HA       ALA  37  -5.387  -3.498   2.203
  236    HB1  ALA  37           1HB      ALA  37  -2.841  -5.111   2.465
  237    HB2  ALA  37           2HB      ALA  37  -4.442  -5.823   2.269
  238    HB3  ALA  37           3HB      ALA  37  -4.075  -4.859   3.700
  239    H    ALA  38           H        ALA  38  -2.203  -2.953   0.830
  240    HA   ALA  38           HA       ALA  38  -1.306  -1.197   2.923
  241    HB1  ALA  38           1HB      ALA  38   0.632  -0.901   1.634
  242    HB2  ALA  38           2HB      ALA  38  -0.214  -1.217   0.119
  243    HB3  ALA  38           3HB      ALA  38   0.121  -2.540   1.234
  244    H    CYS  39           H        CYS  39  -2.705  -0.768  -0.306
  245    HA   CYS  39           HA       CYS  39  -2.518   2.057  -0.381
  246    HB2  CYS  39           2HB      CYS  39  -2.954   0.539  -2.345
  247    HB3  CYS  39           1HB      CYS  39  -4.602   0.344  -1.748
  248    HG   CYS  39           HG       CYS  39  -3.440   2.924  -2.995
  249    H    ARG  40           H        ARG  40  -5.266  -0.081   0.414
  250    HA   ARG  40           HA       ARG  40  -7.129   1.884   1.054
  251    HB2  ARG  40           2HB      ARG  40  -6.742  -0.902   2.158
  252    HB3  ARG  40           1HB      ARG  40  -8.134   0.106   2.551
  253    HG2  ARG  40           2HG      ARG  40  -8.590   0.331   0.091
  254    HG3  ARG  40           1HG      ARG  40  -7.299  -0.834  -0.206
  255    HD2  ARG  40           2HD      ARG  40  -9.348  -2.079  -0.177
  256    HD3  ARG  40           1HD      ARG  40  -8.522  -2.427   1.338
  257    HE   ARG  40           HE       ARG  40 -10.163  -0.288   1.906
  258   HH11  ARG  40          1HH2      ARG  40 -10.527  -3.470   0.597
  259   HH12  ARG  40          2HH2      ARG  40 -12.131  -3.689   1.212
  260   HH21  ARG  40          1HH1      ARG  40 -12.266  -0.567   2.716
  261   HH22  ARG  40          2HH1      ARG  40 -13.116  -2.046   2.411
  262    H    GLU  41           H        GLU  41  -4.430   0.655   2.915
  263    HA   GLU  41           HA       GLU  41  -5.244   1.715   5.436
  264    HB2  GLU  41           2HB      GLU  41  -2.644   0.713   4.306
  265    HB3  GLU  41           1HB      GLU  41  -2.692   1.481   5.892
  266    HG2  GLU  41           2HG      GLU  41  -4.597  -0.747   5.179
  267    HG3  GLU  41           1HG      GLU  41  -2.981  -1.089   5.798
  268    H    GLU  42           H        GLU  42  -2.864   2.864   3.021
  269    HA   GLU  42           HA       GLU  42  -2.422   5.326   4.424
  270    HB2  GLU  42           2HB      GLU  42  -0.856   5.818   2.783
  271    HB3  GLU  42           1HB      GLU  42  -0.877   4.057   2.728
  272    HG2  GLU  42           2HG      GLU  42  -1.082   4.567   0.469
  273    HG3  GLU  42           1HG      GLU  42  -2.776   4.433   0.930
  274    H    PHE  43           H        PHE  43  -4.606   4.255   1.919
  275    HA   PHE  43           HA       PHE  43  -5.392   6.774   0.906
  276    HB2  PHE  43           2HB      PHE  43  -5.917   4.473  -0.058
  277    HB3  PHE  43           1HB      PHE  43  -7.186   4.360   1.161
  278    HD1  PHE  43           2HD      PHE  43  -9.019   6.092   1.212
  279    HD2  PHE  43           1HD      PHE  43  -6.195   5.813  -2.013
  280    HE1  PHE  43           2HE      PHE  43 -10.523   7.445  -0.223
  281    HE2  PHE  43           1HE      PHE  43  -7.698   7.166  -3.447
  282    HZ   PHE  43           HZ       PHE  43  -9.863   7.983  -2.551
  283    H    HIS  44           H        HIS  44  -6.373   4.927   3.729
  284    HA   HIS  44           HA       HIS  44  -8.678   6.454   4.380
  285    HB2  HIS  44           2HB      HIS  44  -6.848   4.785   6.123
  286    HB3  HIS  44           1HB      HIS  44  -8.398   5.447   6.644
  287    HD2  HIS  44           2HD      HIS  44  -9.167   4.497   3.166
  288    HE1  HIS  44           1HE      HIS  44  -9.659   0.877   5.281
  289    HE2  HIS  44           2HE      HIS  44 -10.127   2.068   3.089
  290    H    ARG  45           H        ARG  45  -5.259   6.724   5.235
  291    HA   ARG  45           HA       ARG  45  -5.505   8.747   7.183
  292    HB2  ARG  45           2HB      ARG  45  -3.187   8.330   5.282
  293    HB3  ARG  45           1HB      ARG  45  -3.140   9.114   6.862
  294    HG2  ARG  45           2HG      ARG  45  -3.987   6.910   7.834
  295    HG3  ARG  45           1HG      ARG  45  -3.645   6.193   6.259
  296    HD2  ARG  45           2HD      ARG  45  -1.691   7.482   8.170
  297    HD3  ARG  45           1HD      ARG  45  -1.694   5.820   7.587
  298    HE   ARG  45           HE       ARG  45  -1.432   7.794   5.486
  299   HH11  ARG  45          1HH2      ARG  45   0.165   5.854   7.865
  300   HH12  ARG  45          2HH2      ARG  45   1.690   5.856   7.043
  301   HH21  ARG  45          1HH1      ARG  45   0.564   7.800   4.402
  302   HH22  ARG  45          2HH1      ARG  45   1.915   6.957   5.082
  303    H    ARG  46           H        ARG  46  -5.233   8.866   3.663
  304    HA   ARG  46           HA       ARG  46  -4.778  11.595   3.310
  305    HB2  ARG  46           2HB      ARG  46  -6.459   9.739   1.606
  306    HB3  ARG  46           1HB      ARG  46  -5.829  11.303   1.095
  307    HG2  ARG  46           2HG      ARG  46  -3.933   9.235   2.183
  308    HG3  ARG  46           1HG      ARG  46  -4.494   9.103   0.516
  309    HD2  ARG  46           2HD      ARG  46  -3.736  11.446   0.114
  310    HD3  ARG  46           1HD      ARG  46  -3.091  11.491   1.752
  311    HE   ARG  46           HE       ARG  46  -2.048   9.249   0.346
  312   HH11  ARG  46          1HH2      ARG  46  -1.886  12.698   0.575
  313   HH12  ARG  46          2HH2      ARG  46  -0.248  12.795   0.024
  314   HH21  ARG  46          1HH1      ARG  46   0.101   9.369  -0.379
  315   HH22  ARG  46          2HH1      ARG  46   0.877  10.912  -0.516
  316    H    LEU  47           H        LEU  47  -7.732   9.856   4.069
  317    HA   LEU  47           HA       LEU  47  -9.500  12.063   3.617
  318    HB2  LEU  47           2HB      LEU  47 -10.089   9.783   5.489
  319    HB3  LEU  47           1HB      LEU  47 -11.197  10.672   4.442
  320    HG   LEU  47           HG       LEU  47  -9.040   8.731   3.565
  321   HD11  LEU  47          1HD1      LEU  47 -11.192   7.785   4.461
  322   HD12  LEU  47          2HD1      LEU  47 -10.896   7.393   2.766
  323   HD13  LEU  47          3HD1      LEU  47 -12.048   8.660   3.191
  324   HD21  LEU  47          3HD2      LEU  47 -10.086   9.191   1.273
  325   HD22  LEU  47          1HD2      LEU  47  -9.077  10.478   1.931
  326   HD23  LEU  47          2HD2      LEU  47 -10.835  10.608   2.009
  327    H    LYS  48           H        LYS  48  -7.914  10.687   6.477
  328    HA   LYS  48           HA       LYS  48  -9.091  12.606   8.278
  329    HB2  LYS  48           2HB      LYS  48  -6.848  10.601   8.592
  330    HB3  LYS  48           1HB      LYS  48  -7.415  11.639   9.899
  331    HG2  LYS  48           2HG      LYS  48  -9.435  10.032   8.369
  332    HG3  LYS  48           1HG      LYS  48  -8.435   9.207   9.562
  333    HD2  LYS  48           2HD      LYS  48  -9.772  11.784  10.334
  334    HD3  LYS  48           1HD      LYS  48 -10.733  10.306  10.281
  335    HE2  LYS  48           2HE      LYS  48  -9.415   9.249  11.935
  336    HE3  LYS  48           1HE      LYS  48  -8.096  10.406  11.747
  337    HZ1  LYS  48           3HZ      LYS  48  -9.813  10.594  13.705
  338    HZ2  LYS  48           1HZ      LYS  48 -10.721  11.427  12.540
  339    HZ3  LYS  48           2HZ      LYS  48  -9.169  11.978  12.960
  340    H    VAL  49           H        VAL  49  -5.690  12.082   8.573
  341    HA   VAL  49           HA       VAL  49  -5.063  14.797   8.868
  342    HB   VAL  49           HB       VAL  49  -3.620  13.032   9.740
  343   HG11  VAL  49          1HG1      VAL  49  -2.409  11.533   8.350
  344   HG12  VAL  49          2HG1      VAL  49  -2.766  12.465   6.896
  345   HG13  VAL  49          3HG1      VAL  49  -4.042  11.538   7.686
  346   HG21  VAL  49          3HG2      VAL  49  -2.104  14.520   7.583
  347   HG22  VAL  49          1HG2      VAL  49  -1.515  14.021   9.168
  348   HG23  VAL  49          2HG2      VAL  49  -2.707  15.314   9.039
  349    H    TYR  50           H        TYR  50  -4.816  16.384   7.446
  350    HA   TYR  50           HA       TYR  50  -4.029  15.750   4.677
  351    HB2  TYR  50           2HB      TYR  50  -6.551  16.008   4.896
  352    HB3  TYR  50           1HB      TYR  50  -6.252  17.694   5.317
  353    HD1  TYR  50           1HD      TYR  50  -5.514  15.129   2.697
  354    HD2  TYR  50           2HD      TYR  50  -5.914  19.303   3.629
  355    HE1  TYR  50           1HE      TYR  50  -5.284  15.688   0.292
  356    HE2  TYR  50           2HE      TYR  50  -5.686  19.862   1.224
  357    HH   TYR  50           HH       TYR  50  -5.597  17.350  -1.245
  358    H    HIS  51           H        HIS  51  -2.146  16.783   4.470
  359    HA   HIS  51           HA       HIS  51  -1.145  18.871   5.969
  360    HB2  HIS  51           2HB      HIS  51  -0.599  18.504   3.017
  361    HB3  HIS  51           1HB      HIS  51   0.473  19.207   4.230
  362    HD2  HIS  51           2HD      HIS  51   1.161  16.308   2.533
  363    HE1  HIS  51           1HE      HIS  51   0.825  14.637   6.395
  364    HE2  HIS  51           2HE      HIS  51   1.692  14.245   4.041
  Start of MODEL   19
    1    H1   GLY   9           H        GLY   9   9.152 -10.664   9.152
    2    HA2  GLY   9           2HA      GLY   9   8.522 -13.169   8.190
    3    HA3  GLY   9           1HA      GLY   9   7.663 -13.042   9.723
    4    H    THR  10           H        THR  10   8.315 -10.894   6.940
    5    HA   THR  10           HA       THR  10   5.626 -10.724   6.096
    6    HB   THR  10           HB       THR  10   5.075  -9.540   8.073
    7    HG1  THR  10           1HG      THR  10   5.096  -8.354   5.746
    8   HG21  THR  10          3HG2      THR  10   6.448  -7.661   8.915
    9   HG22  THR  10          1HG2      THR  10   7.615  -7.947   7.624
   10   HG23  THR  10          2HG2      THR  10   7.366  -9.167   8.873
   11    H    LYS  11           H        LYS  11   5.423  -9.528   4.214
   12    HA   LYS  11           HA       LYS  11   7.843  -8.101   3.277
   13    HB2  LYS  11           2HB      LYS  11   7.794 -10.286   2.203
   14    HB3  LYS  11           1HB      LYS  11   6.121 -10.032   1.705
   15    HG2  LYS  11           2HG      LYS  11   6.734  -8.246   0.233
   16    HG3  LYS  11           1HG      LYS  11   8.366  -8.171   0.899
   17    HD2  LYS  11           2HD      LYS  11   8.964 -10.271  -0.068
   18    HD3  LYS  11           1HD      LYS  11   7.284 -10.647  -0.457
   19    HE2  LYS  11           2HE      LYS  11   8.545  -9.900  -2.461
   20    HE3  LYS  11           1HE      LYS  11   7.221  -8.800  -2.072
   21    HZ1  LYS  11           3HZ      LYS  11   9.904  -8.175  -2.328
   22    HZ2  LYS  11           1HZ      LYS  11   9.559  -8.048  -0.674
   23    HZ3  LYS  11           2HZ      LYS  11   8.653  -7.155  -1.798
   24    H    LYS  12           H        LYS  12   7.157  -6.035   3.359
   25    HA   LYS  12           HA       LYS  12   4.576  -5.374   2.061
   26    HB2  LYS  12           2HB      LYS  12   4.834  -3.203   3.405
   27    HB3  LYS  12           1HB      LYS  12   4.428  -4.659   4.310
   28    HG2  LYS  12           2HG      LYS  12   7.333  -4.066   3.938
   29    HG3  LYS  12           1HG      LYS  12   6.442  -3.028   5.049
   30    HD2  LYS  12           2HD      LYS  12   6.114  -6.010   5.254
   31    HD3  LYS  12           1HD      LYS  12   7.553  -5.251   5.936
   32    HE2  LYS  12           2HE      LYS  12   6.294  -3.950   7.454
   33    HE3  LYS  12           1HE      LYS  12   4.796  -4.194   6.557
   34    HZ1  LYS  12           3HZ      LYS  12   5.897  -6.682   7.327
   35    HZ2  LYS  12           1HZ      LYS  12   4.385  -6.020   7.715
   36    HZ3  LYS  12           2HZ      LYS  12   5.734  -5.681   8.689
   37    H    TYR  13           H        TYR  13   4.909  -2.704   1.661
   38    HA   TYR  13           HA       TYR  13   7.309  -2.468  -0.052
   39    HB2  TYR  13           2HB      TYR  13   4.567  -1.451  -0.819
   40    HB3  TYR  13           1HB      TYR  13   6.017  -1.508  -1.822
   41    HD1  TYR  13           1HD      TYR  13   7.047  -3.813  -2.321
   42    HD2  TYR  13           2HD      TYR  13   3.083  -3.287  -0.748
   43    HE1  TYR  13           1HE      TYR  13   6.449  -6.104  -3.057
   44    HE2  TYR  13           2HE      TYR  13   2.488  -5.579  -1.485
   45    HH   TYR  13           HH       TYR  13   4.170  -7.849  -1.972
   46    H    ASP  14           H        ASP  14   7.842  -0.212  -0.593
   47    HA   ASP  14           HA       ASP  14   7.357   1.526   1.724
   48    HB2  ASP  14           2HB      ASP  14   9.690   1.108   1.028
   49    HB3  ASP  14           1HB      ASP  14   9.334   1.810  -0.549
   50    H    LEU  15           H        LEU  15   5.627   2.795   1.536
   51    HA   LEU  15           HA       LEU  15   5.066   4.068  -1.077
   52    HB2  LEU  15           2HB      LEU  15   3.080   3.895   1.178
   53    HB3  LEU  15           1HB      LEU  15   2.783   4.092  -0.548
   54    HG   LEU  15           HG       LEU  15   3.901   1.589   0.755
   55   HD11  LEU  15          1HD1      LEU  15   1.672   0.640   0.062
   56   HD12  LEU  15          2HD1      LEU  15   1.153   2.281  -0.319
   57   HD13  LEU  15          3HD1      LEU  15   1.568   1.848   1.341
   58   HD21  LEU  15          3HD2      LEU  15   3.086   2.247  -2.092
   59   HD22  LEU  15          1HD2      LEU  15   3.428   0.616  -1.517
   60   HD23  LEU  15          2HD2      LEU  15   4.705   1.833  -1.529
   61    H    SER  16           H        SER  16   7.047   5.014   0.796
   62    HA   SER  16           HA       SER  16   6.461   6.928   2.602
   63    HB2  SER  16           2HB      SER  16   8.742   6.631   2.086
   64    HB3  SER  16           1HB      SER  16   8.488   6.966   0.375
   65    HG   SER  16           HG       SER  16   8.245   9.091   0.823
   66    H    LYS  17           H        LYS  17   6.248   7.352  -0.920
   67    HA   LYS  17           HA       LYS  17   4.352   9.558  -0.487
   68    HB2  LYS  17           2HB      LYS  17   6.993   9.737  -1.881
   69    HB3  LYS  17           1HB      LYS  17   5.635  10.662  -2.525
   70    HG2  LYS  17           2HG      LYS  17   5.409  11.941  -0.571
   71    HG3  LYS  17           1HG      LYS  17   6.264  10.758   0.419
   72    HD2  LYS  17           2HD      LYS  17   7.701  12.695   0.027
   73    HD3  LYS  17           1HD      LYS  17   8.359  11.285  -0.803
   74    HE2  LYS  17           2HE      LYS  17   7.524  12.032  -2.924
   75    HE3  LYS  17           1HE      LYS  17   6.553  13.294  -2.167
   76    HZ1  LYS  17           3HZ      LYS  17   8.425  14.406  -2.925
   77    HZ2  LYS  17           1HZ      LYS  17   9.485  13.160  -2.478
   78    HZ3  LYS  17           2HZ      LYS  17   8.779  14.142  -1.285
   79    H    TRP  18           H        TRP  18   2.637   9.388  -1.789
   80    HA   TRP  18           HA       TRP  18   2.884   7.986  -4.363
   81    HB2  TRP  18           2HB      TRP  18   1.258   7.135  -2.012
   82    HB3  TRP  18           1HB      TRP  18   0.508   6.996  -3.601
   83    HD1  TRP  18           HD       TRP  18   3.862   6.023  -1.919
   84    HE1  TRP  18           1HE      TRP  18   4.625   3.768  -2.909
   85    HE3  TRP  18           3HE      TRP  18   0.141   5.252  -5.329
   86    HZ2  TRP  18           2HZ      TRP  18   3.769   1.885  -4.882
   87    HZ3  TRP  18           3HZ      TRP  18   0.138   3.220  -6.748
   88    HH2  TRP  18           HH       TRP  18   1.945   1.535  -6.528
   89    H    LYS  19           H        LYS  19   0.829   8.258  -5.663
   90    HA   LYS  19           HA       LYS  19  -0.192  11.004  -5.267
   91    HB2  LYS  19           2HB      LYS  19  -0.347   9.396  -7.815
   92    HB3  LYS  19           1HB      LYS  19  -0.491  11.143  -7.611
   93    HG2  LYS  19           2HG      LYS  19   2.016   9.502  -7.131
   94    HG3  LYS  19           1HG      LYS  19   1.726  10.568  -8.506
   95    HD2  LYS  19           2HD      LYS  19   1.345  12.425  -6.756
   96    HD3  LYS  19           1HD      LYS  19   2.096  11.318  -5.606
   97    HE2  LYS  19           2HE      LYS  19   3.875  12.671  -6.441
   98    HE3  LYS  19           1HE      LYS  19   4.028  11.124  -7.272
   99    HZ1  LYS  19           3HZ      LYS  19   2.408  12.376  -8.939
  100    HZ2  LYS  19           1HZ      LYS  19   4.098  12.469  -9.065
  101    HZ3  LYS  19           2HZ      LYS  19   3.232  13.724  -8.314
  102    H    TYR  20           H        TYR  20  -2.359  11.420  -5.218
  103    HA   TYR  20           HA       TYR  20  -4.139   9.530  -4.243
  104    HB2  TYR  20           2HB      TYR  20  -4.536  11.946  -4.093
  105    HB3  TYR  20           1HB      TYR  20  -4.776  12.023  -5.838
  106    HD1  TYR  20           2HD      TYR  20  -6.754  11.006  -6.892
  107    HD2  TYR  20           1HD      TYR  20  -6.214  10.971  -2.630
  108    HE1  TYR  20           2HE      TYR  20  -9.137  10.389  -6.595
  109    HE2  TYR  20           1HE      TYR  20  -8.597  10.353  -2.334
  110    HH   TYR  20           HH       TYR  20 -10.860  10.798  -4.231
  111    H    ALA  21           H        ALA  21  -3.353  10.364  -7.562
  112    HA   ALA  21           HA       ALA  21  -5.517   8.869  -8.727
  113    HB1  ALA  21           1HB      ALA  21  -2.943   9.848  -9.986
  114    HB2  ALA  21           2HB      ALA  21  -4.447  10.767  -9.895
  115    HB3  ALA  21           3HB      ALA  21  -4.376   9.285 -10.848
  116    H    GLU  22           H        GLU  22  -2.052   8.304  -8.197
  117    HA   GLU  22           HA       GLU  22  -1.892   5.802  -9.484
  118    HB2  GLU  22           2HB      GLU  22  -0.284   7.047  -7.253
  119    HB3  GLU  22           1HB      GLU  22   0.106   5.470  -7.938
  120    HG2  GLU  22           2HG      GLU  22  -0.239   7.933  -9.655
  121    HG3  GLU  22           1HG      GLU  22   1.318   7.476  -8.967
  122    H    LEU  23           H        LEU  23  -2.555   6.658  -6.102
  123    HA   LEU  23           HA       LEU  23  -2.697   4.046  -5.073
  124    HB2  LEU  23           2HB      LEU  23  -4.189   6.529  -4.190
  125    HB3  LEU  23           1HB      LEU  23  -3.998   5.060  -3.235
  126    HG   LEU  23           HG       LEU  23  -1.607   6.543  -4.326
  127   HD11  LEU  23          1HD1      LEU  23  -1.503   7.475  -1.910
  128   HD12  LEU  23          2HD1      LEU  23  -3.223   7.092  -1.840
  129   HD13  LEU  23          3HD1      LEU  23  -2.624   8.240  -3.036
  130   HD21  LEU  23          3HD2      LEU  23  -0.607   5.458  -2.225
  131   HD22  LEU  23          1HD2      LEU  23  -1.054   4.358  -3.527
  132   HD23  LEU  23          2HD2      LEU  23  -2.101   4.528  -2.119
  133    H    ARG  24           H        ARG  24  -5.264   6.167  -6.338
  134    HA   ARG  24           HA       ARG  24  -7.346   4.245  -5.995
  135    HB2  ARG  24           2HB      ARG  24  -7.619   6.765  -6.227
  136    HB3  ARG  24           1HB      ARG  24  -7.337   6.544  -7.953
  137    HG2  ARG  24           2HG      ARG  24  -9.648   6.372  -7.910
  138    HG3  ARG  24           1HG      ARG  24  -9.217   4.679  -7.680
  139    HD2  ARG  24           2HD      ARG  24  -9.243   5.245  -5.143
  140    HD3  ARG  24           1HD      ARG  24 -10.140   6.682  -5.625
  141    HE   ARG  24           HE       ARG  24 -11.206   4.208  -6.694
  142   HH11  ARG  24          1HH2      ARG  24 -11.150   6.464  -4.071
  143   HH12  ARG  24          2HH2      ARG  24 -12.719   6.028  -3.482
  144   HH21  ARG  24          1HH1      ARG  24 -13.264   3.632  -5.929
  145   HH22  ARG  24          2HH1      ARG  24 -13.917   4.426  -4.534
  146    H    ASP  25           H        ASP  25  -5.243   5.149  -8.694
  147    HA   ASP  25           HA       ASP  25  -6.522   3.568 -10.665
  148    HB2  ASP  25           2HB      ASP  25  -3.740   4.700 -10.404
  149    HB3  ASP  25           1HB      ASP  25  -4.237   3.749 -11.800
  150    H    THR  26           H        THR  26  -3.697   2.954  -8.585
  151    HA   THR  26           HA       THR  26  -2.991   0.437  -9.522
  152    HB   THR  26           HB       THR  26  -2.922   1.328  -6.631
  153    HG1  THR  26           1HG      THR  26  -1.952   2.655  -8.485
  154   HG21  THR  26          3HG2      THR  26  -1.219  -0.614  -8.219
  155   HG22  THR  26          1HG2      THR  26  -2.419  -1.055  -7.003
  156   HG23  THR  26          2HG2      THR  26  -0.966  -0.173  -6.530
  157    H    ILE  27           H        ILE  27  -5.476   1.337  -7.167
  158    HA   ILE  27           HA       ILE  27  -6.180  -1.366  -6.511
  159    HB   ILE  27           HB       ILE  27  -7.679   1.236  -6.122
  160   HG12  ILE  27          2HG1      ILE  27  -6.156  -0.445  -4.112
  161   HG13  ILE  27          1HG1      ILE  27  -5.433   0.919  -4.963
  162   HG21  ILE  27          1HG2      ILE  27  -9.314  -0.477  -6.009
  163   HG22  ILE  27          2HG2      ILE  27  -8.842  -0.211  -4.331
  164   HG23  ILE  27          3HG2      ILE  27  -8.206  -1.597  -5.216
  165   HD11  ILE  27          3HD1      ILE  27  -6.521   1.327  -2.618
  166   HD12  ILE  27          1HD1      ILE  27  -8.043   1.272  -3.506
  167   HD13  ILE  27          2HD1      ILE  27  -6.828   2.482  -3.914
  168    H    ASN  28           H        ASN  28  -7.240   0.999  -8.879
  169    HA   ASN  28           HA       ASN  28  -9.441  -0.727  -9.759
  170    HB2  ASN  28           2HB      ASN  28  -8.571   2.064 -10.509
  171    HB3  ASN  28           1HB      ASN  28  -9.849   1.200 -11.362
  172   HD21  ASN  28          1HD2      ASN  28  -8.973   1.704  -7.885
  173   HD22  ASN  28          2HD2      ASN  28 -10.550   2.112  -7.406
  174    H    THR  29           H        THR  29  -6.585  -1.477 -10.102
  175    HA   THR  29           HA       THR  29  -6.745  -2.135 -12.941
  176    HB   THR  29           HB       THR  29  -4.339  -1.413 -13.265
  177    HG1  THR  29           1HG      THR  29  -3.540  -0.986 -11.336
  178   HG21  THR  29          3HG2      THR  29  -4.939   0.858 -13.801
  179   HG22  THR  29          1HG2      THR  29  -6.248   0.846 -12.621
  180   HG23  THR  29          2HG2      THR  29  -6.365  -0.141 -14.079
  181    H    SER  30           H        SER  30  -4.529  -2.235 -10.139
  182    HA   SER  30           HA       SER  30  -3.646  -4.910 -10.872
  183    HB2  SER  30           2HB      SER  30  -2.229  -2.986  -9.816
  184    HB3  SER  30           1HB      SER  30  -2.935  -3.534  -8.298
  185    HG   SER  30           HG       SER  30  -2.231  -5.710  -9.106
  186    H    CYS  31           H        CYS  31  -3.385  -6.384  -8.767
  187    HA   CYS  31           HA       CYS  31  -5.681  -6.318  -7.004
  188    HB2  CYS  31           2HB      CYS  31  -6.474  -7.359  -9.204
  189    HB3  CYS  31           1HB      CYS  31  -5.412  -8.712  -8.817
  190    HG   CYS  31           HG       CYS  31  -6.973  -8.402  -6.387
  191    H    ASP  32           H        ASP  32  -4.986  -7.004  -5.093
  192    HA   ASP  32           HA       ASP  32  -3.536  -9.402  -4.686
  193    HB2  ASP  32           2HB      ASP  32  -1.816  -7.591  -5.630
  194    HB3  ASP  32           1HB      ASP  32  -1.809  -7.081  -3.944
  195    H    ILE  33           H        ILE  33  -3.203  -9.855  -2.450
  196    HA   ILE  33           HA       ILE  33  -5.045  -8.424  -0.725
  197    HB   ILE  33           HB       ILE  33  -3.245 -10.788  -0.137
  198   HG12  ILE  33          2HG1      ILE  33  -6.214 -10.767  -0.741
  199   HG13  ILE  33          1HG1      ILE  33  -4.989 -11.069  -1.974
  200   HG21  ILE  33          1HG2      ILE  33  -5.085 -11.102   1.663
  201   HG22  ILE  33          2HG2      ILE  33  -5.467  -9.406   1.368
  202   HG23  ILE  33          3HG2      ILE  33  -3.864  -9.863   1.947
  203   HD11  ILE  33          3HD1      ILE  33  -4.171 -13.008  -0.772
  204   HD12  ILE  33          1HD1      ILE  33  -5.920 -13.166  -0.940
  205   HD13  ILE  33          2HD1      ILE  33  -5.224 -12.656   0.599
  206    H    GLU  34           H        GLU  34  -1.841  -8.060  -1.582
  207    HA   GLU  34           HA       GLU  34  -1.022  -7.005   1.045
  208    HB2  GLU  34           2HB      GLU  34   0.715  -7.281  -1.406
  209    HB3  GLU  34           1HB      GLU  34   1.217  -7.142   0.279
  210    HG2  GLU  34           2HG      GLU  34   0.010  -9.331   0.710
  211    HG3  GLU  34           1HG      GLU  34  -0.175  -9.485  -1.037
  212    H    LEU  35           H        LEU  35  -0.659  -6.047  -2.385
  213    HA   LEU  35           HA       LEU  35  -0.025  -3.376  -1.935
  214    HB2  LEU  35           2HB      LEU  35  -1.274  -4.852  -4.226
  215    HB3  LEU  35           1HB      LEU  35  -1.201  -3.093  -4.280
  216    HG   LEU  35           HG       LEU  35   1.203  -4.867  -3.759
  217   HD11  LEU  35          1HD1      LEU  35   1.822  -4.531  -6.065
  218   HD12  LEU  35          2HD1      LEU  35   0.469  -3.429  -6.322
  219   HD13  LEU  35          3HD1      LEU  35   0.169  -5.146  -6.049
  220   HD21  LEU  35          3HD2      LEU  35   2.184  -2.528  -4.701
  221   HD22  LEU  35          1HD2      LEU  35   1.911  -2.818  -2.984
  222   HD23  LEU  35          2HD2      LEU  35   0.719  -1.925  -3.929
  223    H    LEU  36           H        LEU  36  -3.246  -4.766  -2.606
  224    HA   LEU  36           HA       LEU  36  -4.726  -2.411  -2.409
  225    HB2  LEU  36           2HB      LEU  36  -5.541  -5.208  -1.578
  226    HB3  LEU  36           1HB      LEU  36  -6.647  -3.866  -1.871
  227    HG   LEU  36           HG       LEU  36  -4.739  -5.030  -3.922
  228   HD11  LEU  36          1HD1      LEU  36  -6.622  -6.099  -4.902
  229   HD12  LEU  36          2HD1      LEU  36  -7.757  -5.179  -3.916
  230   HD13  LEU  36          3HD1      LEU  36  -6.763  -6.435  -3.177
  231   HD21  LEU  36          3HD2      LEU  36  -5.047  -2.829  -4.623
  232   HD22  LEU  36          1HD2      LEU  36  -6.650  -2.713  -3.896
  233   HD23  LEU  36          2HD2      LEU  36  -6.422  -3.614  -5.396
  234    H    ALA  37           H        ALA  37  -3.914  -4.752   0.147
  235    HA   ALA  37           HA       ALA  37  -5.204  -3.390   2.251
  236    HB1  ALA  37           1HB      ALA  37  -3.819  -4.759   3.734
  237    HB2  ALA  37           2HB      ALA  37  -2.765  -5.180   2.384
  238    HB3  ALA  37           3HB      ALA  37  -4.439  -5.736   2.404
  239    H    ALA  38           H        ALA  38  -2.031  -3.033   0.792
  240    HA   ALA  38           HA       ALA  38  -0.995  -1.292   2.830
  241    HB1  ALA  38           1HB      ALA  38   0.917  -1.084   1.458
  242    HB2  ALA  38           2HB      ALA  38   0.010  -1.462  -0.006
  243    HB3  ALA  38           3HB      ALA  38   0.345  -2.728   1.174
  244    H    CYS  39           H        CYS  39  -2.409  -0.833  -0.392
  245    HA   CYS  39           HA       CYS  39  -2.085   1.981  -0.486
  246    HB2  CYS  39           2HB      CYS  39  -2.523   0.688  -2.503
  247    HB3  CYS  39           1HB      CYS  39  -4.091   0.188  -1.874
  248    HG   CYS  39           HG       CYS  39  -4.444   2.294  -3.418
  249    H    ARG  40           H        ARG  40  -4.916  -0.031   0.332
  250    HA   ARG  40           HA       ARG  40  -6.699   2.025   0.938
  251    HB2  ARG  40           2HB      ARG  40  -6.449  -0.768   2.069
  252    HB3  ARG  40           1HB      ARG  40  -7.807   0.304   2.419
  253    HG2  ARG  40           2HG      ARG  40  -8.533   0.320   0.174
  254    HG3  ARG  40           1HG      ARG  40  -6.981  -0.268  -0.426
  255    HD2  ARG  40           2HD      ARG  40  -9.026  -1.923  -0.222
  256    HD3  ARG  40           1HD      ARG  40  -7.406  -2.462   0.212
  257    HE   ARG  40           HE       ARG  40  -8.890  -1.328   2.424
  258   HH11  ARG  40          1HH2      ARG  40  -8.190  -4.141   0.533
  259   HH12  ARG  40          2HH2      ARG  40  -8.605  -5.258   1.791
  260   HH21  ARG  40          1HH1      ARG  40  -9.437  -2.788   4.076
  261   HH22  ARG  40          2HH1      ARG  40  -9.310  -4.492   3.795
  262    H    GLU  41           H        GLU  41  -4.197   0.530   2.933
  263    HA   GLU  41           HA       GLU  41  -4.914   1.578   5.425
  264    HB2  GLU  41           2HB      GLU  41  -2.327   0.696   4.194
  265    HB3  GLU  41           1HB      GLU  41  -2.309   1.485   5.772
  266    HG2  GLU  41           2HG      GLU  41  -3.599  -0.206   6.774
  267    HG3  GLU  41           1HG      GLU  41  -4.206  -0.792   5.226
  268    H    GLU  42           H        GLU  42  -2.639   2.939   3.022
  269    HA   GLU  42           HA       GLU  42  -2.319   5.369   4.516
  270    HB2  GLU  42           2HB      GLU  42  -0.726   5.947   2.958
  271    HB3  GLU  42           1HB      GLU  42  -0.741   4.201   2.727
  272    HG2  GLU  42           2HG      GLU  42  -0.917   4.968   0.531
  273    HG3  GLU  42           1HG      GLU  42  -2.608   4.724   0.953
  274    H    PHE  43           H        PHE  43  -4.434   4.256   1.977
  275    HA   PHE  43           HA       PHE  43  -5.346   6.744   1.013
  276    HB2  PHE  43           2HB      PHE  43  -5.768   4.360   0.092
  277    HB3  PHE  43           1HB      PHE  43  -7.110   4.313   1.236
  278    HD1  PHE  43           2HD      PHE  43  -8.809   6.254   1.173
  279    HD2  PHE  43           1HD      PHE  43  -6.010   5.451  -1.984
  280    HE1  PHE  43           2HE      PHE  43 -10.199   7.580  -0.397
  281    HE2  PHE  43           1HE      PHE  43  -7.399   6.775  -3.554
  282    HZ   PHE  43           HZ       PHE  43  -9.493   7.840  -2.760
  283    H    HIS  44           H        HIS  44  -6.354   4.754   3.755
  284    HA   HIS  44           HA       HIS  44  -8.682   6.188   4.442
  285    HB2  HIS  44           2HB      HIS  44  -6.789   4.418   5.971
  286    HB3  HIS  44           1HB      HIS  44  -8.100   5.255   6.803
  287    HD2  HIS  44           2HD      HIS  44  -7.642   1.950   5.103
  288    HE1  HIS  44           1HE      HIS  44 -11.723   2.865   4.533
  289    HE2  HIS  44           2HE      HIS  44  -9.978   1.025   4.391
  290    H    ARG  45           H        ARG  45  -5.278   6.699   5.202
  291    HA   ARG  45           HA       ARG  45  -5.621   8.657   7.213
  292    HB2  ARG  45           2HB      ARG  45  -3.358   8.165   5.268
  293    HB3  ARG  45           1HB      ARG  45  -3.278   9.328   6.592
  294    HG2  ARG  45           2HG      ARG  45  -3.648   7.567   8.227
  295    HG3  ARG  45           1HG      ARG  45  -3.891   6.380   6.945
  296    HD2  ARG  45           2HD      ARG  45  -1.627   6.137   7.740
  297    HD3  ARG  45           1HD      ARG  45  -1.557   6.881   6.144
  298    HE   ARG  45           HE       ARG  45  -1.632   8.877   8.177
  299   HH11  ARG  45          1HH2      ARG  45   0.387   6.496   6.685
  300   HH12  ARG  45          2HH2      ARG  45   1.864   7.336   7.024
  301   HH21  ARG  45          1HH1      ARG  45   0.299   9.984   8.624
  302   HH22  ARG  45          2HH1      ARG  45   1.814   9.311   8.122
  303    H    ARG  46           H        ARG  46  -5.839   8.788   3.743
  304    HA   ARG  46           HA       ARG  46  -5.456  11.579   3.403
  305    HB2  ARG  46           2HB      ARG  46  -7.113   9.686   1.718
  306    HB3  ARG  46           1HB      ARG  46  -6.500  11.262   1.220
  307    HG2  ARG  46           2HG      ARG  46  -4.552   9.214   2.234
  308    HG3  ARG  46           1HG      ARG  46  -5.175   9.056   0.592
  309    HD2  ARG  46           2HD      ARG  46  -4.380  11.262   0.007
  310    HD3  ARG  46           1HD      ARG  46  -3.929  11.594   1.676
  311    HE   ARG  46           HE       ARG  46  -2.605   9.269   0.611
  312   HH11  ARG  46          1HH2      ARG  46  -2.620  12.725   0.796
  313   HH12  ARG  46          2HH2      ARG  46  -0.915  12.884   0.530
  314   HH21  ARG  46          1HH1      ARG  46  -0.368   9.471   0.262
  315   HH22  ARG  46          2HH1      ARG  46   0.358  11.042   0.227
  316    H    LEU  47           H        LEU  47  -8.371   9.593   3.849
  317    HA   LEU  47           HA       LEU  47 -10.314  11.560   3.580
  318    HB2  LEU  47           2HB      LEU  47 -10.179   9.081   5.292
  319    HB3  LEU  47           1HB      LEU  47 -11.604  10.121   5.280
  320    HG   LEU  47           HG       LEU  47 -11.739   9.868   2.810
  321   HD11  LEU  47          1HD1      LEU  47 -10.344   7.859   1.925
  322   HD12  LEU  47          2HD1      LEU  47  -9.313   8.150   3.324
  323   HD13  LEU  47          3HD1      LEU  47  -9.533   9.413   2.113
  324   HD21  LEU  47          3HD2      LEU  47 -12.878   8.304   4.492
  325   HD22  LEU  47          1HD2      LEU  47 -11.595   7.148   4.131
  326   HD23  LEU  47          2HD2      LEU  47 -12.691   7.678   2.854
  327    H    LYS  48           H        LYS  48  -8.174  10.873   6.276
  328    HA   LYS  48           HA       LYS  48  -9.501  12.446   8.226
  329    HB2  LYS  48           2HB      LYS  48  -7.665  10.707   8.598
  330    HB3  LYS  48           1HB      LYS  48  -6.524  11.963   8.116
  331    HG2  LYS  48           2HG      LYS  48  -7.288  13.414   9.914
  332    HG3  LYS  48           1HG      LYS  48  -8.553  12.266  10.349
  333    HD2  LYS  48           2HD      LYS  48  -6.692  10.562  10.731
  334    HD3  LYS  48           1HD      LYS  48  -5.561  11.910  10.610
  335    HE2  LYS  48           2HE      LYS  48  -6.628  13.040  12.480
  336    HE3  LYS  48           1HE      LYS  48  -7.888  11.807  12.550
  337    HZ1  LYS  48           3HZ      LYS  48  -6.577  10.716  13.945
  338    HZ2  LYS  48           1HZ      LYS  48  -5.277  11.770  13.673
  339    HZ3  LYS  48           2HZ      LYS  48  -5.512  10.431  12.653
  340    H    VAL  49           H        VAL  49  -7.830  13.312   5.417
  341    HA   VAL  49           HA       VAL  49  -6.649  15.759   6.274
  342    HB   VAL  49           HB       VAL  49  -6.172  14.400   4.140
  343   HG11  VAL  49          1HG1      VAL  49  -7.579  14.536   2.323
  344   HG12  VAL  49          2HG1      VAL  49  -8.183  16.130   2.768
  345   HG13  VAL  49          3HG1      VAL  49  -8.790  14.696   3.595
  346   HG21  VAL  49          3HG2      VAL  49  -6.154  17.296   4.628
  347   HG22  VAL  49          1HG2      VAL  49  -6.177  16.903   2.908
  348   HG23  VAL  49          2HG2      VAL  49  -4.898  16.269   3.941
  349    H    TYR  50           H        TYR  50  -7.783  17.428   4.134
  350    HA   TYR  50           HA       TYR  50  -9.748  18.796   5.609
  351    HB2  TYR  50           2HB      TYR  50  -8.717  18.922   2.807
  352    HB3  TYR  50           1HB      TYR  50 -10.230  19.752   3.163
  353    HD1  TYR  50           2HD      TYR  50  -7.253  19.223   5.368
  354    HD2  TYR  50           1HD      TYR  50  -9.662  22.041   3.198
  355    HE1  TYR  50           2HE      TYR  50  -5.991  21.092   6.395
  356    HE2  TYR  50           1HE      TYR  50  -8.400  23.911   4.226
  357    HH   TYR  50           HH       TYR  50  -5.653  23.292   6.406
  358    H    HIS  51           H        HIS  51 -11.139  16.947   6.176
  359    HA   HIS  51           HA       HIS  51 -12.643  15.450   4.365
  360    HB2  HIS  51           2HB      HIS  51 -14.204  15.084   6.202
  361    HB3  HIS  51           1HB      HIS  51 -12.548  15.024   6.808
  362    HD2  HIS  51           2HD      HIS  51 -15.669  17.437   6.979
  363    HE1  HIS  51           1HE      HIS  51 -12.794  18.770   9.768
  364    HE2  HIS  51           2HE      HIS  51 -15.161  19.112   8.917
  Start of MODEL   20
    1    H1   GLY   9           H        GLY   9   6.642 -15.279   3.236
    2    HA2  GLY   9           2HA      GLY   9   3.967 -16.060   4.037
    3    HA3  GLY   9           1HA      GLY   9   5.154 -15.216   5.027
    4    H    THR  10           H        THR  10   5.688 -13.068   3.245
    5    HA   THR  10           HA       THR  10   3.364 -11.728   2.363
    6    HB   THR  10           HB       THR  10   2.698 -11.584   4.669
    7    HG1  THR  10           1HG      THR  10   3.642  -9.116   4.772
    8   HG21  THR  10          3HG2      THR  10   5.457 -10.455   5.215
    9   HG22  THR  10          1HG2      THR  10   4.934 -12.088   5.630
   10   HG23  THR  10          2HG2      THR  10   4.175 -10.696   6.403
   11    H    LYS  11           H        LYS  11   3.860  -9.795   1.351
   12    HA   LYS  11           HA       LYS  11   6.660  -8.861   1.545
   13    HB2  LYS  11           2HB      LYS  11   5.051  -9.379  -0.964
   14    HB3  LYS  11           1HB      LYS  11   6.557  -8.461  -0.937
   15    HG2  LYS  11           2HG      LYS  11   7.697 -10.430   0.086
   16    HG3  LYS  11           1HG      LYS  11   6.197 -11.344  -0.068
   17    HD2  LYS  11           2HD      LYS  11   6.241 -10.913  -2.532
   18    HD3  LYS  11           1HD      LYS  11   7.811 -10.135  -2.331
   19    HE2  LYS  11           2HE      LYS  11   8.626 -12.284  -1.263
   20    HE3  LYS  11           1HE      LYS  11   7.108 -13.026  -1.766
   21    HZ1  LYS  11           3HZ      LYS  11   7.804 -13.171  -3.858
   22    HZ2  LYS  11           1HZ      LYS  11   9.360 -12.838  -3.274
   23    HZ3  LYS  11           2HZ      LYS  11   8.394 -11.577  -3.877
   24    H    LYS  12           H        LYS  12   6.450  -6.914   2.476
   25    HA   LYS  12           HA       LYS  12   4.175  -5.196   1.867
   26    HB2  LYS  12           2HB      LYS  12   5.414  -3.644   3.497
   27    HB3  LYS  12           1HB      LYS  12   4.775  -5.152   4.151
   28    HG2  LYS  12           2HG      LYS  12   7.554  -5.220   3.055
   29    HG3  LYS  12           1HG      LYS  12   7.316  -4.374   4.584
   30    HD2  LYS  12           2HD      LYS  12   6.099  -7.100   4.225
   31    HD3  LYS  12           1HD      LYS  12   7.823  -6.967   4.573
   32    HE2  LYS  12           2HE      LYS  12   5.765  -5.507   6.231
   33    HE3  LYS  12           1HE      LYS  12   6.230  -7.169   6.592
   34    HZ1  LYS  12           3HZ      LYS  12   8.495  -6.497   6.843
   35    HZ2  LYS  12           1HZ      LYS  12   7.536  -5.491   7.814
   36    HZ3  LYS  12           2HZ      LYS  12   8.143  -4.913   6.337
   37    H    TYR  13           H        TYR  13   5.046  -2.707   1.828
   38    HA   TYR  13           HA       TYR  13   7.279  -2.395  -0.020
   39    HB2  TYR  13           2HB      TYR  13   4.628  -1.258  -0.872
   40    HB3  TYR  13           1HB      TYR  13   6.076  -1.546  -1.838
   41    HD1  TYR  13           2HD      TYR  13   6.708  -3.857  -2.501
   42    HD2  TYR  13           1HD      TYR  13   3.032  -3.009  -0.446
   43    HE1  TYR  13           2HE      TYR  13   5.835  -6.088  -3.142
   44    HE2  TYR  13           1HE      TYR  13   2.159  -5.241  -1.088
   45    HH   TYR  13           HH       TYR  13   4.105  -7.708  -2.257
   46    H    ASP  14           H        ASP  14   7.848  -0.141  -0.352
   47    HA   ASP  14           HA       ASP  14   7.155   1.487   1.993
   48    HB2  ASP  14           2HB      ASP  14   9.093   2.898   1.157
   49    HB3  ASP  14           1HB      ASP  14   9.506   1.267   1.682
   50    H    LEU  15           H        LEU  15   5.428   2.750   1.701
   51    HA   LEU  15           HA       LEU  15   5.030   4.059  -0.918
   52    HB2  LEU  15           2HB      LEU  15   2.991   4.018   1.294
   53    HB3  LEU  15           1HB      LEU  15   2.740   4.170  -0.445
   54    HG   LEU  15           HG       LEU  15   3.719   1.677   0.982
   55   HD11  LEU  15          1HD1      LEU  15   1.555   0.765   0.586
   56   HD12  LEU  15          2HD1      LEU  15   1.110   2.090  -0.488
   57   HD13  LEU  15          3HD1      LEU  15   1.265   2.374   1.245
   58   HD21  LEU  15          3HD2      LEU  15   4.663   1.795  -1.250
   59   HD22  LEU  15          1HD2      LEU  15   3.108   2.277  -1.929
   60   HD23  LEU  15          2HD2      LEU  15   3.325   0.648  -1.291
   61    H    SER  16           H        SER  16   7.037   5.030   0.814
   62    HA   SER  16           HA       SER  16   6.545   6.973   2.628
   63    HB2  SER  16           2HB      SER  16   8.801   6.519   1.911
   64    HB3  SER  16           1HB      SER  16   8.455   7.107   0.287
   65    HG   SER  16           HG       SER  16   7.743   9.037   1.873
   66    H    LYS  17           H        LYS  17   6.012   7.236  -0.855
   67    HA   LYS  17           HA       LYS  17   4.174   9.446  -0.408
   68    HB2  LYS  17           2HB      LYS  17   5.286  10.935  -2.024
   69    HB3  LYS  17           1HB      LYS  17   6.317  10.616  -0.632
   70    HG2  LYS  17           2HG      LYS  17   7.898  10.098  -2.195
   71    HG3  LYS  17           1HG      LYS  17   7.042   8.561  -2.299
   72    HD2  LYS  17           2HD      LYS  17   7.112   9.219  -4.541
   73    HD3  LYS  17           1HD      LYS  17   5.535   9.827  -4.045
   74    HE2  LYS  17           2HE      LYS  17   6.522  12.052  -3.625
   75    HE3  LYS  17           1HE      LYS  17   8.102  11.444  -4.121
   76    HZ1  LYS  17           3HZ      LYS  17   7.108  12.534  -5.971
   77    HZ2  LYS  17           1HZ      LYS  17   5.661  11.666  -5.794
   78    HZ3  LYS  17           2HZ      LYS  17   7.077  10.865  -6.287
   79    H    TRP  18           H        TRP  18   2.495   9.275  -1.749
   80    HA   TRP  18           HA       TRP  18   2.838   7.934  -4.350
   81    HB2  TRP  18           2HB      TRP  18   1.130   7.050  -2.067
   82    HB3  TRP  18           1HB      TRP  18   0.451   6.916  -3.685
   83    HD1  TRP  18           HD       TRP  18   3.756   5.973  -1.891
   84    HE1  TRP  18           1HE      TRP  18   4.573   3.729  -2.857
   85    HE3  TRP  18           3HE      TRP  18   0.149   5.163  -5.416
   86    HZ2  TRP  18           2HZ      TRP  18   3.797   1.835  -4.856
   87    HZ3  TRP  18           3HZ      TRP  18   0.210   3.132  -6.833
   88    HH2  TRP  18           HH       TRP  18   2.028   1.467  -6.558
   89    H    LYS  19           H        LYS  19   0.839   8.221  -5.722
   90    HA   LYS  19           HA       LYS  19  -0.168  10.969  -5.365
   91    HB2  LYS  19           2HB      LYS  19   0.119   9.174  -7.775
   92    HB3  LYS  19           1HB      LYS  19  -0.845  10.649  -7.815
   93    HG2  LYS  19           2HG      LYS  19   1.355  11.226  -8.599
   94    HG3  LYS  19           1HG      LYS  19   1.194  11.895  -6.977
   95    HD2  LYS  19           2HD      LYS  19   2.577  10.244  -6.023
   96    HD3  LYS  19           1HD      LYS  19   2.378   9.151  -7.395
   97    HE2  LYS  19           2HE      LYS  19   3.737  11.841  -7.644
   98    HE3  LYS  19           1HE      LYS  19   4.620  10.366  -7.257
   99    HZ1  LYS  19           3HZ      LYS  19   3.125   9.610  -9.362
  100    HZ2  LYS  19           1HZ      LYS  19   4.738  10.128  -9.461
  101    HZ3  LYS  19           2HZ      LYS  19   3.474  11.224  -9.759
  102    H    TYR  20           H        TYR  20  -2.355  11.443  -5.477
  103    HA   TYR  20           HA       TYR  20  -4.156   9.620  -4.358
  104    HB2  TYR  20           2HB      TYR  20  -4.465  12.075  -4.338
  105    HB3  TYR  20           1HB      TYR  20  -4.802  12.031  -6.069
  106    HD1  TYR  20           2HD      TYR  20  -5.982  10.841  -2.749
  107    HD2  TYR  20           1HD      TYR  20  -6.935  11.362  -6.905
  108    HE1  TYR  20           2HE      TYR  20  -8.351  10.282  -2.276
  109    HE2  TYR  20           1HE      TYR  20  -9.304  10.802  -6.432
  110    HH   TYR  20           HH       TYR  20 -10.846  10.652  -4.703
  111    H    ALA  21           H        ALA  21  -3.317  10.256  -7.698
  112    HA   ALA  21           HA       ALA  21  -5.534   8.758  -8.788
  113    HB1  ALA  21           1HB      ALA  21  -4.594   9.232 -10.917
  114    HB2  ALA  21           2HB      ALA  21  -2.996   9.522 -10.231
  115    HB3  ALA  21           3HB      ALA  21  -4.301  10.673  -9.942
  116    H    GLU  22           H        GLU  22  -2.047   8.218  -8.349
  117    HA   GLU  22           HA       GLU  22  -1.888   5.691  -9.553
  118    HB2  GLU  22           2HB      GLU  22  -0.295   6.923  -7.300
  119    HB3  GLU  22           1HB      GLU  22   0.114   5.377  -8.045
  120    HG2  GLU  22           2HG      GLU  22  -0.276   7.884  -9.685
  121    HG3  GLU  22           1HG      GLU  22   1.287   7.457  -8.993
  122    H    LEU  23           H        LEU  23  -2.667   6.617  -6.221
  123    HA   LEU  23           HA       LEU  23  -2.795   3.993  -5.167
  124    HB2  LEU  23           2HB      LEU  23  -4.214   6.516  -4.282
  125    HB3  LEU  23           1HB      LEU  23  -4.084   5.039  -3.326
  126    HG   LEU  23           HG       LEU  23  -1.627   6.413  -4.408
  127   HD11  LEU  23          1HD1      LEU  23  -2.972   6.949  -1.743
  128   HD12  LEU  23          2HD1      LEU  23  -2.927   8.076  -3.099
  129   HD13  LEU  23          3HD1      LEU  23  -1.433   7.620  -2.282
  130   HD21  LEU  23          3HD2      LEU  23  -2.215   4.506  -2.125
  131   HD22  LEU  23          1HD2      LEU  23  -0.665   5.323  -2.321
  132   HD23  LEU  23          2HD2      LEU  23  -1.228   4.198  -3.554
  133    H    ARG  24           H        ARG  24  -5.375   6.182  -6.303
  134    HA   ARG  24           HA       ARG  24  -7.455   4.262  -5.999
  135    HB2  ARG  24           2HB      ARG  24  -7.714   6.791  -6.158
  136    HB3  ARG  24           1HB      ARG  24  -7.470   6.613  -7.896
  137    HG2  ARG  24           2HG      ARG  24  -9.783   6.458  -7.798
  138    HG3  ARG  24           1HG      ARG  24  -9.356   4.755  -7.634
  139    HD2  ARG  24           2HD      ARG  24  -9.296   5.301  -5.065
  140    HD3  ARG  24           1HD      ARG  24 -10.282   6.687  -5.524
  141    HE   ARG  24           HE       ARG  24 -11.145   3.961  -5.402
  142   HH11  ARG  24          1HH2      ARG  24 -11.483   6.950  -7.111
  143   HH12  ARG  24          2HH2      ARG  24 -13.101   6.625  -7.638
  144   HH21  ARG  24          1HH1      ARG  24 -13.264   3.527  -6.090
  145   HH22  ARG  24          2HH1      ARG  24 -14.108   4.686  -7.060
  146    H    ASP  25           H        ASP  25  -5.203   5.031  -8.561
  147    HA   ASP  25           HA       ASP  25  -6.581   3.564 -10.611
  148    HB2  ASP  25           2HB      ASP  25  -5.043   5.373 -11.191
  149    HB3  ASP  25           1HB      ASP  25  -3.708   4.502 -10.435
  150    H    THR  26           H        THR  26  -3.723   2.925  -8.580
  151    HA   THR  26           HA       THR  26  -3.038   0.418  -9.558
  152    HB   THR  26           HB       THR  26  -2.904   1.363  -6.684
  153    HG1  THR  26           1HG      THR  26  -1.471   2.660  -7.460
  154   HG21  THR  26          3HG2      THR  26  -0.962  -0.241  -6.624
  155   HG22  THR  26          1HG2      THR  26  -1.475  -0.829  -8.207
  156   HG23  THR  26          2HG2      THR  26  -2.534  -1.020  -6.810
  157    H    ILE  27           H        ILE  27  -5.400   1.262  -7.043
  158    HA   ILE  27           HA       ILE  27  -6.120  -1.431  -6.442
  159    HB   ILE  27           HB       ILE  27  -7.596   1.174  -5.994
  160   HG12  ILE  27          2HG1      ILE  27  -6.071  -0.559  -4.031
  161   HG13  ILE  27          1HG1      ILE  27  -5.336   0.804  -4.875
  162   HG21  ILE  27          1HG2      ILE  27  -8.724  -0.319  -4.188
  163   HG22  ILE  27          2HG2      ILE  27  -8.166  -1.672  -5.173
  164   HG23  ILE  27          3HG2      ILE  27  -9.270  -0.481  -5.858
  165   HD11  ILE  27          3HD1      ILE  27  -6.795   2.371  -3.845
  166   HD12  ILE  27          1HD1      ILE  27  -6.311   1.283  -2.543
  167   HD13  ILE  27          2HD1      ILE  27  -7.895   1.106  -3.297
  168    H    ASN  28           H        ASN  28  -7.165   0.912  -8.817
  169    HA   ASN  28           HA       ASN  28  -9.404  -0.796  -9.654
  170    HB2  ASN  28           2HB      ASN  28  -8.532   1.983 -10.468
  171    HB3  ASN  28           1HB      ASN  28  -9.867   1.117 -11.228
  172   HD21  ASN  28          1HD2      ASN  28  -8.782   1.751  -7.833
  173   HD22  ASN  28          2HD2      ASN  28 -10.329   2.164  -7.272
  174    H    THR  29           H        THR  29  -6.451  -1.390 -10.037
  175    HA   THR  29           HA       THR  29  -6.677  -2.153 -12.853
  176    HB   THR  29           HB       THR  29  -4.318  -1.347 -13.264
  177    HG1  THR  29           1HG      THR  29  -3.584  -0.962 -11.240
  178   HG21  THR  29          3HG2      THR  29  -6.385  -0.161 -14.054
  179   HG22  THR  29          1HG2      THR  29  -5.013   0.913 -13.784
  180   HG23  THR  29          2HG2      THR  29  -6.313   0.830 -12.596
  181    H    SER  30           H        SER  30  -4.441  -2.120 -10.068
  182    HA   SER  30           HA       SER  30  -3.410  -4.742 -10.776
  183    HB2  SER  30           2HB      SER  30  -2.146  -2.729  -9.659
  184    HB3  SER  30           1HB      SER  30  -2.832  -3.374  -8.170
  185    HG   SER  30           HG       SER  30  -1.944  -5.447  -8.908
  186    H    CYS  31           H        CYS  31  -3.139  -6.243  -8.708
  187    HA   CYS  31           HA       CYS  31  -5.456  -6.294  -6.975
  188    HB2  CYS  31           2HB      CYS  31  -6.395  -8.356  -7.755
  189    HB3  CYS  31           1HB      CYS  31  -6.259  -7.290  -9.153
  190    HG   CYS  31           HG       CYS  31  -4.054  -8.608  -9.821
  191    H    ASP  32           H        ASP  32  -4.770  -7.009  -5.073
  192    HA   ASP  32           HA       ASP  32  -3.249  -9.370  -4.705
  193    HB2  ASP  32           2HB      ASP  32  -1.568  -7.506  -5.577
  194    HB3  ASP  32           1HB      ASP  32  -1.623  -6.994  -3.891
  195    H    ILE  33           H        ILE  33  -2.878  -9.838  -2.459
  196    HA   ILE  33           HA       ILE  33  -4.830  -8.553  -0.736
  197    HB   ILE  33           HB       ILE  33  -2.904 -10.816  -0.150
  198   HG12  ILE  33          2HG1      ILE  33  -5.848 -10.968  -0.848
  199   HG13  ILE  33          1HG1      ILE  33  -4.568 -11.175  -2.044
  200   HG21  ILE  33          1HG2      ILE  33  -5.246  -9.600   1.313
  201   HG22  ILE  33          2HG2      ILE  33  -3.641  -9.984   1.932
  202   HG23  ILE  33          3HG2      ILE  33  -4.784 -11.281   1.584
  203   HD11  ILE  33          3HD1      ILE  33  -3.690 -13.094  -0.887
  204   HD12  ILE  33          1HD1      ILE  33  -5.430 -13.333  -1.040
  205   HD13  ILE  33          2HD1      ILE  33  -4.744 -12.810   0.498
  206    H    GLU  34           H        GLU  34  -1.670  -7.941  -1.553
  207    HA   GLU  34           HA       GLU  34  -0.967  -6.876   1.111
  208    HB2  GLU  34           2HB      GLU  34   0.838  -7.160  -1.297
  209    HB3  GLU  34           1HB      GLU  34   1.311  -6.869   0.378
  210    HG2  GLU  34           2HG      GLU  34  -0.021  -9.372  -0.695
  211    HG3  GLU  34           1HG      GLU  34   1.656  -9.227  -0.172
  212    H    LEU  35           H        LEU  35  -0.565  -5.945  -2.321
  213    HA   LEU  35           HA       LEU  35  -0.034  -3.247  -1.903
  214    HB2  LEU  35           2HB      LEU  35  -1.299  -4.734  -4.192
  215    HB3  LEU  35           1HB      LEU  35  -1.092  -2.988  -4.253
  216    HG   LEU  35           HG       LEU  35   1.162  -4.934  -3.682
  217   HD11  LEU  35          1HD1      LEU  35   1.840  -4.668  -5.980
  218   HD12  LEU  35          2HD1      LEU  35   0.578  -3.471  -6.270
  219   HD13  LEU  35          3HD1      LEU  35   0.145  -5.156  -5.985
  220   HD21  LEU  35          3HD2      LEU  35   2.355  -2.705  -4.605
  221   HD22  LEU  35          1HD2      LEU  35   1.978  -2.918  -2.897
  222   HD23  LEU  35          2HD2      LEU  35   0.909  -1.961  -3.923
  223    H    LEU  36           H        LEU  36  -3.191  -4.777  -2.557
  224    HA   LEU  36           HA       LEU  36  -4.759  -2.469  -2.426
  225    HB2  LEU  36           2HB      LEU  36  -5.484  -5.283  -1.569
  226    HB3  LEU  36           1HB      LEU  36  -6.632  -3.987  -1.899
  227    HG   LEU  36           HG       LEU  36  -4.650  -5.119  -3.897
  228   HD11  LEU  36          1HD1      LEU  36  -6.497  -6.234  -4.908
  229   HD12  LEU  36          2HD1      LEU  36  -7.665  -5.346  -3.932
  230   HD13  LEU  36          3HD1      LEU  36  -6.641  -6.572  -3.185
  231   HD21  LEU  36          3HD2      LEU  36  -6.597  -2.836  -3.928
  232   HD22  LEU  36          1HD2      LEU  36  -6.360  -3.759  -5.413
  233   HD23  LEU  36          2HD2      LEU  36  -4.993  -2.947  -4.652
  234    H    ALA  37           H        ALA  37  -3.889  -4.745   0.171
  235    HA   ALA  37           HA       ALA  37  -5.254  -3.347   2.228
  236    HB1  ALA  37           1HB      ALA  37  -2.935  -5.288   2.314
  237    HB2  ALA  37           2HB      ALA  37  -4.642  -5.650   2.575
  238    HB3  ALA  37           3HB      ALA  37  -3.755  -4.677   3.750
  239    H    ALA  38           H        ALA  38  -2.050  -3.062   0.829
  240    HA   ALA  38           HA       ALA  38  -1.021  -1.320   2.872
  241    HB1  ALA  38           1HB      ALA  38   0.075  -1.460   0.077
  242    HB2  ALA  38           2HB      ALA  38   0.279  -2.817   1.183
  243    HB3  ALA  38           3HB      ALA  38   0.937  -1.235   1.599
  244    H    CYS  39           H        CYS  39  -2.434  -0.884  -0.344
  245    HA   CYS  39           HA       CYS  39  -2.054   1.948  -0.421
  246    HB2  CYS  39           2HB      CYS  39  -2.325   0.660  -2.476
  247    HB3  CYS  39           1HB      CYS  39  -3.940   0.159  -1.973
  248    HG   CYS  39           HG       CYS  39  -4.365   2.229  -3.430
  249    H    ARG  40           H        ARG  40  -4.788  -0.159   0.413
  250    HA   ARG  40           HA       ARG  40  -6.699   1.873   0.809
  251    HB2  ARG  40           2HB      ARG  40  -6.427  -0.933   1.872
  252    HB3  ARG  40           1HB      ARG  40  -7.782   0.101   2.322
  253    HG2  ARG  40           2HG      ARG  40  -8.580   0.232   0.106
  254    HG3  ARG  40           1HG      ARG  40  -7.042  -0.302  -0.574
  255    HD2  ARG  40           2HD      ARG  40  -7.395  -2.540   0.068
  256    HD3  ARG  40           1HD      ARG  40  -8.633  -2.106   1.242
  257    HE   ARG  40           HE       ARG  40  -9.003  -2.461  -1.617
  258   HH11  ARG  40          1HH2      ARG  40 -10.177  -1.116   1.347
  259   HH12  ARG  40          2HH2      ARG  40 -11.822  -1.023   0.813
  260   HH21  ARG  40          1HH1      ARG  40 -11.159  -2.341  -2.323
  261   HH22  ARG  40          2HH1      ARG  40 -12.379  -1.717  -1.264
  262    H    GLU  41           H        GLU  41  -4.186   0.576   2.893
  263    HA   GLU  41           HA       GLU  41  -5.105   1.615   5.350
  264    HB2  GLU  41           2HB      GLU  41  -2.429   0.775   4.284
  265    HB3  GLU  41           1HB      GLU  41  -2.523   1.593   5.843
  266    HG2  GLU  41           2HG      GLU  41  -3.876  -0.105   6.783
  267    HG3  GLU  41           1HG      GLU  41  -4.287  -0.771   5.204
  268    H    GLU  42           H        GLU  42  -2.747   2.967   3.027
  269    HA   GLU  42           HA       GLU  42  -2.477   5.434   4.441
  270    HB2  GLU  42           2HB      GLU  42  -1.365   6.212   2.339
  271    HB3  GLU  42           1HB      GLU  42  -0.698   4.706   2.973
  272    HG2  GLU  42           2HG      GLU  42  -2.035   3.411   1.388
  273    HG3  GLU  42           1HG      GLU  42  -2.791   4.885   0.786
  274    H    PHE  43           H        PHE  43  -4.596   4.257   1.914
  275    HA   PHE  43           HA       PHE  43  -5.589   6.691   0.939
  276    HB2  PHE  43           2HB      PHE  43  -6.024   4.356   0.025
  277    HB3  PHE  43           1HB      PHE  43  -7.232   4.181   1.299
  278    HD1  PHE  43           2HD      PHE  43  -9.148   5.830   1.421
  279    HD2  PHE  43           1HD      PHE  43  -6.476   5.629  -1.937
  280    HE1  PHE  43           2HE      PHE  43 -10.786   7.080   0.040
  281    HE2  PHE  43           1HE      PHE  43  -8.114   6.879  -3.316
  282    HZ   PHE  43           HZ       PHE  43 -10.270   7.604  -2.327
  283    H    HIS  44           H        HIS  44  -6.339   4.873   3.842
  284    HA   HIS  44           HA       HIS  44  -8.722   6.224   4.554
  285    HB2  HIS  44           2HB      HIS  44  -7.673   4.045   5.522
  286    HB3  HIS  44           1HB      HIS  44  -6.784   5.137   6.583
  287    HD2  HIS  44           2HD      HIS  44  -9.883   7.036   6.390
  288    HE1  HIS  44           1HE      HIS  44 -10.854   4.035   9.196
  289    HE2  HIS  44           2HE      HIS  44 -11.559   6.281   8.242
  290    H    ARG  45           H        ARG  45  -5.308   6.832   5.272
  291    HA   ARG  45           HA       ARG  45  -5.645   8.926   7.114
  292    HB2  ARG  45           2HB      ARG  45  -3.409   8.585   5.100
  293    HB3  ARG  45           1HB      ARG  45  -3.345   9.529   6.589
  294    HG2  ARG  45           2HG      ARG  45  -3.754   7.471   7.904
  295    HG3  ARG  45           1HG      ARG  45  -3.780   6.533   6.410
  296    HD2  ARG  45           2HD      ARG  45  -1.472   7.134   5.936
  297    HD3  ARG  45           1HD      ARG  45  -1.431   8.216   7.326
  298    HE   ARG  45           HE       ARG  45  -2.090   5.478   7.996
  299   HH11  ARG  45          1HH2      ARG  45   0.404   7.808   7.423
  300   HH12  ARG  45          2HH2      ARG  45   1.589   6.978   8.376
  301   HH21  ARG  45          1HH1      ARG  45  -0.543   4.386   9.249
  302   HH22  ARG  45          2HH1      ARG  45   1.053   5.041   9.410
  303    H    ARG  46           H        ARG  46  -5.745   8.870   3.603
  304    HA   ARG  46           HA       ARG  46  -5.486  11.599   3.054
  305    HB2  ARG  46           2HB      ARG  46  -7.334   9.683   1.614
  306    HB3  ARG  46           1HB      ARG  46  -6.594  11.143   0.963
  307    HG2  ARG  46           2HG      ARG  46  -4.957   8.822   2.011
  308    HG3  ARG  46           1HG      ARG  46  -5.460   8.945   0.326
  309    HD2  ARG  46           2HD      ARG  46  -4.385  11.246   0.288
  310    HD3  ARG  46           1HD      ARG  46  -3.698  10.865   1.863
  311    HE   ARG  46           HE       ARG  46  -2.941   8.742   0.350
  312   HH11  ARG  46          1HH2      ARG  46  -2.795  12.175  -0.056
  313   HH12  ARG  46          2HH2      ARG  46  -1.345  12.140  -1.002
  314   HH21  ARG  46          1HH1      ARG  46  -1.037   8.689  -0.888
  315   HH22  ARG  46          2HH1      ARG  46  -0.350  10.167  -1.474
  316    H    LEU  47           H        LEU  47  -8.229   9.746   4.229
  317    HA   LEU  47           HA       LEU  47 -10.136  11.877   3.898
  318    HB2  LEU  47           2HB      LEU  47 -10.159   9.225   5.328
  319    HB3  LEU  47           1HB      LEU  47 -11.489  10.370   5.506
  320    HG   LEU  47           HG       LEU  47 -11.898  10.361   3.119
  321   HD11  LEU  47          1HD1      LEU  47 -10.506   8.701   1.718
  322   HD12  LEU  47          2HD1      LEU  47  -9.347   8.744   3.048
  323   HD13  LEU  47          3HD1      LEU  47  -9.730  10.222   2.163
  324   HD21  LEU  47          3HD2      LEU  47 -11.435   7.500   4.017
  325   HD22  LEU  47          1HD2      LEU  47 -12.608   8.060   2.825
  326   HD23  LEU  47          2HD2      LEU  47 -12.812   8.481   4.525
  327    H    LYS  48           H        LYS  48  -7.775  11.009   6.256
  328    HA   LYS  48           HA       LYS  48  -8.974  12.350   8.490
  329    HB2  LYS  48           2HB      LYS  48  -7.048  10.521   8.356
  330    HB3  LYS  48           1HB      LYS  48  -6.013  11.945   8.303
  331    HG2  LYS  48           2HG      LYS  48  -8.111  11.386  10.424
  332    HG3  LYS  48           1HG      LYS  48  -6.372  11.170  10.628
  333    HD2  LYS  48           2HD      LYS  48  -6.165  13.649   9.945
  334    HD3  LYS  48           1HD      LYS  48  -7.903  13.744  10.235
  335    HE2  LYS  48           2HE      LYS  48  -7.559  12.902  12.535
  336    HE3  LYS  48           1HE      LYS  48  -5.820  12.843  12.246
  337    HZ1  LYS  48           3HZ      LYS  48  -6.175  14.880  13.286
  338    HZ2  LYS  48           1HZ      LYS  48  -7.580  15.211  12.397
  339    HZ3  LYS  48           2HZ      LYS  48  -6.061  15.285  11.640
  340    H    VAL  49           H        VAL  49  -6.136  13.147   6.465
  341    HA   VAL  49           HA       VAL  49  -5.556  15.654   7.404
  342    HB   VAL  49           HB       VAL  49  -5.514  14.688   4.536
  343   HG11  VAL  49          1HG1      VAL  49  -5.401  17.070   4.440
  344   HG12  VAL  49          2HG1      VAL  49  -3.731  16.515   4.351
  345   HG13  VAL  49          3HG1      VAL  49  -4.369  17.150   5.868
  346   HG21  VAL  49          3HG2      VAL  49  -4.113  13.328   5.948
  347   HG22  VAL  49          1HG2      VAL  49  -3.481  14.748   6.782
  348   HG23  VAL  49          2HG2      VAL  49  -3.052  14.450   5.097
  349    H    TYR  50           H        TYR  50  -6.629  17.501   7.563
  350    HA   TYR  50           HA       TYR  50  -9.283  17.842   6.693
  351    HB2  TYR  50           2HB      TYR  50  -7.550  20.233   7.180
  352    HB3  TYR  50           1HB      TYR  50  -9.192  19.905   7.732
  353    HD1  TYR  50           1HD      TYR  50  -8.829  17.151   8.856
  354    HD2  TYR  50           2HD      TYR  50  -6.396  20.675   9.202
  355    HE1  TYR  50           1HE      TYR  50  -7.935  16.321  11.013
  356    HE2  TYR  50           2HE      TYR  50  -5.503  19.845  11.363
  357    HH   TYR  50           HH       TYR  50  -5.266  17.261  12.380
  358    H    HIS  51           H        HIS  51  -9.354  17.356   4.469
  359    HA   HIS  51           HA       HIS  51  -7.805  18.902   2.578
  360    HB2  HIS  51           2HB      HIS  51  -8.525  16.519   2.197
  361    HB3  HIS  51           1HB      HIS  51 -10.178  17.109   2.030
  362    HD2  HIS  51           2HD      HIS  51  -8.314  19.834   0.402
  363    HE1  HIS  51           1HE      HIS  51  -8.664  16.954  -2.664
  364    HE2  HIS  51           2HE      HIS  51  -8.108  19.380  -2.160