*HEADER    PROTEIN BINDING                         24-NOV-08   2KB9              
*TITLE     HUMAN JAGGED-1, EXON 6                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: JAGGED-1;                                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 252-295;                                          
*COMPND   5 SYNONYM: JAGGED1, HJ1;                                               
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PROTEIN IS NATURALLY FOUND IN HOMO                
*SOURCE   4 SAPIENS (HUMAN). THE PROTEIN INCLUDES THE C-TERMINAL PART            
*SOURCE   5 OF THE EGF1 DOMAIN AND THE ENTIRE EGF2 DOMAIN.                       
*KEYWDS    NOTCH SIGNALING, EGF, CALCIUM, DEVELOPMENTAL PROTEIN,                 
*KEYWDS   2 DISEASE MUTATION, EGF-LIKE DOMAIN, GLYCOPROTEIN, MEMBRANE,           
*KEYWDS   3 NOTCH SIGNALING PATHWAY, POLYMORPHISM, TRANSMEMBRANE,                
*KEYWDS   4 PROTEIN BINDING                                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.PINTAR, C.GUARNACCIA, S.PONGOR                                      
*REVDAT   1   28-JUL-09 2KB9    0                                                


  4 TYR  HA      5 GLY  H       3.49            #peak     4 #SUP  1.00
 25 CYSS HB2    27 GLU  H       3.76            #peak    11 #SUP  0.99  #QF  0.98
 35 THR  H      35 THR  HA      2.94            #peak    35 #SUP  0.96  #QF  0.96
 35 THR  HB     36 ASN  H       3.40            #peak    40 #SUP  0.97  #QF  0.34
 43 ASP  HA     44 LYS  H       3.49            #peak    41 #SUP  0.99  #QF  0.96
 42 CYSS H      42 CYSS HA      2.83            #peak    42 #SUP  0.87  #QF  0.87
 32 LEU  H      32 LEU  HB2     3.82            #peak    57 #SUP  0.97  #QF  0.97
 31 CYSS H      31 CYSS HB3     4.17            #peak    61 #SUP  0.73  #QF  0.73
 31 CYSS H      31 CYSS HB2     4.17            #peak    62 #SUP  0.98  #QF  0.98
 14 CYSS HA     29 TRP  H       5.43            #peak    63 #SUP  0.99  #QF  0.71
 21 VAL  H      41 LEU  HB3     4.13            #peak    67 #SUP  0.88  #QF  0.39
 21 VAL  H      21 VAL  HB      3.41            #peak    68 #SUP  0.96  #QF  0.96
 41 LEU  H      41 LEU  HB2     3.32            #peak    69 #SUP  0.97  #QF  0.97
 41 LEU  H      41 LEU  HG      3.33            #peak    70 #SUP  0.98  #QF  0.98
 21 VAL  H      21 VAL  QG2     3.27            #peak    71 #SUP  0.95  #QF  0.95
 41 LEU  H      41 LEU  QD1     3.85            #peak    72 #SUP  0.99  #QF  0.99
 41 LEU  H      41 LEU  QD2     3.71            #peak    73 #SUP  1.00
 21 VAL  H      21 VAL  QG1     4.18            #peak    74 #SUP  1.00
 44 LYS  H      44 LYS  QB      3.89            #peak    77 #SUP  0.92  #QF  0.92
 44 LYS  H      44 LYS  QG      3.49            #peak    78 #SUP  0.87  #QF  0.87
 44 LYS  H      44 LYS  HD3     4.15            #peak    79 #SUP  0.76  #QF  0.76
 44 LYS  H      44 LYS  HD2     4.15            #peak    80 #SUP  0.93  #QF  0.93
 40 GLN  H      40 GLN  HG3     4.62            #peak    87 #SUP  0.64  #QF  0.64
 40 GLN  H      40 GLN  HG2     4.62            #peak    88 #SUP  0.95  #QF  0.95
 40 GLN  H      40 GLN  HB3     3.54            #peak    89 #SUP  0.86  #QF  0.86
 40 GLN  H      40 GLN  HB2     3.54            #peak    90 #SUP  0.76  #QF  0.76
  4 TYR  H       4 TYR  HB2     3.82            #peak    93 #SUP  0.85  #QF  0.85
 13 LYS  H      13 LYS  QB      3.23            #peak    94 #SUP  0.85  #QF  0.85
 13 LYS  H      13 LYS  QG      3.94            #peak    95 #SUP  0.91  #QF  0.91
 34 GLU  H      34 GLU  HG3     4.68            #peak    97 #SUP  0.58  #QF  0.58
 34 GLU  H      34 GLU  HB2     3.50            #peak    98 #SUP  0.87  #QF  0.87
 26 ASN  H      26 ASN  QB      3.27            #peak    99 #SUP  0.68  #QF  0.68
 34 GLU  H      34 GLU  HB3     3.50            #peak   100 #SUP  0.47  #QF  0.47
  9 LEU  H       9 LEU  HB2     3.37            #peak   105 #SUP  0.88  #QF  0.88
 14 CYSS H      14 CYSS HB2     3.86            #peak   106 #SUP  0.91  #QF  0.91
 35 THR  H      35 THR  HB      3.05            #peak   111 #SUP  0.65  #QF  0.65
 35 THR  H      35 THR  QG2     3.86            #peak   112 #SUP  0.76  #QF  0.76
 24 ILE  H      24 ILE  HB      4.18            #peak   117 #SUP  0.92  #QF  0.92
 24 ILE  H      24 ILE  QG2     3.62            #peak   119 #SUP  0.97  #QF  0.97
 37 TRP  H      37 TRP  HB2     3.13            #peak   121 #SUP  0.88  #QF  0.88
 37 TRP  H      37 TRP  HB3     3.81            #peak   122 #SUP  0.75  #QF  0.75
 20 CYSS H      20 CYSS HB2     3.68            #peak   123 #SUP  0.94  #QF  0.94
 27 GLU  H      27 GLU  HG3     4.47            #peak   124 #SUP  0.83  #QF  0.83
 27 GLU  H      27 GLU  QB      4.07            #peak   125 #SUP  0.97  #QF  0.97
 27 GLU  H      27 GLU  HG2     4.84            #peak   126 #SUP  0.93  #QF  0.93
 20 CYSS H      20 CYSS HB3     3.68            #peak   127 #SUP  0.85  #QF  0.85
 26 ASN  QB     27 GLU  H       4.28            #peak   128 #SUP  0.72  #QF  0.56
  6 TRP  H       6 TRP  QB      3.57            #peak   129 #SUP  0.91  #QF  0.91
 22 HIS  H      22 HIS  HB2     3.67            #peak   136 #SUP  0.85  #QF  0.85
 30 GLN  H      30 GLN  HG2     4.58            #peak   138 #SUP  0.86  #QF  0.86
 30 GLN  H      30 GLN  HB3     4.03            #peak   139 #SUP  0.64  #QF  0.64
 15 ILE  H      15 ILE  QG1     3.45            #peak   141 #SUP  0.96  #QF  0.96
 15 ILE  H      15 ILE  HB      3.89            #peak   142 #SUP  0.92  #QF  0.92
  9 LEU  H       9 LEU  HB3     3.37            #peak   145 #SUP  0.90  #QF  0.90
  4 TYR  H       4 TYR  HB3     3.82            #peak   146 #SUP  0.87  #QF  0.82
 24 ILE  H      32 LEU  HG      5.50            #peak   154 #SUP  0.80  #QF  0.80
  9 LEU  H       9 LEU  HG      4.56            #peak   161 #SUP  0.70  #QF  0.70
  9 LEU  H       9 LEU  QD2     4.57            #peak   162 #SUP  1.00
  9 LEU  H       9 LEU  QD1     4.57            #peak   163 #SUP  0.99  #QF  0.99
 25 CYSS HA     26 ASN  H       2.86            #peak   174 #SUP  0.78  #QF  0.78
 33 CYSS HA     34 GLU  H       3.23            #peak   175 #SUP  0.67  #QF  0.31
 25 CYSS HB2    26 ASN  H       3.60            #peak   178 #SUP  0.84  #QF  0.84
 34 GLU  H      37 TRP  HB2     4.54            #peak   180 #SUP  0.79  #QF  0.79
 25 CYSS HB3    26 ASN  H       4.10            #peak   181 #SUP  0.83  #QF  0.83
 34 GLU  H      34 GLU  HG2     4.68            #peak   182 #SUP  0.88  #QF  0.88
 26 ASN  H      27 GLU  QB      3.85            #peak   183 #SUP  0.69  #QF  0.69
 26 ASN  H      32 LEU  QD1     3.48            #peak   185 #SUP  0.77  #QF  0.77
  5 GLY  H      15 ILE  QD1     4.15            #peak   186 #SUP  0.94  #QF  0.94
  4 TYR  HA      6 TRP  H       4.41            #peak   187 #SUP  0.69  #QF  0.69
  6 TRP  H      15 ILE  QD1     4.45            #peak   189 #SUP  0.97  #QF  0.97
 40 GLN  HA     42 CYSS H       4.72            #peak   191 #SUP  0.54  #QF  0.54
 41 LEU  HB2    42 CYSS H       4.74            #peak   196 #SUP  0.96  #QF  0.96
 41 LEU  HG     42 CYSS H       4.86            #peak   197 #SUP  0.88  #QF  0.88
  6 TRP  HA      7 GLN  H       3.13            #peak   199 #SUP  0.84  #QF  0.84
  7 GLN  H      11 CYSS HA      5.42            #peak   200 #SUP  0.92  #QF  0.92
  7 GLN  H      14 CYSS HA      4.63            #peak   201 #SUP  0.88  #QF  0.88
  6 TRP  QB      7 GLN  H       4.03            #peak   202 #SUP  1.00
  7 GLN  H       7 GLN  QB      3.79            #peak   203 #SUP  0.93  #QF  0.93
  7 GLN  H      15 ILE  QG1     4.36            #peak   204 #SUP  0.98  #QF  0.98
 32 LEU  H      32 LEU  HG      3.55            #peak   206 #SUP  0.86  #QF  0.86
 32 LEU  H      32 LEU  QD1     5.20            #peak   207 #SUP  0.73  #QF  0.60
 32 LEU  H      32 LEU  QD2     5.50            #peak   207 #SUP  0.73  #QF  0.60
 24 ILE  QG1    32 LEU  H       4.72            #peak   209 #SUP  0.70  #QF  0.70
 31 CYSS HA     32 LEU  H       2.93            #peak   210 #SUP  0.55  #QF  0.55
  5 GLY  HA3    29 TRP  HE1     4.52            #peak   211 #SUP  0.93  #QF  0.93
  5 GLY  HA2    29 TRP  HE1     5.02            #peak   212 #SUP  0.86  #QF  0.86
 28 PRO  HB2    29 TRP  HE1     4.48            #peak   213 #SUP  0.92  #QF  0.92
 28 PRO  HB3    29 TRP  HE1     5.34            #peak   214 #SUP  0.75  #QF  0.75
 38 GLY  H      42 CYSS HA      4.79            #peak   215 #SUP  0.61  #QF  0.61
 37 TRP  HB2    38 GLY  H       4.45            #peak   216 #SUP  0.95  #QF  0.95
 37 TRP  HB3    38 GLY  H       3.66            #peak   217 #SUP  0.53  #QF  0.53
 18 PRO  HA     19 GLY  H       3.24            #peak   219 #SUP  0.80  #QF  0.80
 17 HIS  HA     19 GLY  H       4.63            #peak   221 #SUP  0.25  #QF  0.25
 30 GLN  HA     31 CYSS H       2.87            #peak   223 #SUP  0.76  #QF  0.76
 30 GLN  HG3    31 CYSS H       4.92            #peak   224 #SUP  0.82  #QF  0.82
 30 GLN  HG2    31 CYSS H       4.92            #peak   225 #SUP  0.65  #QF  0.65
 30 GLN  HB3    31 CYSS H       3.99            #peak   226 #SUP  0.35  #QF  0.35
 31 CYSS H      32 LEU  HG      4.65            #peak   227 #SUP  0.94  #QF  0.94
 31 CYSS H      32 LEU  QD2     4.06            #peak   228 #SUP  0.67  #QF  0.67
 28 PRO  HA     29 TRP  H       3.19            #peak   230 #SUP  0.71  #QF  0.71
 14 CYSS HB3    29 TRP  H       4.74            #peak   231 #SUP  0.82  #QF  0.82
 28 PRO  HB3    29 TRP  H       4.62            #peak   233 #SUP  0.80  #QF  0.80
 39 GLY  HA3    41 LEU  H       4.88            #peak   236 #SUP  0.96  #QF  0.96
 20 CYSS HA     21 VAL  H       2.91            #peak   237 #SUP  0.68  #QF  0.68
 39 GLY  HA2    41 LEU  H       4.88            #peak   238 #SUP  0.89  #QF  0.89
 20 CYSS HB3    21 VAL  H       4.66            #peak   239 #SUP  0.95  #QF  0.95
 20 CYSS HB2    21 VAL  H       4.66            #peak   240 #SUP  0.82  #QF  0.75
 40 GLN  HB3    41 LEU  H       4.06            #peak   242 #SUP  0.74  #QF  0.74
 40 GLN  HB2    41 LEU  H       4.06            #peak   243 #SUP  0.54  #QF  0.22
 42 CYSS HA     43 ASP  H       3.35            #peak   244 #SUP  0.80  #QF  0.80
 37 TRP  HB3    43 ASP  H       4.90            #peak   246 #SUP  0.83  #QF  0.32
 44 LYS  H      44 LYS  QE      5.43            #peak   246 #SUP  0.83  #QF  0.32
 35 THR  QG2    36 ASN  H       3.88            #peak   251 #SUP  0.79  #QF  0.79
 40 GLN  H      41 LEU  HG      5.50            #peak   252 #SUP  0.69  #QF  0.51
 40 GLN  H      41 LEU  QD2     4.62            #peak   253 #SUP  0.84  #QF  0.84
 40 GLN  H      41 LEU  QD1     5.26            #peak   254 #SUP  0.85  #QF  0.85
 32 LEU  HA     33 CYSS H       2.54            #peak   257 #SUP  0.62  #QF  0.62
 32 LEU  HB3    33 CYSS H       3.75            #peak   258 #SUP  0.66  #QF  0.66
 32 LEU  QD2    33 CYSS H       3.88            #peak   259 #SUP  0.88  #QF  0.88
 24 ILE  HA     25 CYSS H       2.97            #peak   261 #SUP  0.93  #QF  0.93
 24 ILE  HB     25 CYSS H       2.73            #peak   262 #SUP  0.77  #QF  0.77
 25 CYSS H      32 LEU  HB2     5.09            #peak   263 #SUP  0.79  #QF  0.79
 24 ILE  QG1    25 CYSS H       3.73            #peak   264 #SUP  1.00
 24 ILE  QG2    25 CYSS H       3.78            #peak   265 #SUP  0.90  #QF  0.90
 24 ILE  QD1    25 CYSS H       3.95            #peak   266 #SUP  0.98  #QF  0.98
 13 LYS  HA     14 CYSS H       2.70            #peak   270 #SUP  0.69  #QF  0.69
 13 LYS  QB     14 CYSS H       3.65            #peak   271 #SUP  0.81  #QF  0.81
 13 LYS  QG     14 CYSS H       4.29            #peak   272 #SUP  0.91  #QF  0.91
 34 GLU  HA     35 THR  H       2.68            #peak   273 #SUP  0.68  #QF  0.68
 23 GLY  HA3    24 ILE  H       3.16            #peak   278 #SUP  0.87  #QF  0.87
 24 ILE  H      31 CYSS HA      5.35            #peak   279 #SUP  0.83  #QF  0.83
 23 GLY  HA2    24 ILE  H       3.16            #peak   280 #SUP  0.46  #QF  0.46
 24 ILE  H      32 LEU  HB2     4.00            #peak   281 #SUP  0.88  #QF  0.88
 24 ILE  H      32 LEU  HB3     4.79            #peak   282 #SUP  0.81  #QF  0.81
 24 ILE  H      24 ILE  QG1     2.97            #peak   283 #SUP  0.92  #QF  0.92
 24 ILE  H      24 ILE  QD1     4.29            #peak   284 #SUP  0.99  #QF  0.99
  7 GLN  HA      8 GLY  H       3.10            #peak   285 #SUP  0.87  #QF  0.87
  7 GLN  QB      8 GLY  H       3.35            #peak   288 #SUP  0.87  #QF  0.87
 21 VAL  QG1    22 HIS  HE1     3.64            #peak   289 #SUP  0.54  #QF  0.54
 36 ASN  HB2    37 TRP  H       4.92            #peak   292 #SUP  0.96  #QF  0.96
 38 GLY  HA3    39 GLY  H       3.56            #peak   293 #SUP  0.90  #QF  0.90
 18 PRO  HA     20 CYSS H       4.78            #peak   294 #SUP  0.26  #QF  0.26
 38 GLY  HA2    39 GLY  H       3.56            #peak   295 #SUP  0.62  #QF  0.62
 36 ASN  HB3    37 TRP  H       4.92            #peak   296 #SUP  0.97  #QF  0.97
 20 CYSS H      41 LEU  HB3     5.22            #peak   301 #SUP  0.99  #QF  0.99
 14 CYSS HB3    27 GLU  H       4.80            #peak   302 #SUP  0.32  #QF  0.32
 27 GLU  H      32 LEU  QD1     4.84            #peak   303 #SUP  0.80  #QF  0.61
 20 CYSS H      41 LEU  QD1     5.43            #peak   303 #SUP  0.80  #QF  0.61
 20 CYSS H      41 LEU  QD2     4.36            #peak   304 #SUP  0.98  #QF  0.98
 25 CYSS HA     27 GLU  H       4.00            #peak   307 #SUP  0.92  #QF  0.92
 21 VAL  HB     22 HIS  H       3.11            #peak   314 #SUP  0.92  #QF  0.92
 21 VAL  QG2    22 HIS  H       4.00            #peak   315 #SUP  0.97  #QF  0.97
 21 VAL  QG1    22 HIS  H       3.51            #peak   316 #SUP  0.96  #QF  0.96
 22 HIS  HA     23 GLY  H       2.91            #peak   317 #SUP  0.77  #QF  0.77
 14 CYSS HA     15 ILE  H       3.16            #peak   318 #SUP  0.86  #QF  0.86
  6 TRP  HH2    28 PRO  HA      4.41            #peak   319 #SUP  0.95  #QF  0.95
 37 TRP  HE3    43 ASP  HA      3.50            #peak   320 #SUP  0.48  #QF  0.48
 37 TRP  HB2    37 TRP  HE3     4.08            #peak   324 #SUP  0.55  #QF  0.55
 37 TRP  HB3    37 TRP  HE3     3.26            #peak   325 #SUP  0.31  #QF  0.31
 22 HIS  HB2    37 TRP  HE3     4.78            #peak   326 #SUP  0.64  #QF  0.64
 16 PRO  QB     17 HIS  HD2     4.39            #peak   337 #SUP  0.89  #QF  0.89
 16 PRO  HG2    17 HIS  HD2     3.46            #peak   338 #SUP  0.44  #QF  0.44
  6 TRP  HZ2    27 GLU  HA      3.74            #peak   342 #SUP  0.96  #QF  0.96
  6 TRP  HZ2    28 PRO  HD2     3.74            #peak   343 #SUP  0.97  #QF  0.97
  6 TRP  HZ2    28 PRO  HD3     3.34            #peak   344 #SUP  0.85  #QF  0.85
  6 TRP  HZ2    27 GLU  HG3     5.32            #peak   345 #SUP  0.93  #QF  0.93
  6 TRP  HZ2    28 PRO  QG      4.69            #peak   346 #SUP  0.99  #QF  0.99
  6 TRP  HZ2    27 GLU  HG2     4.73            #peak   348 #SUP  0.50  #QF  0.50
  4 TYR  HA      4 TYR  QD      2.97            #peak   350 #SUP  0.81  #QF  0.81
 30 GLN  QE2    32 LEU  QD2     3.98            #peak   353 #SUP  0.35  #QF  0.35
 13 LYS  HA     15 ILE  H       4.10            #peak   355 #SUP  0.53  #QF  0.53
  6 TRP  HH2    27 GLU  HA      3.95            #peak   356 #SUP  0.89  #QF  0.81
  6 TRP  HH2    14 CYSS HB2     4.77            #peak   357 #SUP  0.99  #QF  0.79
 14 CYSS HB2    15 ILE  H       5.18            #peak   357 #SUP  0.99  #QF  0.79
  6 TRP  HH2    14 CYSS HB3     3.96            #peak   358 #SUP  0.91  #QF  0.91
 15 ILE  H      15 ILE  QD1     4.70            #peak   359 #SUP  0.95  #QF  0.95
 22 HIS  HB3    23 GLY  H       4.17            #peak   360 #SUP  0.95  #QF  0.95
  6 TRP  HH2    28 PRO  HD3     4.14            #peak   361 #SUP  0.79  #QF  0.79
 25 CYSS HB2    30 GLN  H       4.28            #peak   364 #SUP  0.55  #QF  0.55
 30 GLN  H      30 GLN  HG3     4.58            #peak   369 #SUP  0.67  #QF  0.67
 30 GLN  H      30 GLN  HB2     4.03            #peak   371 #SUP  0.79  #QF  0.79
  6 TRP  HE3    13 LYS  HA      4.36            #peak   377 #SUP  0.60  #QF  0.60
  6 TRP  HA      6 TRP  HE3     3.52            #peak   378 #SUP  0.41  #QF  0.41
 29 TRP  HA     29 TRP  HE3     2.94            #peak   380 #SUP  0.63  #QF  0.63
  6 TRP  HE3    14 CYSS HA      3.66            #peak   384 #SUP  0.59  #QF  0.59
  6 TRP  QB      6 TRP  HE3     3.30            #peak   386 #SUP  0.52  #QF  0.52
 22 HIS  HB2    37 TRP  HH2     3.64            #peak   387 #SUP  0.86  #QF  0.86
  6 TRP  HE3    14 CYSS HB2     5.20            #peak   388 #SUP  0.53  #QF  0.53
  6 TRP  HE3    13 LYS  QB      5.50            #peak   389 #SUP  0.72  #QF  0.25
  6 TRP  HE3    14 CYSS HB3     5.50            #peak   389 #SUP  0.72  #QF  0.25
  7 GLN  HE21   15 ILE  QG1     4.57            #peak   391 #SUP  0.96  #QF  0.59
 15 ILE  QG1    29 TRP  HE3     4.95            #peak   391 #SUP  0.96  #QF  0.59
  6 TRP  HE1    28 PRO  HD2     5.42            #peak   393 #SUP  0.98  #QF  0.98
  6 TRP  HE1    28 PRO  HD3     4.20            #peak   394 #SUP  0.74  #QF  0.74
  6 TRP  HE1    28 PRO  QG      3.98            #peak   395 #SUP  0.99  #QF  0.99
 24 ILE  H      32 LEU  H       3.50            #peak   400 #SUP  0.76  #QF  0.76
 34 GLU  H      37 TRP  HE1     3.90            #peak   403 #SUP  0.47  #QF  0.47
  4 TYR  QD     29 TRP  HE1     4.03            #peak   405 #SUP  0.84  #QF  0.84
  4 TYR  QE     29 TRP  HE1     4.06            #peak   407 #SUP  0.82  #QF  0.82
 37 TRP  H      38 GLY  H       4.95            #peak   410 #SUP  0.96  #QF  0.80
 38 GLY  H      39 GLY  H       5.40            #peak   410 #SUP  0.96  #QF  0.80
 19 GLY  H      20 CYSS H       4.27            #peak   412 #SUP  0.72  #QF  0.72
 29 TRP  H      30 GLN  H       4.64            #peak   413 #SUP  0.73  #QF  0.50
 29 TRP  H      29 TRP  HE3     4.33            #peak   414 #SUP  0.43  #QF  0.43
 40 GLN  H      41 LEU  H       3.37            #peak   415 #SUP  0.88  #QF  0.88
 41 LEU  H      42 CYSS H       3.31            #peak   416 #SUP  0.76  #QF  0.65
 21 VAL  H      22 HIS  H       3.83            #peak   417 #SUP  0.73  #QF  0.64
  9 LEU  H      10 TYR  H       4.43            #peak   418 #SUP  0.90  #QF  0.90
 36 ASN  H      37 TRP  H       3.39            #peak   420 #SUP  0.39  #QF  0.39
 12 ASP  H      13 LYS  H       3.32            #peak   421 #SUP  0.48  #QF  0.48
 26 ASN  H      27 GLU  H       2.78            #peak   422 #SUP  0.67  #QF  0.67
  5 GLY  H       6 TRP  H       3.46            #peak   423 #SUP  0.71  #QF  0.71
  4 TYR  QD      5 GLY  H       3.44            #peak   424 #SUP  0.80  #QF  0.80
 42 CYSS H      43 ASP  H       3.54            #peak   425 #SUP  0.41  #QF  0.41
 10 TYR  H      11 CYSS H       4.68            #peak   426 #SUP  0.92  #QF  0.92
 20 CYSS H      21 VAL  H       4.92            #peak   427 #SUP  0.96  #QF  0.96
  8 GLY  H       9 LEU  H       4.60            #peak   428 #SUP  0.94  #QF  0.94
 11 CYSS H      12 ASP  H       4.24            #peak   429 #SUP  0.81  #QF  0.81
 24 ILE  H      25 CYSS H       4.77            #peak   430 #SUP  0.99  #QF  0.99
 34 GLU  H      37 TRP  HD1     5.01            #peak   432 #SUP  0.98  #QF  0.38
 37 TRP  H      37 TRP  HD1     3.94            #peak   435 #SUP  0.94  #QF  0.94
  6 TRP  H       6 TRP  HD1     4.55            #peak   437 #SUP  0.86  #QF  0.86
 22 HIS  H      23 GLY  H       4.64            #peak   438 #SUP  0.80  #QF  0.80
 35 THR  H      36 ASN  H       4.48            #peak   439 #SUP  0.86  #QF  0.86
  5 GLY  H      29 TRP  HZ2     3.91            #peak   443 #SUP  0.76  #QF  0.76
  4 TYR  QD     29 TRP  HZ2     4.22            #peak   444 #SUP  0.71  #QF  0.71
 22 HIS  H      22 HIS  HD2     4.01            #peak   445 #SUP  0.34  #QF  0.34
  4 TYR  QE     29 TRP  HZ2     4.09            #peak   447 #SUP  0.70  #QF  0.70
  5 GLY  HA3    29 TRP  HZ2     4.13            #peak   449 #SUP  0.85  #QF  0.85
  5 GLY  HA2    29 TRP  HZ2     3.74            #peak   450 #SUP  0.70  #QF  0.70
 15 ILE  QG1    29 TRP  HZ2     5.35            #peak   451 #SUP  0.80  #QF  0.80
 15 ILE  QD1    29 TRP  HZ2     4.72            #peak   452 #SUP  0.71  #QF  0.71
 22 HIS  HD2    37 TRP  HZ3     4.02            #peak   454 #SUP  0.52  #QF  0.52
 22 HIS  HD2    43 ASP  HA      3.33            #peak   455 #SUP  0.37  #QF  0.37
 21 VAL  QG2    22 HIS  HD2     4.80            #peak   459 #SUP  0.44  #QF  0.44
 30 GLN  HB2    31 CYSS H       3.99            #peak   461 #SUP  0.88  #QF  0.88
  4 TYR  QD      5 GLY  HA2     4.57            #peak   464 #SUP  0.30  #QF  0.30
  4 TYR  HA     29 TRP  HZ2     4.91            #peak   466 #SUP  0.89  #QF  0.89
 22 HIS  HD2    37 TRP  HE3     4.57            #peak    13 #SUP  0.97  #QF  0.97
 22 HIS  HD2    37 TRP  HH2     4.78            #peak    20 #SUP  0.90  #QF  0.90
 10 TYR  HA     10 TYR  QD      3.87            #peak    27 #SUP  0.93  #QF  0.93
 37 TRP  HA     37 TRP  HD1     4.62            #peak    28 #SUP  0.46  #QF  0.46
 37 TRP  HZ3    43 ASP  HA      3.68            #peak    29 #SUP  0.80  #QF  0.80
 37 TRP  HZ3    42 CYSS HA      5.50            #peak    30 #SUP  0.40  #QF  0.40
 29 TRP  HA     29 TRP  HD1     4.81            #peak    31 #SUP  0.92  #QF  0.92
  4 TYR  HA      4 TYR  QE      4.82            #peak    33 #SUP  0.96  #QF  0.96
  6 TRP  HZ3    13 LYS  HA      4.21            #peak    34 #SUP  0.80  #QF  0.80
  6 TRP  HZ3    12 ASP  HA      4.34            #peak    35 #SUP  0.88  #QF  0.88
  6 TRP  HA      6 TRP  HD1     4.61            #peak    40 #SUP  0.94  #QF  0.94
 29 TRP  HB3    29 TRP  HD1     3.68            #peak    58 #SUP  0.85  #QF  0.85
 29 TRP  HB2    29 TRP  HD1     3.68            #peak    59 #SUP  0.80  #QF  0.80
 37 TRP  HB2    37 TRP  HD1     3.67            #peak    60 #SUP  0.91  #QF  0.91
 36 ASN  HB3    37 TRP  HD1     4.69            #peak    62 #SUP  0.89  #QF  0.89
 22 HIS  HB2    37 TRP  HZ3     3.99            #peak    63 #SUP  0.87  #QF  0.87
 36 ASN  HB2    37 TRP  HD1     4.69            #peak    64 #SUP  0.84  #QF  0.84
  6 TRP  HZ3    14 CYSS HA      4.62            #peak    65 #SUP  0.78  #QF  0.78
  5 GLY  HA3     6 TRP  HD1     5.09            #peak    68 #SUP  0.55  #QF  0.55
  6 TRP  QB      6 TRP  HD1     3.57            #peak    70 #SUP  0.81  #QF  0.81
 34 GLU  HG2    37 TRP  HD1     5.50            #peak    74 #SUP  0.83  #QF  0.83
  6 TRP  HZ3    14 CYSS HB2     4.79            #peak    79 #SUP  0.92  #QF  0.85
  6 TRP  HZ3    14 CYSS HB3     5.15            #peak    80 #SUP  0.91  #QF  0.86
  7 GLN  HE21   15 ILE  QG2     5.24            #peak    87 #SUP  0.93  #QF  0.83
  9 LEU  HG     10 TYR  QD      4.00            #peak    89 #SUP  0.75  #QF  0.75
  9 LEU  QD2    10 TYR  QD      4.68            #peak    90 #SUP  0.88  #QF  0.88
  9 LEU  QD1    10 TYR  QD      4.68            #peak    91 #SUP  0.90  #QF  0.90
 28 PRO  HB2    29 TRP  HD1     4.00            #peak    94 #SUP  0.87  #QF  0.87
 15 ILE  QG1    29 TRP  HZ3     3.32            #peak    96 #SUP  0.76  #QF  0.76
 15 ILE  QD1    29 TRP  HZ3     4.64            #peak    97 #SUP  0.92  #QF  0.28
 15 ILE  HB     29 TRP  HZ3     4.49            #peak    98 #SUP  0.86  #QF  0.69
  9 LEU  HG     10 TYR  QE      4.52            #peak   101 #SUP  0.67  #QF  0.67
  7 GLN  HE22   15 ILE  QG1     4.57            #peak   102 #SUP  0.96  #QF  0.43
 15 ILE  QG1    29 TRP  HH2     4.74            #peak   102 #SUP  0.96  #QF  0.43
  9 LEU  QD2    10 TYR  QE      4.83            #peak   103 #SUP  0.91  #QF  0.91
  9 LEU  QD1    10 TYR  QE      4.83            #peak   104 #SUP  0.90  #QF  0.90
 15 ILE  QD1    29 TRP  HH2     4.05            #peak   105 #SUP  0.96  #QF  0.72
  6 TRP  HZ2    27 GLU  QB      5.30            #peak   108 #SUP  0.38  #QF  0.38
 18 PRO  HG3    29 TRP  HE3     5.50            #peak   109 #SUP  0.64  #QF  0.64
 18 PRO  HG2    29 TRP  HE3     5.50            #peak   110 #SUP  0.58  #QF  0.58
 22 HIS  HD2    37 TRP  HZ2     5.50            #peak   118 #SUP  0.94  #QF  0.94
  6 TRP  HH2    28 PRO  HD2     5.35            #peak   120 #SUP  0.90  #QF  0.90
 21 VAL  HB     22 HIS  HD2     4.05            #peak   133 #SUP  0.86  #QF  0.86
 21 VAL  QG1    22 HIS  HD2     3.48            #peak   135 #SUP  0.84  #QF  0.84
  7 GLN  HE22   15 ILE  QG2     5.24            #peak   136 #SUP  0.56  #QF  0.39
 13 LYS  HA     14 CYSS HB3     4.44            #peak   139 #SUP  0.93  #QF  0.93
 13 LYS  HA     13 LYS  QD      4.06            #peak   141 #SUP  0.49  #QF  0.49
 13 LYS  HA     13 LYS  QG      3.58            #peak   142 #SUP  0.98  #QF  0.98
  7 GLN  HA     11 CYSS HA      4.61            #peak   143 #SUP  0.71  #QF  0.71
  7 GLN  HA      7 GLN  HG3     3.93            #peak   144 #SUP  0.93  #QF  0.93
  7 GLN  HA      7 GLN  HG2     3.93            #peak   145 #SUP  0.97  #QF  0.97
  7 GLN  HA     15 ILE  QG1     5.24            #peak   147 #SUP  0.98  #QF  0.98
  7 GLN  HA     15 ILE  QD1     4.90            #peak   148 #SUP  0.95  #QF  0.95
 33 CYSS HA     34 GLU  HA      4.71            #peak   149 #SUP  0.31  #QF  0.31
 33 CYSS HA     37 TRP  HB2     5.50            #peak   151 #SUP  0.55  #QF  0.55
  6 TRP  QB      7 GLN  HA      4.54            #peak   152 #SUP  0.69  #QF  0.69
  6 TRP  HA     14 CYSS HA      3.41            #peak   159 #SUP  0.62  #QF  0.62
 24 ILE  HB     25 CYSS HA      4.74            #peak   166 #SUP  0.94  #QF  0.86
 25 CYSS HA     32 LEU  HB2     4.36            #peak   167 #SUP  0.91  #QF  0.29
 25 CYSS HA     32 LEU  HG      3.92            #peak   168 #SUP  0.91  #QF  0.91
 24 ILE  QG1    25 CYSS HA      5.45            #peak   169 #SUP  0.99  #QF  0.67
  6 TRP  HA     15 ILE  QG1     4.24            #peak   170 #SUP  0.73  #QF  0.63
 23 GLY  HA3    24 ILE  QG2     5.04            #peak   170 #SUP  0.73  #QF  0.63
 25 CYSS HA     32 LEU  QD1     3.84            #peak   171 #SUP  0.88  #QF  0.88
  6 TRP  HA     15 ILE  QD1     4.74            #peak   177 #SUP  0.92  #QF  0.92
 37 TRP  HA     37 TRP  HE3     3.90            #peak   180 #SUP  0.86  #QF  0.86
  6 TRP  HE3    12 ASP  HA      3.93            #peak   187 #SUP  0.58  #QF  0.58
 29 TRP  HA     29 TRP  HZ3     4.73            #peak   194 #SUP  0.51  #QF  0.51
 34 GLU  HA     37 TRP  HD1     4.75            #peak   198 #SUP  0.60  #QF  0.60
 34 GLU  HG3    37 TRP  HD1     5.50            #peak   219 #SUP  0.84  #QF  0.68
 22 HIS  HB3    37 TRP  HZ3     5.50            #peak   219 #SUP  0.84  #QF  0.68
 28 PRO  HB3    29 TRP  HD1     5.50            #peak   242 #SUP  0.84  #QF  0.61
 24 ILE  HA     24 ILE  HB      2.93            #peak   246 #SUP  0.97  #QF  0.97
 20 CYSS HA     41 LEU  HA      3.73            #peak   247 #SUP  0.89  #QF  0.89
 27 GLU  HA     28 PRO  HD2     3.51            #peak   259 #SUP  0.69  #QF  0.69
 27 GLU  HA     28 PRO  HD3     3.17            #peak   260 #SUP  0.70  #QF  0.70
 30 GLN  HA     30 GLN  HG3     3.74            #peak   261 #SUP  0.93  #QF  0.93
 30 GLN  HA     30 GLN  HG2     3.74            #peak   262 #SUP  0.94  #QF  0.94
  6 TRP  QB     11 CYSS HA      4.34            #peak   278 #SUP  0.52  #QF  0.52
 25 CYSS HB2    30 GLN  HB3     4.25            #peak   284 #SUP  0.46  #QF  0.46
 25 CYSS HB2    30 GLN  HB2     4.25            #peak   285 #SUP  0.94  #QF  0.94
 26 ASN  QB     27 GLU  HA      4.87            #peak   292 #SUP  0.70  #QF  0.70
 37 TRP  HB3    42 CYSS HA      4.28            #peak   293 #SUP  0.50  #QF  0.50
 32 LEU  HA     32 LEU  HG      4.02            #peak   312 #SUP  0.97  #QF  0.97
 44 LYS  HA     44 LYS  QG      3.61            #peak   314 #SUP  0.91  #QF  0.91
 41 LEU  HA     41 LEU  HG      4.05            #peak   317 #SUP  1.00
 24 ILE  HA     24 ILE  QG2     2.91            #peak   318 #SUP  0.81  #QF  0.81
 32 LEU  HA     32 LEU  QD2     3.04            #peak   319 #SUP  0.66  #QF  0.66
 32 LEU  HA     32 LEU  QD1     4.39            #peak   320 #SUP  1.00  #QF  0.98
 41 LEU  HA     41 LEU  QD1     4.71            #peak   320 #SUP  1.00  #QF  0.98
 21 VAL  QG2    43 ASP  HA      3.84            #peak   321 #SUP  0.60  #QF  0.60
 21 VAL  HB     43 ASP  HA      3.54            #peak   322 #SUP  0.54  #QF  0.54
 14 CYSS HB2    27 GLU  HA      5.42            #peak   323 #SUP  0.66  #QF  0.66
 14 CYSS HB3    27 GLU  HA      5.43            #peak   324 #SUP  0.52  #QF  0.34
 27 GLU  HA     28 PRO  QG      4.82            #peak   326 #SUP  0.75  #QF  0.75
 30 GLN  HA     32 LEU  QD2     5.50            #peak   335 #SUP  0.81  #QF  0.81
 35 THR  QG2    36 ASN  HA      4.69            #peak   336 #SUP  0.72  #QF  0.72
 16 PRO  QB     20 CYSS HA      5.50            #peak   337 #SUP  0.94  #QF  0.88
 16 PRO  QB     25 CYSS HB2     5.50            #peak   337 #SUP  0.94  #QF  0.88
 14 CYSS HB3    25 CYSS HB2     4.50            #peak   338 #SUP  0.46  #QF  0.46
 25 CYSS HB2    32 LEU  QD1     4.48            #peak   340 #SUP  0.97  #QF  0.81
 20 CYSS HA     41 LEU  QD1     4.88            #peak   340 #SUP  0.97  #QF  0.81
 20 CYSS HA     21 VAL  QG2     4.47            #peak   341 #SUP  0.92  #QF  0.92
 20 CYSS HA     41 LEU  HB2     4.49            #peak   342 #SUP  0.92  #QF  0.92
 20 CYSS HA     41 LEU  HB3     3.59            #peak   344 #SUP  0.82  #QF  0.82
 15 ILE  HA     16 PRO  HG3     5.27            #peak   346 #SUP  1.00  #QF  0.97
 13 LYS  QB     15 ILE  HA      3.97            #peak   348 #SUP  0.37  #QF  0.37
 15 ILE  HA     15 ILE  QG1     3.14            #peak   349 #SUP  0.94  #QF  0.94
 21 VAL  HA     21 VAL  QG2     3.18            #peak   350 #SUP  1.00
 35 THR  HA     35 THR  QG2     2.91            #peak   356 #SUP  0.69  #QF  0.69
  9 LEU  HA      9 LEU  HG      4.13            #peak   359 #SUP  0.94  #QF  0.94
  9 LEU  HA      9 LEU  QD2     3.99            #peak   360 #SUP  0.78  #QF  0.78
  9 LEU  HA      9 LEU  QD1     3.99            #peak   361 #SUP  0.89  #QF  0.89
 41 LEU  HA     41 LEU  QD2     3.30            #peak   365 #SUP  0.65  #QF  0.65
 21 VAL  QG1    43 ASP  HA      4.04            #peak   366 #SUP  0.47  #QF  0.47
 21 VAL  QG1    22 HIS  HA      4.51            #peak   367 #SUP  0.71  #QF  0.71
 21 VAL  HA     21 VAL  QG1     2.99            #peak   368 #SUP  0.84  #QF  0.84
  7 GLN  QB     15 ILE  QD1     3.91            #peak   376 #SUP  0.93  #QF  0.93
  7 GLN  HG2    15 ILE  QD1     4.68            #peak   377 #SUP  0.96  #QF  0.96
  7 GLN  HG3    15 ILE  QD1     4.68            #peak   378 #SUP  0.95  #QF  0.95
  5 GLY  HA2    15 ILE  QD1     4.02            #peak   379 #SUP  0.88  #QF  0.88
 15 ILE  QG2    15 ILE  QG1     3.82            #peak   380 #SUP  0.79  #QF  0.35
  7 GLN  QB     15 ILE  QG1     3.86            #peak   382 #SUP  0.81  #QF  0.32
 32 LEU  HB2    32 LEU  QD2     4.07            #peak   382 #SUP  0.81  #QF  0.32
  5 GLY  HA2    15 ILE  QG1     4.88            #peak   385 #SUP  0.85  #QF  0.85
 14 CYSS HA     15 ILE  QD1     4.94            #peak   386 #SUP  0.97  #QF  0.97
  5 GLY  HA3    15 ILE  QD1     4.97            #peak   387 #SUP  0.92  #QF  0.86
 15 ILE  QD1    18 PRO  QD      5.48            #peak   387 #SUP  0.92  #QF  0.86
 14 CYSS HA     15 ILE  QG1     3.44            #peak   388 #SUP  0.76  #QF  0.76
  5 GLY  HA3    15 ILE  QG1     5.50            #peak   389 #SUP  0.95  #QF  0.90
 15 ILE  QG1    18 PRO  QD      5.50            #peak   389 #SUP  0.95  #QF  0.90
 15 ILE  HA     15 ILE  QD1     4.08            #peak   390 #SUP  0.98  #QF  0.98
 15 ILE  QG2    18 PRO  QD      5.39            #peak   397 #SUP  0.96  #QF  0.55
 20 CYSS HA     41 LEU  HG      4.98            #peak   399 #SUP  0.97  #QF  0.97
 21 VAL  QG1    43 ASP  HB2     4.70            #peak   403 #SUP  0.73  #QF  0.73
 21 VAL  QG2    43 ASP  HB2     3.53            #peak   404 #SUP  0.84  #QF  0.84
 21 VAL  QG2    43 ASP  HB3     3.53            #peak   405 #SUP  0.89  #QF  0.89
 21 VAL  QG1    43 ASP  HB3     4.70            #peak   406 #SUP  0.74  #QF  0.74
 21 VAL  QG2    41 LEU  HB3     4.29            #peak   407 #SUP  0.57  #QF  0.57
 24 ILE  QG2    24 ILE  QG1     3.10            #peak   409 #SUP  0.83  #QF  0.83
 24 ILE  HB     24 ILE  QD1     3.24            #peak   411 #SUP  0.95  #QF  0.95
 23 GLY  HA2    24 ILE  QG2     5.04            #peak   414 #SUP  0.83  #QF  0.83
 24 ILE  HA     24 ILE  QG1     3.92            #peak   415 #SUP  0.96  #QF  0.96
 24 ILE  QG1    32 LEU  HB2     3.62            #peak   417 #SUP  0.83  #QF  0.83
 41 LEU  HB2    41 LEU  QD1     3.34            #peak   424 #SUP  0.91  #QF  0.91
 32 LEU  HB3    32 LEU  QD2     3.62            #peak   425 #SUP  0.94  #QF  0.81
 41 LEU  HB3    41 LEU  QD1     3.46            #peak   427 #SUP  0.89  #QF  0.89
  5 GLY  HA2    28 PRO  HB3     4.69            #peak   428 #SUP  0.50  #QF  0.50
 32 LEU  HB2    32 LEU  QD1     3.49            #peak   430 #SUP  0.94  #QF  0.84
 26 ASN  QB     32 LEU  QD1     4.15            #peak   433 #SUP  0.77  #QF  0.77
  5 GLY  HA3    28 PRO  HB3     3.86            #peak   435 #SUP  0.41  #QF  0.41
 41 LEU  HB2    41 LEU  QD2     4.03            #peak   437 #SUP  0.78  #QF  0.78
  5 GLY  HA2    15 ILE  HB      5.15            #peak   440 #SUP  0.85  #QF  0.85
 15 ILE  HB     18 PRO  QD      5.23            #peak   443 #SUP  0.68  #QF  0.43
 20 CYSS HA     41 LEU  QD2     3.81            #peak   445 #SUP  0.67  #QF  0.67
 14 CYSS HB3    28 PRO  HA      3.66            #peak   462 #SUP  0.76  #QF  0.76
 14 CYSS HB2    28 PRO  HA      4.18            #peak   463 #SUP  0.86  #QF  0.86
  5 GLY  HA3    28 PRO  HB2     4.66            #peak   464 #SUP  0.78  #QF  0.78
 16 PRO  QB     20 CYSS HB3     5.06            #peak   468 #SUP  0.97  #QF  0.97
 20 CYSS HB3    41 LEU  HB3     5.50            #peak   469 #SUP  0.88  #QF  0.71
 13 LYS  QG     13 LYS  QE      4.12            #peak   474 #SUP  0.99  #QF  0.74
 44 LYS  QG     44 LYS  QE      3.81            #peak   476 #SUP  0.70  #QF  0.70
 16 PRO  QB     20 CYSS HB2     5.06            #peak   482 #SUP  0.81  #QF  0.81
 20 CYSS HB2    41 LEU  HB3     5.50            #peak   483 #SUP  0.98  #QF  0.90
 14 CYSS HB3    25 CYSS HB3     5.47            #peak   493 #SUP  0.83  #QF  0.61
 25 CYSS HB3    32 LEU  HB2     5.50            #peak   493 #SUP  0.83  #QF  0.61
  4 TYR  H       4 TYR  QB      3.04            #peak    93
  4 TYR  QB      5 GLY  H       4.24            #peak   146
  7 GLN  H       7 GLN  QG      3.22            #peak    59
  7 GLN  QB      7 GLN  QE2     4.61            #peak   372
  7 GLN  QG      7 GLN  QE2     3.01            #peak    82
  7 GLN  QG      8 GLY  H       2.92            #peak   286
  7 GLN  QG     15 ILE  HA      4.79            #peak   345
  7 GLN  QG     15 ILE  QG1     3.07            #peak   412
  7 GLN  QG     15 ILE  QD1     3.98            #peak   377
  7 GLN  QE2    15 ILE  QG2     4.60            #peak    87
  8 GLY  QA      9 LEU  H       2.80            #peak   269
  9 LEU  H       9 LEU  QB      2.75            #peak   145
  9 LEU  H       9 LEU  QQD     3.94            #peak   162
  9 LEU  HA      9 LEU  QQD     3.09            #peak   360
  9 LEU  QB     10 TYR  QD      4.14            #peak   373
  9 LEU  QB     10 TYR  QE      4.42            #peak    99
  9 LEU  QQD    10 TYR  QD      3.98            #peak    91
  9 LEU  QQD    10 TYR  QE      3.46            #peak   104
 11 CYSS H      11 CYSS QB      3.56            #peak   128
 13 LYS  QB     16 PRO  QD      4.02            #peak   363
 15 ILE  HA     16 PRO  QD      2.95            #peak   286
 15 ILE  HA     18 PRO  QG      4.52            #peak   347
 15 ILE  HB     18 PRO  QG      4.39            #peak   438
 15 ILE  QG2    18 PRO  QG      3.77            #peak   391
 15 ILE  QG1    18 PRO  QG      4.73            #peak   383
 16 PRO  QB     20 CYSS QB      4.25            #peak   482
 16 PRO  HG3    20 CYSS QB      5.34            #peak   483
 17 HIS  QB     18 PRO  QB      4.87            #peak   490
 17 HIS  QB     18 PRO  QG      3.80            #peak   488
 18 PRO  QG     29 TRP  HE3     4.77            #peak   109
 18 PRO  QG     29 TRP  HZ3     4.74            #peak    81
 19 GLY  QA     41 LEU  QD2     5.34            #peak   443
 20 CYSS H      20 CYSS QB      3.11            #peak   127
 20 CYSS QB     21 VAL  H       4.06            #peak   240
 20 CYSS QB     41 LEU  QD2     4.70            #peak   442
 21 VAL  H      42 CYSS QB      4.49            #peak   241
 21 VAL  HB     43 ASP  QB      4.00            #peak   485
 21 VAL  QG1    43 ASP  QB      4.12            #peak   403
 21 VAL  QG2    43 ASP  QB      3.09            #peak   404
 22 HIS  H      42 CYSS QB      3.50            #peak   137
 22 HIS  HB3    23 GLY  QA      4.49            #peak   156
 22 HIS  HD2    43 ASP  QB      4.95            #peak   132
 23 GLY  QA     24 ILE  H       2.75            #peak   278
 23 GLY  QA     24 ILE  QG2     4.17            #peak   170
 23 GLY  QA     24 ILE  QG1     5.10            #peak   169
 25 CYSS HA     30 GLN  QB      5.07            #peak   166
 25 CYSS HB2    30 GLN  QB      3.62            #peak   284
 26 ASN  H      30 GLN  QB      4.45            #peak   184
 26 ASN  QD2    27 GLU  QB      4.44            #peak    77
 26 ASN  QD2    27 GLU  HG3     3.67            #peak    75
 26 ASN  QD2    32 LEU  QD1     5.23            #peak   242
 29 TRP  QB     29 TRP  HD1     3.05            #peak    58
 29 TRP  QB     29 TRP  HE3     3.59            #peak   385
 30 GLN  H      30 GLN  QG      3.93            #peak   138
 30 GLN  HA     30 GLN  QG      3.26            #peak   261
 30 GLN  QB     31 CYSS H       3.39            #peak   461
 30 GLN  QB     32 LEU  QD2     5.06            #peak   432
 30 GLN  QG     31 CYSS H       4.25            #peak   224
 31 CYSS H      31 CYSS QB      3.63            #peak    61
 31 CYSS QB     32 LEU  HA      5.34            #peak   248
 31 CYSS QB     32 LEU  HG      5.34            #peak   472
 31 CYSS QB     41 LEU  HA      5.34            #peak   248
 31 CYSS QB     42 CYSS H       5.34            #peak   194
 33 CYSS H      33 CYSS QB      3.65            #peak   179
 33 CYSS HA     42 CYSS QB      4.64            #peak   154
 33 CYSS QB     34 GLU  H       3.09            #peak    92
 33 CYSS QB     42 CYSS QB      3.69            #peak   450
 34 GLU  H      34 GLU  QG      4.12            #peak   182
 34 GLU  HA     34 GLU  QG      3.21            #peak   299
 34 GLU  QB     35 THR  H       3.85            #peak   277
 34 GLU  QB     37 TRP  HD1     3.15            #peak    78
 34 GLU  QG     35 THR  H       3.40            #peak   275
 34 GLU  QG     37 TRP  HD1     4.63            #peak    74
 35 THR  QG2    36 ASN  QD2     4.70            #peak   374
 36 ASN  HA     36 ASN  QD2     4.16            #peak    41
 36 ASN  QB     36 ASN  QD2     3.07            #peak    71
 36 ASN  QB     37 TRP  H       4.31            #peak   292
 37 TRP  HE3    43 ASP  QB      5.34            #peak   137
 38 GLY  QA     39 GLY  H       2.84            #peak   295
 39 GLY  QA     40 GLN  H       2.51            #peak   249
 39 GLY  QA     41 LEU  H       4.07            #peak   238
 39 GLY  QA     42 CYSS H       4.75            #peak   192
 40 GLN  H      40 GLN  QB      2.95            #peak    89
 40 GLN  H      40 GLN  QG      4.05            #peak    88
 40 GLN  HA     40 GLN  QG      3.67            #peak   288
 40 GLN  QB     41 LEU  HG      4.71            #peak   393
 40 GLN  QG     41 LEU  QD2     4.81            #peak   439
 43 ASP  QB     44 LYS  H       3.83            #peak    76
 44 LYS  H      44 LYS  QD      3.46            #peak    79
 44 LYS  HA     44 LYS  QD      4.33            #peak   315

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           H        ARG   1   1.807   0.001   0.855
    2    HA   ARG   1           HA       ARG   1   2.857   0.759  -1.162
    3    HB2  ARG   1           2HB      ARG   1   2.423  -2.039  -0.685
    4    HB3  ARG   1           3HB      ARG   1   2.471  -1.744  -2.418
    5    HG2  ARG   1           2HG      ARG   1   4.585  -0.326  -1.062
    6    HG3  ARG   1           3HG      ARG   1   4.635  -2.054  -0.710
    7    HD2  ARG   1           2HD      ARG   1   5.963  -1.425  -2.701
    8    HD3  ARG   1           3HD      ARG   1   4.681  -2.581  -3.058
    9    HE   ARG   1           HE       ARG   1   3.759   0.052  -3.491
   10   HH11  ARG   1          1HH1      ARG   1   5.867  -2.356  -4.859
   11   HH12  ARG   1          2HH1      ARG   1   5.692  -1.776  -6.482
   12   HH21  ARG   1          1HH2      ARG   1   3.519   0.826  -5.623
   13   HH22  ARG   1          2HH2      ARG   1   4.356   0.034  -6.915
   14    H    CYS   2           H        CYS   2  -0.302  -0.727  -1.631
   15    HA   CYS   2           HA       CYS   2  -1.088   1.125  -3.599
   16    HB2  CYS   2           2HB      CYS   2  -1.236  -0.439  -5.541
   17    HB3  CYS   2           3HB      CYS   2   0.414  -0.026  -5.090
   18    H    GLN   3           H        GLN   3  -3.271   1.013  -4.010
   19    HA   GLN   3           HA       GLN   3  -4.834  -1.318  -3.525
   20    HB2  GLN   3           2HB      GLN   3  -6.160  -0.227  -1.630
   21    HB3  GLN   3           3HB      GLN   3  -4.593  -0.912  -1.221
   22    HG2  GLN   3           2HG      GLN   3  -3.590   1.298  -1.273
   23    HG3  GLN   3           3HG      GLN   3  -5.138   2.002  -1.739
   24   HE21  GLN   3          1HE2      GLN   3  -6.742   2.243  -0.216
   25   HE22  GLN   3          2HE2      GLN   3  -6.464   2.045   1.477
   26    H    TYR   4           H        TYR   4  -4.799   2.214  -3.722
   27    HA   TYR   4           HA       TYR   4  -7.453   2.256  -4.902
   28    HB2  TYR   4           2HB      TYR   4  -6.146   4.032  -3.311
   29    HB3  TYR   4           3HB      TYR   4  -5.852   4.735  -4.897
   30    HD1  TYR   4           HD2      TYR   4  -8.238   4.386  -6.391
   31    HD2  TYR   4           HD1      TYR   4  -7.839   5.154  -2.225
   32    HE1  TYR   4           HE2      TYR   4 -10.484   5.389  -6.367
   33    HE2  TYR   4           HE1      TYR   4 -10.084   6.158  -2.189
   34    HH   TYR   4           HH       TYR   4 -11.773   6.986  -5.010
   35    H    GLY   5           H        GLY   5  -7.735   1.917  -6.998
   36    HA2  GLY   5           2HA      GLY   5  -7.476   2.186  -9.280
   37    HA3  GLY   5           3HA      GLY   5  -6.142   3.285  -8.958
   38    H    TRP   6           H        TRP   6  -6.170   0.090  -7.589
   39    HA   TRP   6           HA       TRP   6  -4.495  -0.996  -9.699
   40    HB2  TRP   6           2HB      TRP   6  -3.481  -0.515  -6.894
   41    HB3  TRP   6           3HB      TRP   6  -2.712  -1.627  -8.024
   42    HD1  TRP   6           HD1      TRP   6  -2.492   1.838  -6.896
   43    HE1  TRP   6           HE1      TRP   6  -1.133   3.271  -8.548
   44    HE3  TRP   6           HE3      TRP   6  -2.424  -1.362 -10.883
   45    HZ2  TRP   6           HZ2      TRP   6  -0.162   3.071 -11.190
   46    HZ3  TRP   6           HZ3      TRP   6  -1.259  -0.666 -12.935
   47    HH2  TRP   6           HH2      TRP   6  -0.153   1.506 -13.084
   48    H    GLN   7           H        GLN   7  -5.583  -2.823 -10.072
   49    HA   GLN   7           HA       GLN   7  -6.351  -4.477  -7.758
   50    HB2  GLN   7           2HB      GLN   7  -8.165  -5.365  -9.045
   51    HB3  GLN   7           3HB      GLN   7  -8.236  -3.612  -9.159
   52    HG2  GLN   7           2HG      GLN   7  -7.296  -3.660 -11.365
   53    HG3  GLN   7           3HG      GLN   7  -7.021  -5.398 -11.252
   54   HE21  GLN   7          1HE2      GLN   7  -9.822  -3.429 -10.359
   55   HE22  GLN   7          2HE2      GLN   7 -10.942  -4.237 -11.397
   56    H    GLY   8           H        GLY   8  -6.835  -6.864  -8.940
   57    HA2  GLY   8           2HA      GLY   8  -5.806  -8.465 -10.449
   58    HA3  GLY   8           3HA      GLY   8  -4.307  -7.560 -10.293
   59    H    LEU   9           H        LEU   9  -3.997 -10.131  -9.932
   60    HA   LEU   9           HA       LEU   9  -4.547 -11.321  -7.504
   61    HB2  LEU   9           2HB      LEU   9  -3.489 -12.419  -9.456
   62    HB3  LEU   9           3HB      LEU   9  -1.986 -11.584  -9.072
   63    HG   LEU   9           HG       LEU   9  -2.091 -12.789  -6.823
   64   HD11  LEU   9          1HD1      LEU   9  -4.210 -13.649  -6.604
   65   HD12  LEU   9          2HD1      LEU   9  -3.327 -15.058  -7.189
   66   HD13  LEU   9          3HD1      LEU   9  -4.316 -14.114  -8.302
   67   HD21  LEU   9          3HD2      LEU   9  -1.304 -14.966  -7.939
   68   HD22  LEU   9          1HD2      LEU   9  -0.422 -13.481  -8.295
   69   HD23  LEU   9          2HD2      LEU   9  -1.581 -14.119  -9.461
   70    H    TYR  10           H        TYR  10  -2.094  -8.946  -8.297
   71    HA   TYR  10           HA       TYR  10  -1.514  -8.678  -5.432
   72    HB2  TYR  10           2HB      TYR  10   0.451  -9.083  -7.660
   73    HB3  TYR  10           3HB      TYR  10   0.910  -8.133  -6.251
   74    HD1  TYR  10           HD1      TYR  10   0.020 -11.479  -7.464
   75    HD2  TYR  10           HD2      TYR  10   1.230  -9.180  -4.094
   76    HE1  TYR  10           HE1      TYR  10   0.559 -13.550  -6.252
   77    HE2  TYR  10           HE2      TYR  10   1.774 -11.245  -2.873
   78    HH   TYR  10           HH       TYR  10   0.775 -13.904  -3.222
   79    H    CYS  11           H        CYS  11  -0.243  -7.124  -8.367
   80    HA   CYS  11           HA       CYS  11  -1.778  -4.792  -8.247
   81    HB2  CYS  11           2HB      CYS  11   0.338  -4.909  -6.286
   82    HB3  CYS  11           3HB      CYS  11   0.631  -3.599  -7.425
   83    H    ASP  12           H        ASP  12  -1.684  -5.134 -10.476
   84    HA   ASP  12           HA       ASP  12   0.496  -3.826 -11.797
   85    HB2  ASP  12           2HB      ASP  12   1.283  -6.232 -11.436
   86    HB3  ASP  12           3HB      ASP  12   0.036  -6.698 -12.589
   87    H    LYS  13           H        LYS  13  -2.118  -3.117 -11.679
   88    HA   LYS  13           HA       LYS  13  -2.830  -2.980 -14.429
   89    HB2  LYS  13           2HB      LYS  13  -4.081  -5.046 -12.763
   90    HB3  LYS  13           3HB      LYS  13  -5.234  -4.005 -13.588
   91    HG2  LYS  13           2HG      LYS  13  -3.646  -4.522 -15.649
   92    HG3  LYS  13           3HG      LYS  13  -3.315  -5.970 -14.696
   93    HD2  LYS  13           2HD      LYS  13  -6.137  -5.097 -15.168
   94    HD3  LYS  13           3HD      LYS  13  -5.263  -5.979 -16.422
   95    HE2  LYS  13           2HE      LYS  13  -4.731  -7.695 -14.623
   96    HE3  LYS  13           3HE      LYS  13  -5.940  -6.878 -13.633
   97    HZ1  LYS  13           3HZ      LYS  13  -6.546  -8.890 -15.205
   98    HZ2  LYS  13           1HZ      LYS  13  -6.721  -7.646 -16.339
   99    HZ3  LYS  13           2HZ      LYS  13  -7.633  -7.627 -14.914
  100    H    CYS  14           H        CYS  14  -3.771  -1.070 -14.732
  101    HA   CYS  14           HA       CYS  14  -4.834   0.346 -12.404
  102    HB2  CYS  14           2HB      CYS  14  -4.529   2.365 -13.647
  103    HB3  CYS  14           3HB      CYS  14  -3.079   1.395 -13.878
  104    H    ILE  15           H        ILE  15  -6.294  -1.787 -13.871
  105    HA   ILE  15           HA       ILE  15  -8.371  -2.231 -14.699
  106    HB   ILE  15           HB       ILE  15  -9.398   0.344 -13.596
  107   HG12  ILE  15          2HG1      ILE  15  -8.371  -1.965 -11.933
  108   HG13  ILE  15          3HG1      ILE  15  -7.746  -0.319 -11.940
  109   HG21  ILE  15          1HG2      ILE  15 -10.534  -2.322 -12.968
  110   HG22  ILE  15          2HG2      ILE  15 -11.346  -0.795 -13.312
  111   HG23  ILE  15          3HG2      ILE  15 -10.664  -1.748 -14.630
  112   HD11  ILE  15          3HD1      ILE  15  -9.028  -0.220 -10.078
  113   HD12  ILE  15          1HD1      ILE  15 -10.247   0.230 -11.271
  114   HD13  ILE  15          2HD1      ILE  15 -10.174  -1.425 -10.665
  115    HA   PRO  16           HA       PRO  16  -7.832   0.652 -18.281
  116    HB2  PRO  16           2HB      PRO  16  -7.771  -1.322 -20.144
  117    HB3  PRO  16           3HB      PRO  16  -6.333  -0.782 -19.270
  118    HG2  PRO  16           2HG      PRO  16  -8.075  -3.163 -18.763
  119    HG3  PRO  16           3HG      PRO  16  -6.306  -3.045 -18.736
  120    HD2  PRO  16           2HD      PRO  16  -7.801  -3.029 -16.479
  121    HD3  PRO  16           3HD      PRO  16  -6.273  -2.137 -16.618
  122    H    HIS  17           H        HIS  17 -10.022  -1.943 -17.508
  123    HA   HIS  17           HA       HIS  17 -11.862  -1.870 -19.540
  124    HB2  HIS  17           2HB      HIS  17 -11.892  -2.602 -16.712
  125    HB3  HIS  17           3HB      HIS  17 -13.462  -2.049 -17.289
  126    HD1  HIS  17           HD1      HIS  17 -14.519  -4.378 -17.193
  127    HD2  HIS  17           HD2      HIS  17 -11.162  -4.173 -19.632
  128    HE1  HIS  17           HE1      HIS  17 -14.497  -6.532 -18.490
  129    HA   PRO  18           HA       PRO  18 -14.249   1.772 -17.479
  130    HB2  PRO  18           2HB      PRO  18 -13.120   2.969 -15.320
  131    HB3  PRO  18           3HB      PRO  18 -14.202   1.577 -15.190
  132    HG2  PRO  18           2HG      PRO  18 -11.211   1.664 -15.112
  133    HG3  PRO  18           3HG      PRO  18 -12.330   0.738 -14.096
  134    HD2  PRO  18           2HD      PRO  18 -11.002  -0.367 -16.181
  135    HD3  PRO  18           3HD      PRO  18 -12.624  -0.899 -15.692
  136    H    GLY  19           H        GLY  19 -13.295   2.533 -19.521
  137    HA2  GLY  19           2HA      GLY  19 -12.682   4.951 -19.991
  138    HA3  GLY  19           3HA      GLY  19 -11.209   4.581 -19.107
  139    H    CYS  20           H        CYS  20 -11.413   1.790 -20.398
  140    HA   CYS  20           HA       CYS  20 -10.761   2.403 -23.164
  141    HB2  CYS  20           2HB      CYS  20  -8.753   1.808 -21.104
  142    HB3  CYS  20           3HB      CYS  20  -8.633   0.791 -22.536
  143    H    VAL  21           H        VAL  21  -9.886   0.177 -24.171
  144    HA   VAL  21           HA       VAL  21 -11.727  -1.928 -23.235
  145    HB   VAL  21           HB       VAL  21 -10.885  -1.463 -26.097
  146   HG11  VAL  21          1HG1      VAL  21 -13.201  -3.107 -25.132
  147   HG12  VAL  21          2HG1      VAL  21 -12.379  -3.156 -26.693
  148   HG13  VAL  21          3HG1      VAL  21 -11.579  -3.788 -25.253
  149   HG21  VAL  21          3HG2      VAL  21 -13.136  -0.589 -26.468
  150   HG22  VAL  21          1HG2      VAL  21 -13.485  -0.743 -24.746
  151   HG23  VAL  21          2HG2      VAL  21 -12.258   0.397 -25.298
  152    H    HIS  22           H        HIS  22  -8.699  -1.316 -24.992
  153    HA   HIS  22           HA       HIS  22  -7.555  -3.703 -23.758
  154    HB2  HIS  22           2HB      HIS  22  -7.384  -3.196 -26.735
  155    HB3  HIS  22           3HB      HIS  22  -6.674  -4.548 -25.858
  156    HD1  HIS  22           HD1      HIS  22  -8.635  -6.031 -24.518
  157    HD2  HIS  22           HD2      HIS  22  -9.753  -3.829 -27.859
  158    HE1  HIS  22           HE1      HIS  22 -10.803  -7.041 -25.294
  159    H    GLY  23           H        GLY  23  -5.117  -3.832 -24.487
  160    HA2  GLY  23           2HA      GLY  23  -3.193  -2.490 -25.162
  161    HA3  GLY  23           3HA      GLY  23  -4.026  -1.088 -24.509
  162    H    ILE  24           H        ILE  24  -2.444  -0.485 -23.072
  163    HA   ILE  24           HA       ILE  24  -2.275  -2.120 -20.667
  164    HB   ILE  24           HB       ILE  24   0.129  -2.009 -20.504
  165   HG12  ILE  24          2HG1      ILE  24   0.892  -1.232 -23.136
  166   HG13  ILE  24          3HG1      ILE  24  -0.163   0.021 -22.491
  167   HG21  ILE  24          1HG2      ILE  24   0.727  -3.598 -22.174
  168   HG22  ILE  24          2HG2      ILE  24  -0.964  -3.878 -21.763
  169   HG23  ILE  24          3HG2      ILE  24  -0.547  -3.032 -23.253
  170   HD11  ILE  24          3HD1      ILE  24   1.793   0.802 -21.696
  171   HD12  ILE  24          1HD1      ILE  24   1.433  -0.316 -20.381
  172   HD13  ILE  24          2HD1      ILE  24   2.547  -0.792 -21.664
  173    H    CYS  25           H        CYS  25  -0.540  -0.759 -19.165
  174    HA   CYS  25           HA       CYS  25  -0.624   2.050 -19.357
  175    HB2  CYS  25           2HB      CYS  25  -2.288   2.638 -17.742
  176    HB3  CYS  25           3HB      CYS  25  -3.058   1.575 -18.915
  177    H    ASN  26           H        ASN  26   0.444   3.087 -17.622
  178    HA   ASN  26           HA       ASN  26   1.791   1.228 -15.774
  179    HB2  ASN  26           2HB      ASN  26   3.312   2.198 -17.459
  180    HB3  ASN  26           3HB      ASN  26   2.862   3.815 -16.925
  181   HD21  ASN  26          1HD2      ASN  26   4.280   4.718 -15.640
  182   HD22  ASN  26          2HD2      ASN  26   5.316   3.903 -14.523
  183    H    GLU  27           H        GLU  27   0.022   4.184 -16.132
  184    HA   GLU  27           HA       GLU  27   0.328   4.742 -13.259
  185    HB2  GLU  27           2HB      GLU  27   0.017   6.451 -15.639
  186    HB3  GLU  27           3HB      GLU  27  -0.951   6.934 -14.252
  187    HG2  GLU  27           2HG      GLU  27   1.063   7.007 -12.871
  188    HG3  GLU  27           3HG      GLU  27   2.032   6.531 -14.265
  189    HA   PRO  28           HA       PRO  28  -3.862   3.776 -12.398
  190    HB2  PRO  28           2HB      PRO  28  -4.566   5.725 -10.644
  191    HB3  PRO  28           3HB      PRO  28  -3.464   4.408 -10.225
  192    HG2  PRO  28           2HG      PRO  28  -2.835   7.225 -11.022
  193    HG3  PRO  28           3HG      PRO  28  -2.115   6.238  -9.737
  194    HD2  PRO  28           2HD      PRO  28  -0.913   6.610 -12.135
  195    HD3  PRO  28           3HD      PRO  28  -0.738   5.110 -11.201
  196    H    TRP  29           H        TRP  29  -5.659   4.025 -13.557
  197    HA   TRP  29           HA       TRP  29  -7.301   4.932 -14.843
  198    HB2  TRP  29           2HB      TRP  29  -6.652   7.570 -13.526
  199    HB3  TRP  29           3HB      TRP  29  -8.189   7.060 -14.221
  200    HD1  TRP  29           HD1      TRP  29  -7.050   7.786 -11.006
  201    HE1  TRP  29           HE1      TRP  29  -8.093   6.310  -9.175
  202    HE3  TRP  29           HE3      TRP  29  -8.808   3.982 -13.934
  203    HZ2  TRP  29           HZ2      TRP  29  -9.478   3.857  -8.994
  204    HZ3  TRP  29           HZ3      TRP  29  -9.980   2.107 -12.854
  205    HH2  TRP  29           HH2      TRP  29 -10.307   2.048 -10.435
  206    H    GLN  30           H        GLN  30  -5.593   4.522 -16.542
  207    HA   GLN  30           HA       GLN  30  -5.277   6.956 -18.107
  208    HB2  GLN  30           2HB      GLN  30  -3.070   5.534 -16.827
  209    HB3  GLN  30           3HB      GLN  30  -2.857   5.704 -18.564
  210    HG2  GLN  30           2HG      GLN  30  -3.676   8.209 -17.809
  211    HG3  GLN  30           3HG      GLN  30  -2.676   7.694 -16.451
  212   HE21  GLN  30          1HE2      GLN  30  -2.741   8.689 -19.731
  213   HE22  GLN  30          2HE2      GLN  30  -1.034   8.696 -19.996
  214    H    CYS  31           H        CYS  31  -4.248   6.315 -20.327
  215    HA   CYS  31           HA       CYS  31  -5.135   3.653 -21.164
  216    HB2  CYS  31           2HB      CYS  31  -6.201   6.274 -22.131
  217    HB3  CYS  31           3HB      CYS  31  -6.053   4.946 -23.277
  218    H    LEU  32           H        LEU  32  -3.466   2.728 -22.132
  219    HA   LEU  32           HA       LEU  32  -1.772   4.367 -23.895
  220    HB2  LEU  32           2HB      LEU  32  -0.813   2.132 -22.116
  221    HB3  LEU  32           3HB      LEU  32   0.178   3.129 -23.180
  222    HG   LEU  32           HG       LEU  32  -1.226   4.003 -20.659
  223   HD11  LEU  32          1HD1      LEU  32   0.845   4.098 -19.660
  224   HD12  LEU  32          2HD1      LEU  32   1.703   4.197 -21.198
  225   HD13  LEU  32          3HD1      LEU  32   1.007   2.664 -20.674
  226   HD21  LEU  32          3HD2      LEU  32   0.511   6.003 -21.539
  227   HD22  LEU  32          1HD2      LEU  32  -1.251   6.056 -21.508
  228   HD23  LEU  32          2HD2      LEU  32  -0.411   5.524 -22.965
  229    H    CYS  33           H        CYS  33  -2.009   3.691 -25.913
  230    HA   CYS  33           HA       CYS  33  -2.025   0.809 -26.450
  231    HB2  CYS  33           2HB      CYS  33  -3.801   1.124 -28.152
  232    HB3  CYS  33           3HB      CYS  33  -4.361   1.462 -26.518
  233    H    GLU  34           H        GLU  34  -2.092   0.664 -29.078
  234    HA   GLU  34           HA       GLU  34   0.391   1.911 -29.874
  235    HB2  GLU  34           2HB      GLU  34  -1.079  -0.437 -30.598
  236    HB3  GLU  34           3HB      GLU  34  -0.772   0.509 -32.047
  237    HG2  GLU  34           2HG      GLU  34   1.331  -0.165 -32.104
  238    HG3  GLU  34           3HG      GLU  34   1.601   0.398 -30.455
  239    H    THR  35           H        THR  35   0.333   2.479 -32.417
  240    HA   THR  35           HA       THR  35  -1.248   4.875 -32.561
  241    HB   THR  35           HB       THR  35   0.504   3.670 -34.710
  242    HG1  THR  35           HG1      THR  35   2.148   4.371 -33.583
  243   HG21  THR  35          3HG2      THR  35  -1.180   5.987 -34.617
  244   HG22  THR  35          1HG2      THR  35  -0.192   5.386 -35.948
  245   HG23  THR  35          2HG2      THR  35   0.505   6.488 -34.761
  246    H    ASN  36           H        ASN  36  -1.328   1.682 -34.010
  247    HA   ASN  36           HA       ASN  36  -3.093   2.152 -36.116
  248    HB2  ASN  36           2HB      ASN  36  -1.795  -0.034 -35.194
  249    HB3  ASN  36           3HB      ASN  36  -3.430  -0.399 -34.651
  250   HD21  ASN  36          1HD2      ASN  36  -1.914   0.994 -37.546
  251   HD22  ASN  36          2HD2      ASN  36  -2.782   0.017 -38.676
  252    H    TRP  37           H        TRP  37  -3.676   1.775 -32.691
  253    HA   TRP  37           HA       TRP  37  -6.524   1.497 -32.960
  254    HB2  TRP  37           2HB      TRP  37  -4.880   2.167 -30.510
  255    HB3  TRP  37           3HB      TRP  37  -6.565   1.657 -30.521
  256    HD1  TRP  37           HD1      TRP  37  -3.094   0.239 -31.514
  257    HE1  TRP  37           HE1      TRP  37  -3.145  -2.308 -31.146
  258    HE3  TRP  37           HE3      TRP  37  -7.989  -0.283 -30.134
  259    HZ2  TRP  37           HZ2      TRP  37  -5.014  -4.277 -30.374
  260    HZ3  TRP  37           HZ3      TRP  37  -8.830  -2.532 -29.598
  261    HH2  TRP  37           HH2      TRP  37  -7.371  -4.487 -29.716
  262    H    GLY  38           H        GLY  38  -8.042   3.051 -32.978
  263    HA2  GLY  38           2HA      GLY  38  -7.099   5.837 -32.774
  264    HA3  GLY  38           3HA      GLY  38  -8.493   5.309 -33.704
  265    H    GLY  39           H        GLY  39  -8.084   7.314 -31.466
  266    HA2  GLY  39           2HA      GLY  39  -9.780   8.128 -30.041
  267    HA3  GLY  39           3HA      GLY  39 -10.467   6.512 -29.973
  268    H    GLN  40           H        GLN  40 -10.090   8.117 -27.710
  269    HA   GLN  40           HA       GLN  40  -7.687   7.538 -26.336
  270    HB2  GLN  40           2HB      GLN  40 -10.382   8.563 -25.559
  271    HB3  GLN  40           3HB      GLN  40  -9.289   8.024 -24.290
  272    HG2  GLN  40           2HG      GLN  40  -8.744  10.229 -24.379
  273    HG3  GLN  40           3HG      GLN  40  -7.586   9.580 -25.539
  274   HE21  GLN  40          1HE2      GLN  40 -10.144  11.736 -25.026
  275   HE22  GLN  40          2HE2      GLN  40 -10.343  12.270 -26.657
  276    H    LEU  41           H        LEU  41 -10.855   5.967 -26.403
  277    HA   LEU  41           HA       LEU  41 -10.346   4.073 -24.381
  278    HB2  LEU  41           2HB      LEU  41 -12.132   3.566 -26.736
  279    HB3  LEU  41           3HB      LEU  41 -12.304   2.987 -25.081
  280    HG   LEU  41           HG       LEU  41 -12.793   5.786 -26.091
  281   HD11  LEU  41          1HD1      LEU  41 -14.689   3.858 -24.770
  282   HD12  LEU  41          2HD1      LEU  41 -14.527   4.022 -26.518
  283   HD13  LEU  41          3HD1      LEU  41 -15.071   5.393 -25.551
  284   HD21  LEU  41          3HD2      LEU  41 -12.869   4.705 -23.276
  285   HD22  LEU  41          1HD2      LEU  41 -13.470   6.287 -23.775
  286   HD23  LEU  41          2HD2      LEU  41 -11.752   5.913 -23.911
  287    H    CYS  42           H        CYS  42  -9.405   4.245 -27.706
  288    HA   CYS  42           HA       CYS  42  -8.150   2.896 -29.040
  289    HB2  CYS  42           2HB      CYS  42  -7.260   1.658 -26.427
  290    HB3  CYS  42           3HB      CYS  42  -6.415   1.566 -27.969
  291    H    ASP  43           H        ASP  43 -10.296   1.996 -29.663
  292    HA   ASP  43           HA       ASP  43 -10.509  -0.844 -28.903
  293    HB2  ASP  43           2HB      ASP  43 -12.847  -0.753 -29.167
  294    HB3  ASP  43           3HB      ASP  43 -12.444   0.738 -28.318
  295    H    LYS  44           H        LYS  44 -11.896  -1.998 -30.760
  296    HA   LYS  44           HA       LYS  44 -10.221  -1.824 -33.114
  297    HB2  LYS  44           2HB      LYS  44 -11.375  -3.855 -33.832
  298    HB3  LYS  44           3HB      LYS  44 -10.797  -4.017 -32.179
  299    HG2  LYS  44           2HG      LYS  44 -13.429  -2.989 -32.061
  300    HG3  LYS  44           3HG      LYS  44 -13.430  -4.347 -33.189
  301    HD2  LYS  44           2HD      LYS  44 -11.931  -4.749 -30.678
  302    HD3  LYS  44           3HD      LYS  44 -13.684  -4.617 -30.519
  303    HE2  LYS  44           2HE      LYS  44 -13.775  -6.778 -31.056
  304    HE3  LYS  44           3HE      LYS  44 -13.335  -6.294 -32.693
  305    HZ1  LYS  44           3HZ      LYS  44 -11.656  -7.453 -30.584
  306    HZ2  LYS  44           1HZ      LYS  44 -10.938  -6.417 -31.713
  307    HZ3  LYS  44           2HZ      LYS  44 -11.720  -7.823 -32.234
  Start of MODEL    2
    1    H1   ARG   1           H        ARG   1   3.360   1.663  -5.490
    2    HA   ARG   1           HA       ARG   1   2.335   1.071  -2.983
    3    HB2  ARG   1           2HB      ARG   1   1.788   3.325  -4.900
    4    HB3  ARG   1           3HB      ARG   1   1.006   3.248  -3.327
    5    HG2  ARG   1           2HG      ARG   1   3.056   3.459  -2.185
    6    HG3  ARG   1           3HG      ARG   1   3.989   3.147  -3.650
    7    HD2  ARG   1           2HD      ARG   1   2.156   5.426  -3.838
    8    HD3  ARG   1           3HD      ARG   1   3.433   5.618  -2.638
    9    HE   ARG   1           HE       ARG   1   4.481   4.682  -5.104
   10   HH11  ARG   1          1HH1      ARG   1   3.274   7.535  -3.515
   11   HH12  ARG   1          2HH1      ARG   1   4.197   8.628  -4.493
   12   HH21  ARG   1          1HH2      ARG   1   5.701   6.111  -6.397
   13   HH22  ARG   1          2HH2      ARG   1   5.576   7.817  -6.132
   14    H    CYS   2           H        CYS   2   0.877  -0.525  -2.724
   15    HA   CYS   2           HA       CYS   2  -1.454  -0.651  -4.479
   16    HB2  CYS   2           2HB      CYS   2  -0.556  -2.533  -2.287
   17    HB3  CYS   2           3HB      CYS   2  -1.903  -2.808  -3.388
   18    H    GLN   3           H        GLN   3  -2.821   0.960  -3.851
   19    HA   GLN   3           HA       GLN   3  -4.055   0.635  -1.221
   20    HB2  GLN   3           2HB      GLN   3  -3.163   3.314  -2.298
   21    HB3  GLN   3           3HB      GLN   3  -4.033   3.039  -0.795
   22    HG2  GLN   3           2HG      GLN   3  -2.035   1.575  -0.137
   23    HG3  GLN   3           3HG      GLN   3  -1.197   2.365  -1.471
   24   HE21  GLN   3          1HE2      GLN   3   0.247   3.153   0.177
   25   HE22  GLN   3          2HE2      GLN   3  -0.179   4.557   1.088
   26    H    TYR   4           H        TYR   4  -4.163   2.341  -4.333
   27    HA   TYR   4           HA       TYR   4  -6.933   1.619  -4.674
   28    HB2  TYR   4           2HB      TYR   4  -7.082   3.666  -3.281
   29    HB3  TYR   4           3HB      TYR   4  -6.188   4.547  -4.515
   30    HD1  TYR   4           HD2      TYR   4  -8.988   2.094  -4.801
   31    HD2  TYR   4           HD1      TYR   4  -7.649   6.079  -5.458
   32    HE1  TYR   4           HE2      TYR   4 -11.098   2.606  -5.957
   33    HE2  TYR   4           HE1      TYR   4  -9.756   6.602  -6.615
   34    HH   TYR   4           HH       TYR   4 -11.820   5.876  -7.099
   35    H    GLY   5           H        GLY   5  -6.973   0.920  -6.700
   36    HA2  GLY   5           2HA      GLY   5  -7.026   1.563  -9.045
   37    HA3  GLY   5           3HA      GLY   5  -5.584   2.523  -8.752
   38    H    TRP   6           H        TRP   6  -5.754  -0.584  -7.279
   39    HA   TRP   6           HA       TRP   6  -4.367  -1.908  -9.460
   40    HB2  TRP   6           2HB      TRP   6  -3.052  -1.559  -6.757
   41    HB3  TRP   6           3HB      TRP   6  -2.419  -2.505  -8.101
   42    HD1  TRP   6           HD1      TRP   6  -2.296   0.895  -6.635
   43    HE1  TRP   6           HE1      TRP   6  -1.061   2.508  -8.214
   44    HE3  TRP   6           HE3      TRP   6  -2.168  -2.019 -10.834
   45    HZ2  TRP   6           HZ2      TRP   6  -0.153   2.542 -10.887
   46    HZ3  TRP   6           HZ3      TRP   6  -1.098  -1.121 -12.860
   47    HH2  TRP   6           HH2      TRP   6  -0.112   1.112 -12.884
   48    H    GLN   7           H        GLN   7  -5.924  -3.470  -9.556
   49    HA   GLN   7           HA       GLN   7  -6.143  -5.215  -7.195
   50    HB2  GLN   7           2HB      GLN   7  -8.467  -5.579  -7.605
   51    HB3  GLN   7           3HB      GLN   7  -8.207  -3.839  -7.590
   52    HG2  GLN   7           2HG      GLN   7  -8.246  -3.788 -10.014
   53    HG3  GLN   7           3HG      GLN   7  -8.440  -5.540 -10.062
   54   HE21  GLN   7          1HE2      GLN   7 -10.361  -5.136 -11.288
   55   HE22  GLN   7          2HE2      GLN   7 -11.829  -4.711 -10.484
   56    H    GLY   8           H        GLY   8  -7.568  -7.279  -8.219
   57    HA2  GLY   8           2HA      GLY   8  -7.623  -8.838 -10.041
   58    HA3  GLY   8           3HA      GLY   8  -6.131  -8.129 -10.642
   59    H    LEU   9           H        LEU   9  -4.661  -9.707 -10.618
   60    HA   LEU   9           HA       LEU   9  -4.633 -11.918  -8.918
   61    HB2  LEU   9           2HB      LEU   9  -3.135 -10.998 -11.070
   62    HB3  LEU   9           3HB      LEU   9  -1.974 -11.125  -9.750
   63    HG   LEU   9           HG       LEU   9  -2.877 -13.513  -9.452
   64   HD11  LEU   9          1HD1      LEU   9  -3.486 -13.756 -12.257
   65   HD12  LEU   9          2HD1      LEU   9  -4.617 -12.666 -11.456
   66   HD13  LEU   9          3HD1      LEU   9  -4.401 -14.309 -10.855
   67   HD21  LEU   9          3HD2      LEU   9  -1.129 -12.501 -11.649
   68   HD22  LEU   9          1HD2      LEU   9  -1.489 -14.224 -11.546
   69   HD23  LEU   9          2HD2      LEU   9  -0.702 -13.405 -10.196
   70    H    TYR  10           H        TYR  10  -2.543  -9.029  -8.778
   71    HA   TYR  10           HA       TYR  10  -2.597  -9.104  -5.884
   72    HB2  TYR  10           2HB      TYR  10  -0.100  -9.662  -7.472
   73    HB3  TYR  10           3HB      TYR  10  -0.030  -9.002  -5.842
   74    HD1  TYR  10           HD1      TYR  10  -0.946 -10.341  -3.938
   75    HD2  TYR  10           HD2      TYR  10  -0.523 -11.965  -7.848
   76    HE1  TYR  10           HE1      TYR  10  -1.119 -12.610  -3.007
   77    HE2  TYR  10           HE2      TYR  10  -0.696 -14.240  -6.927
   78    HH   TYR  10           HH       TYR  10  -0.341 -14.956  -3.720
   79    H    CYS  11           H        CYS  11  -0.572  -7.697  -8.465
   80    HA   CYS  11           HA       CYS  11  -1.670  -5.112  -8.280
   81    HB2  CYS  11           2HB      CYS  11   0.309  -5.766  -6.275
   82    HB3  CYS  11           3HB      CYS  11   0.884  -4.464  -7.312
   83    H    ASP  12           H        ASP  12  -1.472  -4.686 -10.380
   84    HA   ASP  12           HA       ASP  12   0.989  -4.040 -11.554
   85    HB2  ASP  12           2HB      ASP  12   1.512  -6.360 -11.680
   86    HB3  ASP  12           3HB      ASP  12  -0.104  -6.764 -12.255
   87    H    LYS  13           H        LYS  13  -2.327  -5.101 -12.036
   88    HA   LYS  13           HA       LYS  13  -2.536  -3.530 -14.492
   89    HB2  LYS  13           2HB      LYS  13  -3.944  -5.811 -13.349
   90    HB3  LYS  13           3HB      LYS  13  -5.048  -4.576 -13.939
   91    HG2  LYS  13           2HG      LYS  13  -4.315  -4.781 -16.127
   92    HG3  LYS  13           3HG      LYS  13  -2.790  -5.532 -15.650
   93    HD2  LYS  13           2HD      LYS  13  -3.732  -7.602 -15.398
   94    HD3  LYS  13           3HD      LYS  13  -5.318  -6.949 -14.981
   95    HE2  LYS  13           2HE      LYS  13  -4.356  -6.399 -17.718
   96    HE3  LYS  13           3HE      LYS  13  -4.743  -8.080 -17.355
   97    HZ1  LYS  13           3HZ      LYS  13  -6.814  -7.458 -17.871
   98    HZ2  LYS  13           1HZ      LYS  13  -6.500  -5.809 -17.655
   99    HZ3  LYS  13           2HZ      LYS  13  -6.854  -6.785 -16.319
  100    H    CYS  14           H        CYS  14  -3.686  -1.675 -14.673
  101    HA   CYS  14           HA       CYS  14  -4.656  -0.491 -12.175
  102    HB2  CYS  14           2HB      CYS  14  -4.417   1.643 -13.231
  103    HB3  CYS  14           3HB      CYS  14  -2.962   0.719 -13.592
  104    H    ILE  15           H        ILE  15  -6.150  -2.492 -13.774
  105    HA   ILE  15           HA       ILE  15  -8.260  -2.888 -14.535
  106    HB   ILE  15           HB       ILE  15  -9.246  -0.375 -13.265
  107   HG12  ILE  15          2HG1      ILE  15  -8.181  -2.773 -11.761
  108   HG13  ILE  15          3HG1      ILE  15  -7.549  -1.131 -11.696
  109   HG21  ILE  15          1HG2      ILE  15 -11.190  -1.523 -12.988
  110   HG22  ILE  15          2HG2      ILE  15 -10.549  -2.403 -14.374
  111   HG23  ILE  15          3HG2      ILE  15 -10.374  -3.068 -12.750
  112   HD11  ILE  15          3HD1      ILE  15 -10.068  -2.232 -10.530
  113   HD12  ILE  15          1HD1      ILE  15  -8.783  -1.310  -9.751
  114   HD13  ILE  15          2HD1      ILE  15  -9.901  -0.506 -10.853
  115    HA   PRO  16           HA       PRO  16  -7.817   0.180 -17.972
  116    HB2  PRO  16           2HB      PRO  16  -7.822  -1.691 -19.939
  117    HB3  PRO  16           3HB      PRO  16  -6.356  -1.203 -19.081
  118    HG2  PRO  16           2HG      PRO  16  -8.093  -3.602 -18.649
  119    HG3  PRO  16           3HG      PRO  16  -6.323  -3.491 -18.670
  120    HD2  PRO  16           2HD      PRO  16  -7.750  -3.592 -16.371
  121    HD3  PRO  16           3HD      PRO  16  -6.222  -2.698 -16.508
  122    H    HIS  17           H        HIS  17  -9.995  -2.446 -17.273
  123    HA   HIS  17           HA       HIS  17 -11.895  -2.258 -19.242
  124    HB2  HIS  17           2HB      HIS  17 -11.848  -3.134 -16.453
  125    HB3  HIS  17           3HB      HIS  17 -13.431  -2.555 -16.963
  126    HD1  HIS  17           HD1      HIS  17 -14.506  -4.870 -16.982
  127    HD2  HIS  17           HD2      HIS  17 -11.168  -4.574 -19.438
  128    HE1  HIS  17           HE1      HIS  17 -14.510  -6.963 -18.378
  129    HA   PRO  18           HA       PRO  18 -14.201   1.276 -16.919
  130    HB2  PRO  18           2HB      PRO  18 -13.003   2.353 -14.734
  131    HB3  PRO  18           3HB      PRO  18 -14.087   0.960 -14.646
  132    HG2  PRO  18           2HG      PRO  18 -11.095   1.033 -14.654
  133    HG3  PRO  18           3HG      PRO  18 -12.187   0.057 -13.655
  134    HD2  PRO  18           2HD      PRO  18 -10.928  -0.939 -15.835
  135    HD3  PRO  18           3HD      PRO  18 -12.536  -1.491 -15.326
  136    H    GLY  19           H        GLY  19 -13.290   2.129 -18.951
  137    HA2  GLY  19           2HA      GLY  19 -12.682   4.576 -19.298
  138    HA3  GLY  19           3HA      GLY  19 -11.180   4.141 -18.496
  139    H    CYS  20           H        CYS  20 -11.437   1.436 -19.925
  140    HA   CYS  20           HA       CYS  20 -10.930   2.180 -22.686
  141    HB2  CYS  20           2HB      CYS  20  -8.800   1.566 -20.763
  142    HB3  CYS  20           3HB      CYS  20  -8.735   0.591 -22.227
  143    H    VAL  21           H        VAL  21 -10.069   0.025 -23.838
  144    HA   VAL  21           HA       VAL  21 -11.856  -2.138 -22.931
  145    HB   VAL  21           HB       VAL  21 -10.992  -1.616 -25.775
  146   HG11  VAL  21          1HG1      VAL  21 -13.414  -3.172 -25.090
  147   HG12  VAL  21          2HG1      VAL  21 -12.249  -3.399 -26.396
  148   HG13  VAL  21          3HG1      VAL  21 -11.857  -3.931 -24.761
  149   HG21  VAL  21          3HG2      VAL  21 -12.388   0.144 -25.638
  150   HG22  VAL  21          1HG2      VAL  21 -13.650  -1.084 -25.737
  151   HG23  VAL  21          2HG2      VAL  21 -13.158  -0.449 -24.166
  152    H    HIS  22           H        HIS  22  -8.849  -1.504 -24.728
  153    HA   HIS  22           HA       HIS  22  -7.681  -3.890 -23.506
  154    HB2  HIS  22           2HB      HIS  22  -7.438  -3.351 -26.469
  155    HB3  HIS  22           3HB      HIS  22  -6.853  -4.758 -25.586
  156    HD1  HIS  22           HD1      HIS  22  -9.039  -6.017 -24.261
  157    HD2  HIS  22           HD2      HIS  22  -9.712  -3.927 -27.788
  158    HE1  HIS  22           HE1      HIS  22 -11.212  -6.904 -25.163
  159    H    GLY  23           H        GLY  23  -5.241  -3.991 -24.335
  160    HA2  GLY  23           2HA      GLY  23  -3.338  -2.616 -24.981
  161    HA3  GLY  23           3HA      GLY  23  -4.168  -1.242 -24.267
  162    H    ILE  24           H        ILE  24  -2.431  -0.733 -22.922
  163    HA   ILE  24           HA       ILE  24  -2.272  -2.400 -20.530
  164    HB   ILE  24           HB       ILE  24   0.205  -2.154 -20.451
  165   HG12  ILE  24          2HG1      ILE  24   0.251  -1.665 -23.389
  166   HG13  ILE  24          3HG1      ILE  24  -0.026  -0.282 -22.337
  167   HG21  ILE  24          1HG2      ILE  24  -0.765  -3.654 -22.878
  168   HG22  ILE  24          2HG2      ILE  24   0.670  -4.001 -21.915
  169   HG23  ILE  24          3HG2      ILE  24  -0.934  -4.223 -21.217
  170   HD11  ILE  24          3HD1      ILE  24   2.140  -1.696 -21.244
  171   HD12  ILE  24          1HD1      ILE  24   2.419  -1.598 -22.983
  172   HD13  ILE  24          2HD1      ILE  24   2.157  -0.126 -22.047
  173    H    CYS  25           H        CYS  25  -0.597  -1.156 -18.964
  174    HA   CYS  25           HA       CYS  25  -0.555   1.674 -19.131
  175    HB2  CYS  25           2HB      CYS  25  -2.174   2.269 -17.469
  176    HB3  CYS  25           3HB      CYS  25  -2.991   1.264 -18.661
  177    H    ASN  26           H        ASN  26   0.622   2.630 -17.445
  178    HA   ASN  26           HA       ASN  26   1.789   0.746 -15.504
  179    HB2  ASN  26           2HB      ASN  26   3.953   1.636 -15.828
  180    HB3  ASN  26           3HB      ASN  26   3.306   1.423 -17.453
  181   HD21  ASN  26          1HD2      ASN  26   2.169   3.391 -18.335
  182   HD22  ASN  26          2HD2      ASN  26   2.930   4.916 -18.050
  183    H    GLU  27           H        GLU  27  -0.433   2.698 -15.291
  184    HA   GLU  27           HA       GLU  27   0.444   3.946 -12.838
  185    HB2  GLU  27           2HB      GLU  27  -0.000   5.485 -15.321
  186    HB3  GLU  27           3HB      GLU  27  -0.776   6.129 -13.881
  187    HG2  GLU  27           2HG      GLU  27   1.498   5.938 -12.762
  188    HG3  GLU  27           3HG      GLU  27   2.146   5.685 -14.381
  189    HA   PRO  28           HA       PRO  28  -3.714   3.278 -11.610
  190    HB2  PRO  28           2HB      PRO  28  -4.190   5.392  -9.975
  191    HB3  PRO  28           3HB      PRO  28  -3.125   4.054  -9.529
  192    HG2  PRO  28           2HG      PRO  28  -2.420   6.762 -10.593
  193    HG3  PRO  28           3HG      PRO  28  -1.655   5.839  -9.286
  194    HD2  PRO  28           2HD      PRO  28  -0.618   5.959 -11.785
  195    HD3  PRO  28           3HD      PRO  28  -0.448   4.528 -10.748
  196    H    TRP  29           H        TRP  29  -5.369   3.465 -12.981
  197    HA   TRP  29           HA       TRP  29  -7.039   4.348 -14.246
  198    HB2  TRP  29           2HB      TRP  29  -6.492   6.977 -12.863
  199    HB3  TRP  29           3HB      TRP  29  -7.999   6.440 -13.600
  200    HD1  TRP  29           HD1      TRP  29  -6.931   7.116 -10.346
  201    HE1  TRP  29           HE1      TRP  29  -7.972   5.572  -8.570
  202    HE3  TRP  29           HE3      TRP  29  -8.554   3.349 -13.397
  203    HZ2  TRP  29           HZ2      TRP  29  -9.304   3.085  -8.474
  204    HZ3  TRP  29           HZ3      TRP  29  -9.702   1.423 -12.384
  205    HH2  TRP  29           HH2      TRP  29 -10.068   1.296  -9.973
  206    H    GLN  30           H        GLN  30  -5.773   4.092 -16.142
  207    HA   GLN  30           HA       GLN  30  -5.334   6.557 -17.550
  208    HB2  GLN  30           2HB      GLN  30  -3.090   5.111 -16.368
  209    HB3  GLN  30           3HB      GLN  30  -2.916   5.336 -18.103
  210    HG2  GLN  30           2HG      GLN  30  -3.785   7.798 -17.068
  211    HG3  GLN  30           3HG      GLN  30  -2.524   7.212 -15.984
  212   HE21  GLN  30          1HE2      GLN  30  -0.552   7.788 -16.509
  213   HE22  GLN  30          2HE2      GLN  30   0.020   8.156 -18.097
  214    H    CYS  31           H        CYS  31  -4.180   5.903 -19.783
  215    HA   CYS  31           HA       CYS  31  -5.114   3.299 -20.704
  216    HB2  CYS  31           2HB      CYS  31  -6.244   5.930 -21.566
  217    HB3  CYS  31           3HB      CYS  31  -6.095   4.641 -22.756
  218    H    LEU  32           H        LEU  32  -3.682   2.415 -22.044
  219    HA   LEU  32           HA       LEU  32  -2.064   4.095 -23.788
  220    HB2  LEU  32           2HB      LEU  32  -0.790   2.102 -21.923
  221    HB3  LEU  32           3HB      LEU  32   0.030   3.158 -23.071
  222    HG   LEU  32           HG       LEU  32  -1.528   4.192 -20.710
  223   HD11  LEU  32          1HD1      LEU  32   0.238   3.972 -19.337
  224   HD12  LEU  32          2HD1      LEU  32   1.411   4.239 -20.626
  225   HD13  LEU  32          3HD1      LEU  32   0.670   2.651 -20.424
  226   HD21  LEU  32          3HD2      LEU  32   0.676   5.780 -21.683
  227   HD22  LEU  32          1HD2      LEU  32  -1.020   6.215 -21.476
  228   HD23  LEU  32          2HD2      LEU  32  -0.485   5.443 -22.968
  229    H    CYS  33           H        CYS  33  -1.707   3.163 -25.713
  230    HA   CYS  33           HA       CYS  33  -1.644   0.292 -26.017
  231    HB2  CYS  33           2HB      CYS  33  -3.468   0.372 -27.789
  232    HB3  CYS  33           3HB      CYS  33  -4.004   0.494 -26.116
  233    H    GLU  34           H        GLU  34  -1.062  -0.365 -28.203
  234    HA   GLU  34           HA       GLU  34   1.030   1.084 -29.281
  235    HB2  GLU  34           2HB      GLU  34   0.074  -1.392 -29.696
  236    HB3  GLU  34           3HB      GLU  34  -0.517  -0.615 -31.158
  237    HG2  GLU  34           2HG      GLU  34   1.729   0.046 -31.757
  238    HG3  GLU  34           3HG      GLU  34   2.353  -0.627 -30.253
  239    H    THR  35           H        THR  35   1.188   1.984 -31.511
  240    HA   THR  35           HA       THR  35  -0.593   4.151 -31.821
  241    HB   THR  35           HB       THR  35   1.391   3.043 -33.818
  242    HG1  THR  35           HG1      THR  35   2.820   4.467 -32.893
  243   HG21  THR  35          3HG2      THR  35   1.180   5.763 -34.210
  244   HG22  THR  35          1HG2      THR  35  -0.488   5.272 -33.916
  245   HG23  THR  35          2HG2      THR  35   0.438   4.516 -35.213
  246    H    ASN  36           H        ASN  36  -0.522   0.939 -33.165
  247    HA   ASN  36           HA       ASN  36  -2.063   1.212 -35.438
  248    HB2  ASN  36           2HB      ASN  36  -1.507  -0.965 -33.521
  249    HB3  ASN  36           3HB      ASN  36  -2.973  -1.163 -34.477
  250   HD21  ASN  36          1HD2      ASN  36   0.180   0.256 -35.248
  251   HD22  ASN  36          2HD2      ASN  36   0.507  -0.776 -36.595
  252    H    TRP  37           H        TRP  37  -3.069   1.155 -32.074
  253    HA   TRP  37           HA       TRP  37  -5.877   1.066 -32.699
  254    HB2  TRP  37           2HB      TRP  37  -4.582   1.805 -30.070
  255    HB3  TRP  37           3HB      TRP  37  -6.237   1.259 -30.326
  256    HD1  TRP  37           HD1      TRP  37  -2.621  -0.092 -30.487
  257    HE1  TRP  37           HE1      TRP  37  -2.699  -2.634 -30.093
  258    HE3  TRP  37           HE3      TRP  37  -7.691  -0.739 -30.357
  259    HZ2  TRP  37           HZ2      TRP  37  -4.650  -4.648 -29.769
  260    HZ3  TRP  37           HZ3      TRP  37  -8.582  -3.005 -30.001
  261    HH2  TRP  37           HH2      TRP  37  -7.091  -4.918 -29.714
  262    H    GLY  38           H        GLY  38  -7.170   2.730 -33.150
  263    HA2  GLY  38           2HA      GLY  38  -6.097   5.448 -32.735
  264    HA3  GLY  38           3HA      GLY  38  -7.222   5.002 -34.009
  265    H    GLY  39           H        GLY  39  -8.807   3.343 -32.109
  266    HA2  GLY  39           2HA      GLY  39 -10.804   5.142 -31.469
  267    HA3  GLY  39           3HA      GLY  39 -10.594   3.583 -30.685
  268    H    GLN  40           H        GLN  40 -11.610   5.847 -29.379
  269    HA   GLN  40           HA       GLN  40  -9.573   7.158 -27.870
  270    HB2  GLN  40           2HB      GLN  40 -12.005   7.922 -28.360
  271    HB3  GLN  40           3HB      GLN  40 -12.430   6.923 -26.976
  272    HG2  GLN  40           2HG      GLN  40 -11.378   8.298 -25.480
  273    HG3  GLN  40           3HG      GLN  40 -10.251   8.925 -26.681
  274   HE21  GLN  40          1HE2      GLN  40 -10.561  10.998 -27.003
  275   HE22  GLN  40          2HE2      GLN  40 -12.087  11.805 -27.079
  276    H    LEU  41           H        LEU  41 -11.414   4.231 -27.499
  277    HA   LEU  41           HA       LEU  41 -10.305   3.850 -24.803
  278    HB2  LEU  41           2HB      LEU  41 -12.435   2.157 -26.067
  279    HB3  LEU  41           3HB      LEU  41 -12.040   2.331 -24.358
  280    HG   LEU  41           HG       LEU  41 -13.357   4.425 -26.087
  281   HD11  LEU  41          1HD1      LEU  41 -15.087   3.796 -24.075
  282   HD12  LEU  41          2HD1      LEU  41 -14.382   2.225 -24.456
  283   HD13  LEU  41          3HD1      LEU  41 -15.171   3.168 -25.721
  284   HD21  LEU  41          3HD2      LEU  41 -13.757   5.480 -23.810
  285   HD22  LEU  41          1HD2      LEU  41 -12.117   5.575 -24.453
  286   HD23  LEU  41          2HD2      LEU  41 -12.507   4.392 -23.204
  287    H    CYS  42           H        CYS  42  -8.897   3.473 -27.398
  288    HA   CYS  42           HA       CYS  42  -7.510   1.989 -28.430
  289    HB2  CYS  42           2HB      CYS  42  -7.538   0.766 -25.663
  290    HB3  CYS  42           3HB      CYS  42  -6.373   0.374 -26.923
  291    H    ASP  43           H        ASP  43 -10.136   1.475 -28.999
  292    HA   ASP  43           HA       ASP  43 -10.344  -1.459 -28.884
  293    HB2  ASP  43           2HB      ASP  43 -12.283  -0.474 -27.903
  294    HB3  ASP  43           3HB      ASP  43 -12.449   0.676 -29.227
  295    H    LYS  44           H        LYS  44 -10.241   1.323 -30.988
  296    HA   LYS  44           HA       LYS  44 -10.411  -0.450 -33.332
  297    HB2  LYS  44           2HB      LYS  44 -10.867   2.529 -33.097
  298    HB3  LYS  44           3HB      LYS  44 -10.867   1.643 -34.617
  299    HG2  LYS  44           2HG      LYS  44 -13.036   1.313 -34.339
  300    HG3  LYS  44           3HG      LYS  44 -12.649   0.267 -32.971
  301    HD2  LYS  44           2HD      LYS  44 -13.032   1.942 -31.416
  302    HD3  LYS  44           3HD      LYS  44 -12.789   3.232 -32.597
  303    HE2  LYS  44           2HE      LYS  44 -14.908   2.972 -33.503
  304    HE3  LYS  44           3HE      LYS  44 -15.075   1.325 -32.899
  305    HZ1  LYS  44           3HZ      LYS  44 -15.642   3.844 -31.584
  306    HZ2  LYS  44           1HZ      LYS  44 -14.861   2.694 -30.619
  307    HZ3  LYS  44           2HZ      LYS  44 -16.338   2.319 -31.353
  Start of MODEL    3
    1    H1   ARG   1           H        ARG   1  -1.156   0.858   1.120
    2    HA   ARG   1           HA       ARG   1  -0.252   1.668  -0.862
    3    HB2  ARG   1           2HB      ARG   1   1.950   1.021  -1.624
    4    HB3  ARG   1           3HB      ARG   1   2.027   1.429   0.085
    5    HG2  ARG   1           2HG      ARG   1   1.882  -1.020   0.584
    6    HG3  ARG   1           3HG      ARG   1   2.057  -1.313  -1.147
    7    HD2  ARG   1           2HD      ARG   1   4.234  -0.500  -1.191
    8    HD3  ARG   1           3HD      ARG   1   4.030   0.399   0.312
    9    HE   ARG   1           HE       ARG   1   3.752  -2.193   1.069
   10   HH11  ARG   1          1HH1      ARG   1   6.185  -0.432  -0.692
   11   HH12  ARG   1          2HH1      ARG   1   7.488  -1.441  -0.159
   12   HH21  ARG   1          1HH2      ARG   1   5.459  -3.530   1.778
   13   HH22  ARG   1          2HH2      ARG   1   7.073  -3.204   1.245
   14    H    CYS   2           H        CYS   2  -0.042   0.802  -3.085
   15    HA   CYS   2           HA       CYS   2  -0.853  -0.499  -4.766
   16    HB2  CYS   2           2HB      CYS   2   0.253  -2.504  -2.835
   17    HB3  CYS   2           3HB      CYS   2  -0.628  -3.065  -4.252
   18    H    GLN   3           H        GLN   3  -2.984   0.378  -4.294
   19    HA   GLN   3           HA       GLN   3  -4.925  -1.693  -4.011
   20    HB2  GLN   3           2HB      GLN   3  -6.112  -0.570  -2.071
   21    HB3  GLN   3           3HB      GLN   3  -4.646  -1.456  -1.673
   22    HG2  GLN   3           2HG      GLN   3  -3.396   0.655  -1.644
   23    HG3  GLN   3           3HG      GLN   3  -4.889   1.527  -1.991
   24   HE21  GLN   3          1HE2      GLN   3  -3.355  -0.624   0.343
   25   HE22  GLN   3          2HE2      GLN   3  -4.224  -0.045   1.720
   26    H    TYR   4           H        TYR   4  -4.325   1.796  -3.936
   27    HA   TYR   4           HA       TYR   4  -6.901   2.438  -5.036
   28    HB2  TYR   4           2HB      TYR   4  -5.080   3.858  -3.603
   29    HB3  TYR   4           3HB      TYR   4  -4.748   4.450  -5.227
   30    HD1  TYR   4           HD2      TYR   4  -7.182   4.778  -6.560
   31    HD2  TYR   4           HD1      TYR   4  -6.433   5.276  -2.401
   32    HE1  TYR   4           HE2      TYR   4  -9.106   6.302  -6.401
   33    HE2  TYR   4           HE1      TYR   4  -8.356   6.800  -2.231
   34    HH   TYR   4           HH       TYR   4 -10.008   7.993  -5.031
   35    H    GLY   5           H        GLY   5  -7.336   1.842  -7.066
   36    HA2  GLY   5           2HA      GLY   5  -7.228   1.848  -9.365
   37    HA3  GLY   5           3HA      GLY   5  -5.894   2.985  -9.241
   38    H    TRP   6           H        TRP   6  -5.595   0.019  -7.528
   39    HA   TRP   6           HA       TRP   6  -4.063  -1.205  -9.702
   40    HB2  TRP   6           2HB      TRP   6  -2.996  -0.623  -6.935
   41    HB3  TRP   6           3HB      TRP   6  -2.233  -1.747  -8.056
   42    HD1  TRP   6           HD1      TRP   6  -1.871   1.661  -6.953
   43    HE1  TRP   6           HE1      TRP   6  -0.647   3.112  -8.692
   44    HE3  TRP   6           HE3      TRP   6  -2.266  -1.425 -11.010
   45    HZ2  TRP   6           HZ2      TRP   6   0.057   2.968 -11.421
   46    HZ3  TRP   6           HZ3      TRP   6  -1.291  -0.694 -13.147
   47    HH2  TRP   6           HH2      TRP   6  -0.154   1.458 -13.347
   48    H    GLN   7           H        GLN   7  -5.675  -2.774  -9.870
   49    HA   GLN   7           HA       GLN   7  -6.313  -4.381  -7.529
   50    HB2  GLN   7           2HB      GLN   7  -7.984  -5.436  -8.904
   51    HB3  GLN   7           3HB      GLN   7  -8.089  -3.696  -9.132
   52    HG2  GLN   7           2HG      GLN   7  -6.944  -3.855 -11.242
   53    HG3  GLN   7           3HG      GLN   7  -6.673  -5.580 -11.002
   54   HE21  GLN   7          1HE2      GLN   7  -7.746  -5.476 -13.192
   55   HE22  GLN   7          2HE2      GLN   7  -9.467  -5.623 -13.218
   56    H    GLY   8           H        GLY   8  -6.656  -6.877  -8.454
   57    HA2  GLY   8           2HA      GLY   8  -5.555  -8.676  -9.582
   58    HA3  GLY   8           3HA      GLY   8  -4.110  -7.682  -9.685
   59    H    LEU   9           H        LEU   9  -3.267  -9.855  -8.885
   60    HA   LEU   9           HA       LEU   9  -3.727 -10.817  -6.320
   61    HB2  LEU   9           2HB      LEU   9  -2.212 -11.639  -8.339
   62    HB3  LEU   9           3HB      LEU   9  -0.951 -10.870  -7.376
   63    HG   LEU   9           HG       LEU   9  -1.674 -12.339  -5.460
   64   HD11  LEU   9          1HD1      LEU   9  -3.645 -13.111  -7.446
   65   HD12  LEU   9          2HD1      LEU   9  -3.622 -13.388  -5.705
   66   HD13  LEU   9          3HD1      LEU   9  -2.773 -14.494  -6.784
   67   HD21  LEU   9          3HD2      LEU   9   0.285 -12.753  -6.990
   68   HD22  LEU   9          1HD2      LEU   9  -0.749 -13.871  -7.881
   69   HD23  LEU   9          2HD2      LEU   9  -0.369 -14.181  -6.186
   70    H    TYR  10           H        TYR  10  -1.950  -8.036  -7.374
   71    HA   TYR  10           HA       TYR  10  -1.603  -7.191  -4.628
   72    HB2  TYR  10           2HB      TYR  10   0.696  -7.924  -6.401
   73    HB3  TYR  10           3HB      TYR  10   0.879  -6.602  -5.254
   74    HD1  TYR  10           HD1      TYR  10   0.499  -7.075  -2.797
   75    HD2  TYR  10           HD2      TYR  10   0.852 -10.166  -5.699
   76    HE1  TYR  10           HE1      TYR  10   0.990  -8.690  -1.008
   77    HE2  TYR  10           HE2      TYR  10   1.344 -11.790  -3.919
   78    HH   TYR  10           HH       TYR  10   2.421 -11.282  -1.213
   79    H    CYS  11           H        CYS  11  -0.107  -6.284  -7.732
   80    HA   CYS  11           HA       CYS  11  -1.776  -4.112  -8.295
   81    HB2  CYS  11           2HB      CYS  11  -0.130  -2.263  -7.709
   82    HB3  CYS  11           3HB      CYS  11  -0.994  -2.989  -6.357
   83    H    ASP  12           H        ASP  12  -1.559  -3.995 -10.419
   84    HA   ASP  12           HA       ASP  12   0.957  -3.497 -11.669
   85    HB2  ASP  12           2HB      ASP  12   0.753  -6.090 -11.227
   86    HB3  ASP  12           3HB      ASP  12  -0.290  -6.034 -12.645
   87    H    LYS  13           H        LYS  13  -2.400  -4.520 -12.058
   88    HA   LYS  13           HA       LYS  13  -2.548  -3.164 -14.644
   89    HB2  LYS  13           2HB      LYS  13  -4.085  -5.275 -13.282
   90    HB3  LYS  13           3HB      LYS  13  -5.062  -4.126 -14.186
   91    HG2  LYS  13           2HG      LYS  13  -3.670  -4.575 -16.181
   92    HG3  LYS  13           3HG      LYS  13  -2.805  -5.807 -15.258
   93    HD2  LYS  13           2HD      LYS  13  -4.349  -7.225 -16.046
   94    HD3  LYS  13           3HD      LYS  13  -5.427  -6.497 -14.853
   95    HE2  LYS  13           2HE      LYS  13  -6.706  -6.223 -16.719
   96    HE3  LYS  13           3HE      LYS  13  -5.774  -4.728 -16.793
   97    HZ1  LYS  13           3HZ      LYS  13  -4.189  -6.421 -18.131
   98    HZ2  LYS  13           1HZ      LYS  13  -5.333  -5.413 -18.865
   99    HZ3  LYS  13           2HZ      LYS  13  -5.713  -7.029 -18.542
  100    H    CYS  14           H        CYS  14  -3.764  -1.364 -15.025
  101    HA   CYS  14           HA       CYS  14  -4.722   0.058 -12.648
  102    HB2  CYS  14           2HB      CYS  14  -4.508   2.077 -13.910
  103    HB3  CYS  14           3HB      CYS  14  -3.050   1.133 -14.198
  104    H    ILE  15           H        ILE  15  -6.201  -2.109 -14.045
  105    HA   ILE  15           HA       ILE  15  -8.304  -2.597 -14.775
  106    HB   ILE  15           HB       ILE  15  -9.328  -0.025 -13.663
  107   HG12  ILE  15          2HG1      ILE  15  -8.198  -2.296 -12.015
  108   HG13  ILE  15          3HG1      ILE  15  -7.600  -0.641 -12.067
  109   HG21  ILE  15          1HG2      ILE  15 -11.245  -1.190 -13.287
  110   HG22  ILE  15          2HG2      ILE  15 -10.600  -2.148 -14.620
  111   HG23  ILE  15          3HG2      ILE  15 -10.395  -2.700 -12.957
  112   HD11  ILE  15          3HD1      ILE  15  -9.667  -1.791 -10.443
  113   HD12  ILE  15          1HD1      ILE  15  -8.889  -0.213 -10.324
  114   HD13  ILE  15          2HD1      ILE  15 -10.290  -0.429 -11.374
  115    HA   PRO  16           HA       PRO  16  -7.959   0.246 -18.411
  116    HB2  PRO  16           2HB      PRO  16  -7.943  -1.751 -20.251
  117    HB3  PRO  16           3HB      PRO  16  -6.479  -1.177 -19.443
  118    HG2  PRO  16           2HG      PRO  16  -8.160  -3.578 -18.835
  119    HG3  PRO  16           3HG      PRO  16  -6.393  -3.432 -18.882
  120    HD2  PRO  16           2HD      PRO  16  -7.795  -3.410 -16.566
  121    HD3  PRO  16           3HD      PRO  16  -6.288  -2.496 -16.779
  122    H    HIS  17           H        HIS  17 -10.073  -2.372 -17.516
  123    HA   HIS  17           HA       HIS  17 -11.996  -2.355 -19.472
  124    HB2  HIS  17           2HB      HIS  17 -11.900  -3.047 -16.634
  125    HB3  HIS  17           3HB      HIS  17 -13.501  -2.530 -17.157
  126    HD1  HIS  17           HD1      HIS  17 -14.488  -4.891 -16.958
  127    HD2  HIS  17           HD2      HIS  17 -11.280  -4.632 -19.586
  128    HE1  HIS  17           HE1      HIS  17 -14.484  -7.060 -18.231
  129    HA   PRO  18           HA       PRO  18 -14.355   1.277 -17.363
  130    HB2  PRO  18           2HB      PRO  18 -13.159   2.520 -15.267
  131    HB3  PRO  18           3HB      PRO  18 -14.213   1.114 -15.076
  132    HG2  PRO  18           2HG      PRO  18 -11.223   1.249 -15.121
  133    HG3  PRO  18           3HG      PRO  18 -12.285   0.319 -14.047
  134    HD2  PRO  18           2HD      PRO  18 -11.025  -0.793 -16.170
  135    HD3  PRO  18           3HD      PRO  18 -12.616  -1.344 -15.608
  136    H    GLY  19           H        GLY  19 -13.498   2.024 -19.452
  137    HA2  GLY  19           2HA      GLY  19 -12.943   4.445 -19.978
  138    HA3  GLY  19           3HA      GLY  19 -11.429   4.109 -19.151
  139    H    CYS  20           H        CYS  20 -11.642   1.299 -20.396
  140    HA   CYS  20           HA       CYS  20 -11.127   1.874 -23.196
  141    HB2  CYS  20           2HB      CYS  20  -9.007   1.331 -21.220
  142    HB3  CYS  20           3HB      CYS  20  -8.922   0.357 -22.685
  143    H    VAL  21           H        VAL  21 -10.245  -0.341 -24.208
  144    HA   VAL  21           HA       VAL  21 -11.957  -2.488 -23.130
  145    HB   VAL  21           HB       VAL  21 -11.326  -2.030 -26.047
  146   HG11  VAL  21          1HG1      VAL  21 -12.823  -3.773 -26.521
  147   HG12  VAL  21          2HG1      VAL  21 -11.850  -4.372 -25.175
  148   HG13  VAL  21          3HG1      VAL  21 -13.482  -3.767 -24.885
  149   HG21  VAL  21          3HG2      VAL  21 -12.706  -0.213 -25.326
  150   HG22  VAL  21          1HG2      VAL  21 -13.726  -1.352 -26.207
  151   HG23  VAL  21          2HG2      VAL  21 -13.774  -1.305 -24.445
  152    H    HIS  22           H        HIS  22  -9.067  -1.793 -25.075
  153    HA   HIS  22           HA       HIS  22  -7.784  -4.149 -23.914
  154    HB2  HIS  22           2HB      HIS  22  -7.734  -3.602 -26.887
  155    HB3  HIS  22           3HB      HIS  22  -6.999  -4.966 -26.049
  156    HD1  HIS  22           HD1      HIS  22  -8.986  -6.383 -24.598
  157    HD2  HIS  22           HD2      HIS  22 -10.066  -4.307 -28.031
  158    HE1  HIS  22           HE1      HIS  22 -11.157  -7.406 -25.347
  159    H    GLY  23           H        GLY  23  -5.381  -4.191 -24.735
  160    HA2  GLY  23           2HA      GLY  23  -3.528  -2.789 -25.482
  161    HA3  GLY  23           3HA      GLY  23  -4.378  -1.414 -24.792
  162    H    ILE  24           H        ILE  24  -2.703  -0.786 -23.453
  163    HA   ILE  24           HA       ILE  24  -2.420  -2.392 -21.038
  164    HB   ILE  24           HB       ILE  24   0.058  -2.014 -21.018
  165   HG12  ILE  24          2HG1      ILE  24   0.170  -1.804 -23.948
  166   HG13  ILE  24          3HG1      ILE  24  -0.429  -0.357 -23.145
  167   HG21  ILE  24          1HG2      ILE  24  -0.661  -3.682 -23.395
  168   HG22  ILE  24          2HG2      ILE  24   0.514  -4.001 -22.120
  169   HG23  ILE  24          3HG2      ILE  24  -1.211  -4.134 -21.782
  170   HD11  ILE  24          3HD1      ILE  24   1.643   0.228 -22.668
  171   HD12  ILE  24          1HD1      ILE  24   1.854  -1.251 -21.732
  172   HD13  ILE  24          2HD1      ILE  24   2.241  -1.234 -23.452
  173    H    CYS  25           H        CYS  25  -0.762  -1.045 -19.537
  174    HA   CYS  25           HA       CYS  25  -0.838   1.780 -19.777
  175    HB2  CYS  25           2HB      CYS  25  -2.445   2.356 -18.103
  176    HB3  CYS  25           3HB      CYS  25  -3.245   1.273 -19.237
  177    H    ASN  26           H        ASN  26   0.287   2.840 -18.094
  178    HA   ASN  26           HA       ASN  26   1.729   1.010 -16.290
  179    HB2  ASN  26           2HB      ASN  26   3.678   2.370 -16.493
  180    HB3  ASN  26           3HB      ASN  26   3.084   2.100 -18.129
  181   HD21  ASN  26          1HD2      ASN  26   4.049   4.381 -15.878
  182   HD22  ASN  26          2HD2      ASN  26   3.513   5.801 -16.702
  183    H    GLU  27           H        GLU  27  -0.090   3.942 -16.594
  184    HA   GLU  27           HA       GLU  27   0.326   4.526 -13.740
  185    HB2  GLU  27           2HB      GLU  27  -0.110   6.210 -16.118
  186    HB3  GLU  27           3HB      GLU  27  -1.029   6.689 -14.698
  187    HG2  GLU  27           2HG      GLU  27   0.966   6.937 -13.406
  188    HG3  GLU  27           3HG      GLU  27   1.946   6.252 -14.701
  189    HA   PRO  28           HA       PRO  28  -3.809   3.503 -12.696
  190    HB2  PRO  28           2HB      PRO  28  -4.469   5.455 -10.929
  191    HB3  PRO  28           3HB      PRO  28  -3.329   4.159 -10.547
  192    HG2  PRO  28           2HG      PRO  28  -2.779   6.978 -11.391
  193    HG3  PRO  28           3HG      PRO  28  -1.989   6.014 -10.130
  194    HD2  PRO  28           2HD      PRO  28  -0.896   6.384 -12.580
  195    HD3  PRO  28           3HD      PRO  28  -0.658   4.895 -11.643
  196    H    TRP  29           H        TRP  29  -5.646   3.711 -13.798
  197    HA   TRP  29           HA       TRP  29  -7.357   4.582 -15.016
  198    HB2  TRP  29           2HB      TRP  29  -6.699   7.240 -13.743
  199    HB3  TRP  29           3HB      TRP  29  -8.253   6.702 -14.375
  200    HD1  TRP  29           HD1      TRP  29  -7.000   7.465 -11.210
  201    HE1  TRP  29           HE1      TRP  29  -7.950   5.984  -9.331
  202    HE3  TRP  29           HE3      TRP  29  -8.815   3.618 -14.047
  203    HZ2  TRP  29           HZ2      TRP  29  -9.290   3.512  -9.084
  204    HZ3  TRP  29           HZ3      TRP  29  -9.917   1.733 -12.911
  205    HH2  TRP  29           HH2      TRP  29 -10.148   1.683 -10.481
  206    H    GLN  30           H        GLN  30  -5.684   4.188 -16.768
  207    HA   GLN  30           HA       GLN  30  -5.479   6.618 -18.363
  208    HB2  GLN  30           2HB      GLN  30  -3.187   5.142 -17.239
  209    HB3  GLN  30           3HB      GLN  30  -3.069   5.505 -18.956
  210    HG2  GLN  30           2HG      GLN  30  -3.925   7.753 -17.281
  211    HG3  GLN  30           3HG      GLN  30  -2.294   7.165 -16.963
  212   HE21  GLN  30          1HE2      GLN  30  -0.701   7.725 -18.305
  213   HE22  GLN  30          2HE2      GLN  30  -0.909   8.588 -19.788
  214    H    CYS  31           H        CYS  31  -4.508   5.966 -20.616
  215    HA   CYS  31           HA       CYS  31  -5.366   3.286 -21.407
  216    HB2  CYS  31           2HB      CYS  31  -6.593   5.859 -22.305
  217    HB3  CYS  31           3HB      CYS  31  -6.450   4.542 -23.465
  218    H    LEU  32           H        LEU  32  -3.810   2.404 -22.582
  219    HA   LEU  32           HA       LEU  32  -2.270   4.106 -24.415
  220    HB2  LEU  32           2HB      LEU  32  -1.080   1.953 -22.675
  221    HB3  LEU  32           3HB      LEU  32  -0.216   2.990 -23.808
  222    HG   LEU  32           HG       LEU  32  -1.592   3.934 -21.293
  223   HD11  LEU  32          1HD1      LEU  32   0.366   3.789 -20.167
  224   HD12  LEU  32          2HD1      LEU  32   1.346   4.040 -21.612
  225   HD13  LEU  32          3HD1      LEU  32   0.632   2.459 -21.296
  226   HD21  LEU  32          3HD2      LEU  32   0.420   5.665 -22.423
  227   HD22  LEU  32          1HD2      LEU  32  -1.256   6.014 -21.998
  228   HD23  LEU  32          2HD2      LEU  32  -0.870   5.346 -23.584
  229    H    CYS  33           H        CYS  33  -2.504   3.374 -26.411
  230    HA   CYS  33           HA       CYS  33  -2.481   0.481 -26.883
  231    HB2  CYS  33           2HB      CYS  33  -4.306   0.755 -28.563
  232    HB3  CYS  33           3HB      CYS  33  -4.825   1.048 -26.906
  233    H    GLU  34           H        GLU  34  -1.953  -0.101 -29.098
  234    HA   GLU  34           HA       GLU  34   0.204   1.411 -30.114
  235    HB2  GLU  34           2HB      GLU  34  -1.113  -1.112 -30.719
  236    HB3  GLU  34           3HB      GLU  34  -0.591  -0.278 -32.176
  237    HG2  GLU  34           2HG      GLU  34   1.252  -1.545 -31.683
  238    HG3  GLU  34           3HG      GLU  34   1.658  -0.017 -30.904
  239    H    THR  35           H        THR  35   0.370   2.199 -32.372
  240    HA   THR  35           HA       THR  35  -1.509   4.209 -32.889
  241    HB   THR  35           HB       THR  35   0.386   3.023 -34.921
  242    HG1  THR  35           HG1      THR  35   1.826   4.683 -34.098
  243   HG21  THR  35          3HG2      THR  35  -0.542   4.583 -36.228
  244   HG22  THR  35          1HG2      THR  35   0.274   5.773 -35.216
  245   HG23  THR  35          2HG2      THR  35  -1.395   5.320 -34.873
  246    H    ASN  36           H        ASN  36  -1.332   0.896 -33.954
  247    HA   ASN  36           HA       ASN  36  -2.976   0.977 -36.199
  248    HB2  ASN  36           2HB      ASN  36  -2.748  -1.223 -34.131
  249    HB3  ASN  36           3HB      ASN  36  -3.422  -1.406 -35.748
  250   HD21  ASN  36          1HD2      ASN  36  -1.757  -0.232 -37.395
  251   HD22  ASN  36          2HD2      ASN  36  -0.164  -0.892 -37.293
  252    H    TRP  37           H        TRP  37  -3.762   1.127 -32.808
  253    HA   TRP  37           HA       TRP  37  -6.589   0.696 -33.237
  254    HB2  TRP  37           2HB      TRP  37  -5.136   1.636 -30.755
  255    HB3  TRP  37           3HB      TRP  37  -6.808   1.087 -30.836
  256    HD1  TRP  37           HD1      TRP  37  -3.251  -0.339 -31.439
  257    HE1  TRP  37           HE1      TRP  37  -3.287  -2.838 -30.825
  258    HE3  TRP  37           HE3      TRP  37  -8.223  -0.838 -30.356
  259    HZ2  TRP  37           HZ2      TRP  37  -5.173  -4.766 -29.993
  260    HZ3  TRP  37           HZ3      TRP  37  -9.062  -3.043 -29.659
  261    HH2  TRP  37           HH2      TRP  37  -7.567  -4.965 -29.482
  262    H    GLY  38           H        GLY  38  -8.132   2.357 -32.231
  263    HA2  GLY  38           2HA      GLY  38  -7.231   5.111 -32.706
  264    HA3  GLY  38           3HA      GLY  38  -8.606   4.508 -33.620
  265    H    GLY  39           H        GLY  39  -8.533   6.735 -31.764
  266    HA2  GLY  39           2HA      GLY  39 -10.146   7.597 -30.332
  267    HA3  GLY  39           3HA      GLY  39 -10.837   5.988 -30.188
  268    H    GLN  40           H        GLN  40 -10.800   7.339 -27.933
  269    HA   GLN  40           HA       GLN  40  -8.372   7.070 -26.446
  270    HB2  GLN  40           2HB      GLN  40 -10.460   8.655 -26.097
  271    HB3  GLN  40           3HB      GLN  40 -11.022   7.323 -25.096
  272    HG2  GLN  40           2HG      GLN  40  -9.125   7.499 -23.666
  273    HG3  GLN  40           3HG      GLN  40  -8.351   8.656 -24.747
  274   HE21  GLN  40          1HE2      GLN  40  -8.929   8.991 -21.961
  275   HE22  GLN  40          2HE2      GLN  40  -9.999  10.340 -21.824
  276    H    LEU  41           H        LEU  41 -11.494   5.361 -26.392
  277    HA   LEU  41           HA       LEU  41 -10.843   3.486 -24.427
  278    HB2  LEU  41           2HB      LEU  41 -12.627   2.903 -26.771
  279    HB3  LEU  41           3HB      LEU  41 -12.732   2.263 -25.132
  280    HG   LEU  41           HG       LEU  41 -13.411   5.056 -26.043
  281   HD11  LEU  41          1HD1      LEU  41 -15.654   4.490 -25.390
  282   HD12  LEU  41          2HD1      LEU  41 -15.129   2.910 -24.809
  283   HD13  LEU  41          3HD1      LEU  41 -15.066   3.281 -26.532
  284   HD21  LEU  41          3HD2      LEU  41 -14.050   5.470 -23.715
  285   HD22  LEU  41          1HD2      LEU  41 -12.324   5.143 -23.868
  286   HD23  LEU  41          2HD2      LEU  41 -13.407   3.891 -23.260
  287    H    CYS  42           H        CYS  42  -9.935   3.683 -27.759
  288    HA   CYS  42           HA       CYS  42  -8.600   2.405 -29.083
  289    HB2  CYS  42           2HB      CYS  42  -7.689   1.273 -26.429
  290    HB3  CYS  42           3HB      CYS  42  -6.855   1.063 -27.965
  291    H    ASP  43           H        ASP  43 -11.038   1.497 -29.242
  292    HA   ASP  43           HA       ASP  43 -10.947  -1.401 -28.749
  293    HB2  ASP  43           2HB      ASP  43 -12.880   0.020 -27.860
  294    HB3  ASP  43           3HB      ASP  43 -13.390   0.181 -29.539
  295    H    LYS  44           H        LYS  44 -11.162   1.041 -31.215
  296    HA   LYS  44           HA       LYS  44 -11.166  -1.081 -33.260
  297    HB2  LYS  44           2HB      LYS  44 -12.310   0.492 -34.773
  298    HB3  LYS  44           3HB      LYS  44 -13.273   0.133 -33.346
  299    HG2  LYS  44           2HG      LYS  44 -13.551   2.388 -33.456
  300    HG3  LYS  44           3HG      LYS  44 -12.118   2.312 -32.428
  301    HD2  LYS  44           2HD      LYS  44 -11.158   3.687 -33.904
  302    HD3  LYS  44           3HD      LYS  44 -11.079   2.295 -34.988
  303    HE2  LYS  44           2HE      LYS  44 -13.640   3.161 -35.365
  304    HE3  LYS  44           3HE      LYS  44 -12.784   4.678 -35.090
  305    HZ1  LYS  44           3HZ      LYS  44 -11.644   2.725 -36.961
  306    HZ2  LYS  44           1HZ      LYS  44 -11.519   4.412 -36.959
  307    HZ3  LYS  44           2HZ      LYS  44 -12.952   3.671 -37.468
  Start of MODEL    4
    1    H1   ARG   1           H        ARG   1   0.006   4.319  -3.365
    2    HA   ARG   1           HA       ARG   1  -1.531   2.519  -1.703
    3    HB2  ARG   1           2HB      ARG   1  -2.251   4.531  -3.824
    4    HB3  ARG   1           3HB      ARG   1  -3.449   3.441  -3.139
    5    HG2  ARG   1           2HG      ARG   1  -2.427   4.411  -0.873
    6    HG3  ARG   1           3HG      ARG   1  -2.102   5.779  -1.940
    7    HD2  ARG   1           2HD      ARG   1  -4.221   6.218  -1.044
    8    HD3  ARG   1           3HD      ARG   1  -4.542   5.580  -2.656
    9    HE   ARG   1           HE       ARG   1  -4.565   3.484  -0.767
   10   HH11  ARG   1          1HH1      ARG   1  -6.438   6.226  -1.812
   11   HH12  ARG   1          2HH1      ARG   1  -7.953   5.545  -1.318
   12   HH21  ARG   1          1HH2      ARG   1  -6.553   2.576  -0.113
   13   HH22  ARG   1          2HH2      ARG   1  -8.017   3.469  -0.351
   14    H    CYS   2           H        CYS   2  -1.144   0.428  -2.264
   15    HA   CYS   2           HA       CYS   2  -1.254  -0.361  -5.067
   16    HB2  CYS   2           2HB      CYS   2   0.113  -1.321  -2.793
   17    HB3  CYS   2           3HB      CYS   2  -1.026  -2.583  -3.252
   18    H    GLN   3           H        GLN   3  -3.138  -0.568  -2.137
   19    HA   GLN   3           HA       GLN   3  -4.900  -2.612  -2.747
   20    HB2  GLN   3           2HB      GLN   3  -4.790  -1.377  -0.583
   21    HB3  GLN   3           3HB      GLN   3  -5.607  -0.024  -1.355
   22    HG2  GLN   3           2HG      GLN   3  -6.935  -2.647  -1.571
   23    HG3  GLN   3           3HG      GLN   3  -6.874  -1.926   0.036
   24   HE21  GLN   3          1HE2      GLN   3  -7.843   0.125   0.356
   25   HE22  GLN   3          2HE2      GLN   3  -9.100   0.683  -0.689
   26    H    TYR   4           H        TYR   4  -5.389   0.865  -3.382
   27    HA   TYR   4           HA       TYR   4  -7.379   0.128  -5.418
   28    HB2  TYR   4           2HB      TYR   4  -8.100   1.627  -3.536
   29    HB3  TYR   4           3HB      TYR   4  -6.969   2.835  -4.135
   30    HD1  TYR   4           HD2      TYR   4  -9.786   0.713  -5.377
   31    HD2  TYR   4           HD1      TYR   4  -7.777   4.459  -5.563
   32    HE1  TYR   4           HE2      TYR   4 -11.509   1.554  -6.917
   33    HE2  TYR   4           HE1      TYR   4  -9.495   5.311  -7.102
   34    HH   TYR   4           HH       TYR   4 -12.278   3.313  -8.036
   35    H    GLY   5           H        GLY   5  -6.946   0.454  -7.502
   36    HA2  GLY   5           2HA      GLY   5  -6.137   1.848  -9.290
   37    HA3  GLY   5           3HA      GLY   5  -4.857   2.401  -8.221
   38    H    TRP   6           H        TRP   6  -4.581  -0.536  -7.367
   39    HA   TRP   6           HA       TRP   6  -3.184  -1.511  -9.765
   40    HB2  TRP   6           2HB      TRP   6  -2.108  -1.304  -6.954
   41    HB3  TRP   6           3HB      TRP   6  -1.400  -2.378  -8.157
   42    HD1  TRP   6           HD1      TRP   6  -0.886   0.926  -6.792
   43    HE1  TRP   6           HE1      TRP   6   0.458   2.425  -8.395
   44    HE3  TRP   6           HE3      TRP   6  -1.323  -1.853 -11.060
   45    HZ2  TRP   6           HZ2      TRP   6   1.231   2.429 -11.110
   46    HZ3  TRP   6           HZ3      TRP   6  -0.252  -1.031 -13.118
   47    HH2  TRP   6           HH2      TRP   6   0.997   1.066 -13.140
   48    H    GLN   7           H        GLN   7  -4.671  -3.086 -10.236
   49    HA   GLN   7           HA       GLN   7  -5.708  -4.856  -8.232
   50    HB2  GLN   7           2HB      GLN   7  -6.117  -4.373 -11.089
   51    HB3  GLN   7           3HB      GLN   7  -6.201  -6.075 -10.655
   52    HG2  GLN   7           2HG      GLN   7  -7.816  -5.347  -8.820
   53    HG3  GLN   7           3HG      GLN   7  -7.904  -3.812  -9.682
   54   HE21  GLN   7          1HE2      GLN   7  -7.918  -4.517 -12.265
   55   HE22  GLN   7          2HE2      GLN   7  -9.299  -5.486 -12.634
   56    H    GLY   8           H        GLY   8  -5.604  -7.330  -8.859
   57    HA2  GLY   8           2HA      GLY   8  -4.278  -9.187  -9.453
   58    HA3  GLY   8           3HA      GLY   8  -2.919  -8.104  -9.714
   59    H    LEU   9           H        LEU   9  -2.165 -10.204  -8.438
   60    HA   LEU   9           HA       LEU   9  -2.523  -9.955  -5.573
   61    HB2  LEU   9           2HB      LEU   9  -2.422 -12.166  -6.580
   62    HB3  LEU   9           3HB      LEU   9  -0.816 -11.819  -7.217
   63    HG   LEU   9           HG       LEU   9   0.008 -11.661  -4.870
   64   HD11  LEU   9          1HD1      LEU   9  -1.648 -12.976  -3.284
   65   HD12  LEU   9          2HD1      LEU   9  -2.855 -12.241  -4.340
   66   HD13  LEU   9          3HD1      LEU   9  -1.721 -11.222  -3.454
   67   HD21  LEU   9          3HD2      LEU   9   0.278 -13.968  -4.621
   68   HD22  LEU   9          1HD2      LEU   9   0.025 -13.750  -6.353
   69   HD23  LEU   9          2HD2      LEU   9  -1.296 -14.324  -5.334
   70    H    TYR  10           H        TYR  10  -0.007  -9.398  -7.977
   71    HA   TYR  10           HA       TYR  10   1.677  -8.218  -5.869
   72    HB2  TYR  10           2HB      TYR  10   2.580  -9.139  -8.600
   73    HB3  TYR  10           3HB      TYR  10   3.597  -8.665  -7.245
   74    HD1  TYR  10           HD1      TYR  10   2.803 -10.095  -4.988
   75    HD2  TYR  10           HD2      TYR  10   2.664 -11.394  -9.037
   76    HE1  TYR  10           HE1      TYR  10   2.897 -12.434  -4.234
   77    HE2  TYR  10           HE2      TYR  10   2.756 -13.737  -8.294
   78    HH   TYR  10           HH       TYR  10   1.995 -14.854  -5.629
   79    H    CYS  11           H        CYS  11  -0.576  -6.968  -7.343
   80    HA   CYS  11           HA       CYS  11  -1.105  -5.019  -8.397
   81    HB2  CYS  11           2HB      CYS  11   1.541  -4.299  -7.137
   82    HB3  CYS  11           3HB      CYS  11   0.528  -3.120  -7.962
   83    H    ASP  12           H        ASP  12  -1.048  -5.873 -10.508
   84    HA   ASP  12           HA       ASP  12   1.100  -4.753 -12.141
   85    HB2  ASP  12           2HB      ASP  12   1.451  -7.274 -11.554
   86    HB3  ASP  12           3HB      ASP  12   0.172  -7.544 -12.735
   87    H    LYS  13           H        LYS  13  -1.398  -3.685 -11.866
   88    HA   LYS  13           HA       LYS  13  -2.302  -3.579 -14.542
   89    HB2  LYS  13           2HB      LYS  13  -3.610  -5.504 -12.761
   90    HB3  LYS  13           3HB      LYS  13  -4.728  -4.374 -13.514
   91    HG2  LYS  13           2HG      LYS  13  -3.163  -5.121 -15.624
   92    HG3  LYS  13           3HG      LYS  13  -3.246  -6.605 -14.672
   93    HD2  LYS  13           2HD      LYS  13  -5.646  -4.975 -15.498
   94    HD3  LYS  13           3HD      LYS  13  -5.054  -6.390 -16.372
   95    HE2  LYS  13           2HE      LYS  13  -5.415  -7.775 -14.405
   96    HE3  LYS  13           3HE      LYS  13  -5.948  -6.366 -13.491
   97    HZ1  LYS  13           3HZ      LYS  13  -7.984  -6.579 -14.306
   98    HZ2  LYS  13           1HZ      LYS  13  -7.519  -8.054 -14.993
   99    HZ3  LYS  13           2HZ      LYS  13  -7.424  -6.630 -15.902
  100    H    CYS  14           H        CYS  14  -3.104  -1.605 -14.838
  101    HA   CYS  14           HA       CYS  14  -3.866  -0.043 -12.488
  102    HB2  CYS  14           2HB      CYS  14  -3.508   1.906 -13.824
  103    HB3  CYS  14           3HB      CYS  14  -2.165   0.813 -14.141
  104    H    ILE  15           H        ILE  15  -5.601  -2.096 -13.784
  105    HA   ILE  15           HA       ILE  15  -7.768  -2.391 -14.429
  106    HB   ILE  15           HB       ILE  15  -8.504   0.269 -13.297
  107   HG12  ILE  15          2HG1      ILE  15  -7.513  -2.087 -11.678
  108   HG13  ILE  15          3HG1      ILE  15  -6.772  -0.494 -11.769
  109   HG21  ILE  15          1HG2      ILE  15 -10.004  -1.735 -14.180
  110   HG22  ILE  15          2HG2      ILE  15  -9.775  -2.296 -12.524
  111   HG23  ILE  15          3HG2      ILE  15 -10.500  -0.717 -12.828
  112   HD11  ILE  15          3HD1      ILE  15  -9.023  -1.437 -10.166
  113   HD12  ILE  15          1HD1      ILE  15  -7.896  -0.111  -9.881
  114   HD13  ILE  15          2HD1      ILE  15  -9.284   0.124 -10.945
  115    HA   PRO  16           HA       PRO  16  -7.317   0.394 -18.099
  116    HB2  PRO  16           2HB      PRO  16  -7.560  -1.603 -19.922
  117    HB3  PRO  16           3HB      PRO  16  -6.017  -1.162 -19.180
  118    HG2  PRO  16           2HG      PRO  16  -7.883  -3.397 -18.484
  119    HG3  PRO  16           3HG      PRO  16  -6.114  -3.413 -18.606
  120    HD2  PRO  16           2HD      PRO  16  -7.410  -3.254 -16.234
  121    HD3  PRO  16           3HD      PRO  16  -5.836  -2.483 -16.516
  122    H    HIS  17           H        HIS  17  -9.622  -2.015 -17.096
  123    HA   HIS  17           HA       HIS  17 -11.615  -1.830 -18.971
  124    HB2  HIS  17           2HB      HIS  17 -11.458  -2.531 -16.143
  125    HB3  HIS  17           3HB      HIS  17 -13.023  -1.853 -16.583
  126    HD1  HIS  17           HD1      HIS  17 -14.337  -4.015 -16.462
  127    HD2  HIS  17           HD2      HIS  17 -11.048  -4.247 -18.989
  128    HE1  HIS  17           HE1      HIS  17 -14.590  -6.191 -17.697
  129    HA   PRO  18           HA       PRO  18 -13.543   2.009 -16.791
  130    HB2  PRO  18           2HB      PRO  18 -12.151   3.145 -14.755
  131    HB3  PRO  18           3HB      PRO  18 -13.319   1.841 -14.510
  132    HG2  PRO  18           2HG      PRO  18 -10.334   1.702 -14.681
  133    HG3  PRO  18           3HG      PRO  18 -11.430   0.876 -13.558
  134    HD2  PRO  18           2HD      PRO  18 -10.367  -0.353 -15.724
  135    HD3  PRO  18           3HD      PRO  18 -11.977  -0.754 -15.092
  136    H    GLY  19           H        GLY  19 -12.702   2.661 -18.921
  137    HA2  GLY  19           2HA      GLY  19 -11.953   5.024 -19.482
  138    HA3  GLY  19           3HA      GLY  19 -10.441   4.548 -18.722
  139    H    CYS  20           H        CYS  20 -10.960   1.770 -19.937
  140    HA   CYS  20           HA       CYS  20 -10.549   2.278 -22.765
  141    HB2  CYS  20           2HB      CYS  20  -8.364   1.611 -20.903
  142    HB3  CYS  20           3HB      CYS  20  -8.433   0.609 -22.348
  143    H    VAL  21           H        VAL  21  -9.885  -0.007 -23.791
  144    HA   VAL  21           HA       VAL  21 -11.685  -2.011 -22.590
  145    HB   VAL  21           HB       VAL  21 -11.180  -1.627 -25.542
  146   HG11  VAL  21          1HG1      VAL  21 -11.798  -3.922 -24.650
  147   HG12  VAL  21          2HG1      VAL  21 -13.361  -3.222 -24.225
  148   HG13  VAL  21          3HG1      VAL  21 -12.839  -3.259 -25.909
  149   HG21  VAL  21          3HG2      VAL  21 -12.399   0.283 -24.681
  150   HG22  VAL  21          1HG2      VAL  21 -13.479  -0.740 -25.628
  151   HG23  VAL  21          2HG2      VAL  21 -13.543  -0.782 -23.866
  152    H    HIS  22           H        HIS  22  -8.850  -1.542 -24.675
  153    HA   HIS  22           HA       HIS  22  -7.687  -3.977 -23.556
  154    HB2  HIS  22           2HB      HIS  22  -7.784  -3.453 -26.533
  155    HB3  HIS  22           3HB      HIS  22  -7.045  -4.839 -25.736
  156    HD1  HIS  22           HD1      HIS  22  -8.961  -6.195 -24.159
  157    HD2  HIS  22           HD2      HIS  22 -10.233  -4.049 -27.481
  158    HE1  HIS  22           HE1      HIS  22 -11.221  -7.132 -24.739
  159    H    GLY  23           H        GLY  23  -5.339  -4.198 -24.549
  160    HA2  GLY  23           2HA      GLY  23  -3.441  -2.919 -25.399
  161    HA3  GLY  23           3HA      GLY  23  -4.143  -1.499 -24.636
  162    H    ILE  24           H        ILE  24  -2.441  -0.973 -23.330
  163    HA   ILE  24           HA       ILE  24  -2.086  -2.657 -20.988
  164    HB   ILE  24           HB       ILE  24   0.361  -2.584 -21.082
  165   HG12  ILE  24          2HG1      ILE  24   0.578  -1.996 -23.927
  166   HG13  ILE  24          3HG1      ILE  24  -0.039  -0.623 -23.014
  167   HG21  ILE  24          1HG2      ILE  24  -0.850  -4.540 -21.941
  168   HG22  ILE  24          2HG2      ILE  24  -0.845  -3.824 -23.552
  169   HG23  ILE  24          3HG2      ILE  24   0.676  -4.284 -22.787
  170   HD11  ILE  24          3HD1      ILE  24   1.951  -1.095 -21.434
  171   HD12  ILE  24          1HD1      ILE  24   2.597  -2.002 -22.801
  172   HD13  ILE  24          2HD1      ILE  24   2.237  -0.283 -22.973
  173    H    CYS  25           H        CYS  25  -0.202  -1.437 -19.609
  174    HA   CYS  25           HA       CYS  25  -0.111   1.383 -19.792
  175    HB2  CYS  25           2HB      CYS  25  -1.575   2.043 -18.016
  176    HB3  CYS  25           3HB      CYS  25  -2.515   1.048 -19.124
  177    H    ASN  26           H        ASN  26   1.173   2.333 -18.156
  178    HA   ASN  26           HA       ASN  26   2.582   0.374 -16.464
  179    HB2  ASN  26           2HB      ASN  26   4.613   1.481 -16.832
  180    HB3  ASN  26           3HB      ASN  26   3.838   1.520 -18.414
  181   HD21  ASN  26          1HD2      ASN  26   3.057   3.459 -19.216
  182   HD22  ASN  26          2HD2      ASN  26   3.505   4.984 -18.538
  183    H    GLU  27           H        GLU  27   0.946   3.421 -16.616
  184    HA   GLU  27           HA       GLU  27   1.537   3.897 -13.771
  185    HB2  GLU  27           2HB      GLU  27   1.177   5.687 -16.085
  186    HB3  GLU  27           3HB      GLU  27   0.365   6.206 -14.614
  187    HG2  GLU  27           2HG      GLU  27   2.456   6.145 -13.399
  188    HG3  GLU  27           3HG      GLU  27   3.291   5.533 -14.826
  189    HA   PRO  28           HA       PRO  28  -2.639   3.233 -12.608
  190    HB2  PRO  28           2HB      PRO  28  -3.053   5.183 -10.765
  191    HB3  PRO  28           3HB      PRO  28  -2.029   3.775 -10.460
  192    HG2  PRO  28           2HG      PRO  28  -1.243   6.555 -11.246
  193    HG3  PRO  28           3HG      PRO  28  -0.507   5.482 -10.041
  194    HD2  PRO  28           2HD      PRO  28   0.535   5.824 -12.516
  195    HD3  PRO  28           3HD      PRO  28   0.662   4.291 -11.630
  196    H    TRP  29           H        TRP  29  -4.518   3.661 -13.574
  197    HA   TRP  29           HA       TRP  29  -6.173   4.723 -14.716
  198    HB2  TRP  29           2HB      TRP  29  -5.201   7.272 -13.421
  199    HB3  TRP  29           3HB      TRP  29  -6.827   6.902 -13.989
  200    HD1  TRP  29           HD1      TRP  29  -5.367   7.468 -10.874
  201    HE1  TRP  29           HE1      TRP  29  -6.370   6.042  -8.980
  202    HE3  TRP  29           HE3      TRP  29  -7.668   3.876 -13.693
  203    HZ2  TRP  29           HZ2      TRP  29  -7.929   3.704  -8.716
  204    HZ3  TRP  29           HZ3      TRP  29  -8.893   2.080 -12.542
  205    HH2  TRP  29           HH2      TRP  29  -9.019   1.997 -10.105
  206    H    GLN  30           H        GLN  30  -4.967   4.275 -16.674
  207    HA   GLN  30           HA       GLN  30  -4.540   6.658 -18.214
  208    HB2  GLN  30           2HB      GLN  30  -2.256   5.122 -17.158
  209    HB3  GLN  30           3HB      GLN  30  -2.186   5.463 -18.882
  210    HG2  GLN  30           2HG      GLN  30  -2.958   7.843 -17.545
  211    HG3  GLN  30           3HG      GLN  30  -1.559   7.167 -16.712
  212   HE21  GLN  30          1HE2      GLN  30   0.233   6.452 -18.200
  213   HE22  GLN  30          2HE2      GLN  30   0.608   7.498 -19.523
  214    H    CYS  31           H        CYS  31  -3.698   5.982 -20.498
  215    HA   CYS  31           HA       CYS  31  -4.704   3.330 -21.236
  216    HB2  CYS  31           2HB      CYS  31  -5.745   5.972 -22.178
  217    HB3  CYS  31           3HB      CYS  31  -5.727   4.614 -23.298
  218    H    LEU  32           H        LEU  32  -3.364   2.318 -22.577
  219    HA   LEU  32           HA       LEU  32  -1.668   3.892 -24.376
  220    HB2  LEU  32           2HB      LEU  32  -0.646   1.635 -22.660
  221    HB3  LEU  32           3HB      LEU  32   0.288   2.584 -23.814
  222    HG   LEU  32           HG       LEU  32  -0.915   3.610 -21.243
  223   HD11  LEU  32          1HD1      LEU  32   1.275   2.049 -21.464
  224   HD12  LEU  32          2HD1      LEU  32   1.066   3.290 -20.229
  225   HD13  LEU  32          3HD1      LEU  32   1.992   3.645 -21.687
  226   HD21  LEU  32          3HD2      LEU  32  -0.617   5.661 -22.029
  227   HD22  LEU  32          1HD2      LEU  32  -0.154   4.987 -23.592
  228   HD23  LEU  32          2HD2      LEU  32   1.077   5.306 -22.370
  229    H    CYS  33           H        CYS  33  -1.915   3.179 -26.378
  230    HA   CYS  33           HA       CYS  33  -2.096   0.315 -26.892
  231    HB2  CYS  33           2HB      CYS  33  -4.048   0.585 -28.366
  232    HB3  CYS  33           3HB      CYS  33  -4.431   1.013 -26.702
  233    H    GLU  34           H        GLU  34  -2.285   0.042 -29.432
  234    HA   GLU  34           HA       GLU  34   0.044   1.344 -30.501
  235    HB2  GLU  34           2HB      GLU  34  -1.359  -1.059 -30.991
  236    HB3  GLU  34           3HB      GLU  34  -1.412  -0.138 -32.487
  237    HG2  GLU  34           2HG      GLU  34   1.183   0.159 -31.845
  238    HG3  GLU  34           3HG      GLU  34   0.860  -1.420 -31.131
  239    H    THR  35           H        THR  35  -0.191   1.958 -32.980
  240    HA   THR  35           HA       THR  35  -1.807   4.314 -33.025
  241    HB   THR  35           HB       THR  35  -0.280   3.055 -35.312
  242    HG1  THR  35           HG1      THR  35   1.371   4.537 -34.657
  243   HG21  THR  35          3HG2      THR  35  -0.240   5.784 -35.627
  244   HG22  THR  35          1HG2      THR  35  -1.869   5.490 -35.021
  245   HG23  THR  35          2HG2      THR  35  -1.310   4.671 -36.480
  246    H    ASN  36           H        ASN  36  -2.070   1.093 -34.376
  247    HA   ASN  36           HA       ASN  36  -4.019   1.512 -36.315
  248    HB2  ASN  36           2HB      ASN  36  -3.748  -0.903 -34.510
  249    HB3  ASN  36           3HB      ASN  36  -4.559  -0.855 -36.073
  250   HD21  ASN  36          1HD2      ASN  36  -2.866   0.481 -37.655
  251   HD22  ASN  36          2HD2      ASN  36  -1.359  -0.353 -37.789
  252    H    TRP  37           H        TRP  37  -4.310   1.211 -32.831
  253    HA   TRP  37           HA       TRP  37  -7.170   1.039 -32.832
  254    HB2  TRP  37           2HB      TRP  37  -5.295   1.764 -30.571
  255    HB3  TRP  37           3HB      TRP  37  -6.986   1.298 -30.409
  256    HD1  TRP  37           HD1      TRP  37  -3.636  -0.242 -31.603
  257    HE1  TRP  37           HE1      TRP  37  -3.717  -2.772 -31.142
  258    HE3  TRP  37           HE3      TRP  37  -8.434  -0.597 -29.875
  259    HZ2  TRP  37           HZ2      TRP  37  -5.570  -4.669 -30.173
  260    HZ3  TRP  37           HZ3      TRP  37  -9.284  -2.806 -29.202
  261    HH2  TRP  37           HH2      TRP  37  -7.880  -4.798 -29.349
  262    H    GLY  38           H        GLY  38  -8.673   2.629 -32.528
  263    HA2  GLY  38           2HA      GLY  38  -7.654   5.391 -32.713
  264    HA3  GLY  38           3HA      GLY  38  -9.207   4.850 -33.332
  265    H    GLY  39           H        GLY  39  -8.795   7.081 -31.607
  266    HA2  GLY  39           2HA      GLY  39  -9.944   8.015 -29.839
  267    HA3  GLY  39           3HA      GLY  39 -10.759   6.474 -29.619
  268    H    GLN  40           H        GLN  40 -10.165   7.783 -27.386
  269    HA   GLN  40           HA       GLN  40  -7.571   7.159 -26.351
  270    HB2  GLN  40           2HB      GLN  40 -10.103   8.268 -25.198
  271    HB3  GLN  40           3HB      GLN  40  -8.819   7.732 -24.123
  272    HG2  GLN  40           2HG      GLN  40  -8.333   9.959 -24.348
  273    HG3  GLN  40           3HG      GLN  40  -7.314   9.249 -25.599
  274   HE21  GLN  40          1HE2      GLN  40  -7.232  10.743 -27.138
  275   HE22  GLN  40          2HE2      GLN  40  -8.600  11.479 -27.893
  276    H    LEU  41           H        LEU  41 -10.821   5.803 -25.931
  277    HA   LEU  41           HA       LEU  41 -10.221   3.876 -24.013
  278    HB2  LEU  41           2HB      LEU  41 -12.185   3.455 -26.248
  279    HB3  LEU  41           3HB      LEU  41 -12.248   2.816 -24.607
  280    HG   LEU  41           HG       LEU  41 -12.733   5.664 -25.470
  281   HD11  LEU  41          1HD1      LEU  41 -14.632   3.911 -23.971
  282   HD12  LEU  41          2HD1      LEU  41 -14.498   3.780 -25.724
  283   HD13  LEU  41          3HD1      LEU  41 -14.963   5.313 -24.988
  284   HD21  LEU  41          3HD2      LEU  41 -11.547   5.730 -23.386
  285   HD22  LEU  41          1HD2      LEU  41 -12.571   4.462 -22.710
  286   HD23  LEU  41          2HD2      LEU  41 -13.253   6.049 -23.069
  287    H    CYS  42           H        CYS  42  -9.497   3.978 -27.394
  288    HA   CYS  42           HA       CYS  42  -8.366   2.578 -28.785
  289    HB2  CYS  42           2HB      CYS  42  -7.387   1.425 -26.165
  290    HB3  CYS  42           3HB      CYS  42  -6.688   1.077 -27.743
  291    H    ASP  43           H        ASP  43 -10.766   1.845 -29.006
  292    HA   ASP  43           HA       ASP  43 -10.992  -1.007 -28.322
  293    HB2  ASP  43           2HB      ASP  43 -13.378  -0.780 -28.583
  294    HB3  ASP  43           3HB      ASP  43 -12.810   0.514 -27.531
  295    H    LYS  44           H        LYS  44 -10.925   1.287 -30.944
  296    HA   LYS  44           HA       LYS  44 -11.187  -0.935 -32.863
  297    HB2  LYS  44           2HB      LYS  44 -11.694   2.003 -33.369
  298    HB3  LYS  44           3HB      LYS  44 -11.955   0.685 -34.504
  299    HG2  LYS  44           2HG      LYS  44 -13.969   0.243 -33.675
  300    HG3  LYS  44           3HG      LYS  44 -13.381   0.280 -32.012
  301    HD2  LYS  44           2HD      LYS  44 -14.113   2.371 -31.691
  302    HD3  LYS  44           3HD      LYS  44 -13.483   2.919 -33.246
  303    HE2  LYS  44           2HE      LYS  44 -15.730   3.183 -33.598
  304    HE3  LYS  44           3HE      LYS  44 -15.511   1.535 -34.184
  305    HZ1  LYS  44           3HZ      LYS  44 -16.830   0.748 -32.597
  306    HZ2  LYS  44           1HZ      LYS  44 -17.282   2.346 -32.273
  307    HZ3  LYS  44           2HZ      LYS  44 -16.043   1.620 -31.379
  Start of MODEL    5
    1    H1   ARG   1           H        ARG   1  -0.507   1.815  -0.751
    2    HA   ARG   1           HA       ARG   1   0.843   0.935  -2.384
    3    HB2  ARG   1           2HB      ARG   1   0.860  -1.121  -0.401
    4    HB3  ARG   1           3HB      ARG   1   0.684  -1.874  -1.981
    5    HG2  ARG   1           2HG      ARG   1   2.833   0.114  -1.283
    6    HG3  ARG   1           3HG      ARG   1   3.032  -1.639  -1.223
    7    HD2  ARG   1           2HD      ARG   1   1.980  -0.470  -3.736
    8    HD3  ARG   1           3HD      ARG   1   3.680  -0.187  -3.364
    9    HE   ARG   1           HE       ARG   1   3.234  -2.893  -3.002
   10   HH11  ARG   1          1HH1      ARG   1   3.053  -0.588  -5.605
   11   HH12  ARG   1          2HH1      ARG   1   3.427  -1.751  -6.834
   12   HH21  ARG   1          1HH2      ARG   1   3.727  -4.433  -4.611
   13   HH22  ARG   1          2HH2      ARG   1   3.810  -3.937  -6.268
   14    H    CYS   2           H        CYS   2  -2.024  -0.974  -1.556
   15    HA   CYS   2           HA       CYS   2  -2.774  -0.926  -4.400
   16    HB2  CYS   2           2HB      CYS   2  -3.273  -3.281  -2.573
   17    HB3  CYS   2           3HB      CYS   2  -3.565  -3.191  -4.307
   18    H    GLN   3           H        GLN   3  -4.072   0.905  -3.804
   19    HA   GLN   3           HA       GLN   3  -6.591   0.103  -2.516
   20    HB2  GLN   3           2HB      GLN   3  -4.950   2.573  -2.034
   21    HB3  GLN   3           3HB      GLN   3  -6.684   2.571  -1.744
   22    HG2  GLN   3           2HG      GLN   3  -6.424   0.742  -0.154
   23    HG3  GLN   3           3HG      GLN   3  -4.687   0.728  -0.451
   24   HE21  GLN   3          1HE2      GLN   3  -6.115   1.166   2.034
   25   HE22  GLN   3          2HE2      GLN   3  -5.635   2.724   2.606
   26    H    TYR   4           H        TYR   4  -5.446   3.103  -4.042
   27    HA   TYR   4           HA       TYR   4  -7.679   2.868  -5.949
   28    HB2  TYR   4           2HB      TYR   4  -6.952   4.981  -4.192
   29    HB3  TYR   4           3HB      TYR   4  -6.668   5.540  -5.837
   30    HD1  TYR   4           HD1      TYR   4  -8.596   5.293  -7.515
   31    HD2  TYR   4           HD2      TYR   4  -9.112   4.976  -3.303
   32    HE1  TYR   4           HE1      TYR   4 -10.999   5.740  -7.782
   33    HE2  TYR   4           HE2      TYR   4 -11.518   5.421  -3.559
   34    HH   TYR   4           HH       TYR   4 -13.150   5.963  -4.967
   35    H    GLY   5           H        GLY   5  -7.041   2.341  -7.926
   36    HA2  GLY   5           2HA      GLY   5  -5.942   2.968  -9.961
   37    HA3  GLY   5           3HA      GLY   5  -4.620   3.618  -9.004
   38    H    TRP   6           H        TRP   6  -4.877   1.059  -7.316
   39    HA   TRP   6           HA       TRP   6  -3.628  -0.811  -9.208
   40    HB2  TRP   6           2HB      TRP   6  -2.527  -0.240  -6.451
   41    HB3  TRP   6           3HB      TRP   6  -1.827  -1.290  -7.680
   42    HD1  TRP   6           HD1      TRP   6  -1.535   2.116  -6.348
   43    HE1  TRP   6           HE1      TRP   6  -0.160   3.609  -7.930
   44    HE3  TRP   6           HE3      TRP   6  -1.526  -0.883 -10.488
   45    HZ2  TRP   6           HZ2      TRP   6   0.801   3.526 -10.583
   46    HZ3  TRP   6           HZ3      TRP   6  -0.356  -0.102 -12.507
   47    HH2  TRP   6           HH2      TRP   6   0.782   2.057 -12.552
   48    H    GLN   7           H        GLN   7  -4.464  -2.787  -9.080
   49    HA   GLN   7           HA       GLN   7  -6.443  -3.411  -7.115
   50    HB2  GLN   7           2HB      GLN   7  -5.451  -4.571  -9.605
   51    HB3  GLN   7           3HB      GLN   7  -5.861  -5.786  -8.402
   52    HG2  GLN   7           2HG      GLN   7  -8.068  -4.470  -8.162
   53    HG3  GLN   7           3HG      GLN   7  -7.624  -3.762  -9.714
   54   HE21  GLN   7          1HE2      GLN   7  -7.108  -5.326 -11.453
   55   HE22  GLN   7          2HE2      GLN   7  -8.043  -6.776 -11.538
   56    H    GLY   8           H        GLY   8  -6.292  -5.801  -6.190
   57    HA2  GLY   8           2HA      GLY   8  -3.822  -5.828  -4.600
   58    HA3  GLY   8           3HA      GLY   8  -5.340  -6.592  -4.151
   59    H    LEU   9           H        LEU   9  -5.705  -7.795  -6.802
   60    HA   LEU   9           HA       LEU   9  -4.631 -10.299  -6.366
   61    HB2  LEU   9           2HB      LEU   9  -6.284  -9.147  -8.242
   62    HB3  LEU   9           3HB      LEU   9  -4.898  -9.665  -9.199
   63    HG   LEU   9           HG       LEU   9  -6.616 -11.363  -9.235
   64   HD11  LEU   9          1HD1      LEU   9  -5.067 -12.954  -9.215
   65   HD12  LEU   9          2HD1      LEU   9  -4.871 -12.831  -7.467
   66   HD13  LEU   9          3HD1      LEU   9  -3.954 -11.768  -8.534
   67   HD21  LEU   9          3HD2      LEU   9  -7.319 -12.513  -7.197
   68   HD22  LEU   9          1HD2      LEU   9  -7.735 -10.800  -7.141
   69   HD23  LEU   9          2HD2      LEU   9  -6.349 -11.401  -6.229
   70    H    TYR  10           H        TYR  10  -3.410  -7.801  -8.594
   71    HA   TYR  10           HA       TYR  10  -0.780  -9.125  -8.474
   72    HB2  TYR  10           2HB      TYR  10  -2.289  -8.001 -10.797
   73    HB3  TYR  10           3HB      TYR  10  -0.531  -7.914 -10.807
   74    HD1  TYR  10           HD2      TYR  10  -3.115 -10.480  -9.933
   75    HD2  TYR  10           HD1      TYR  10   0.495  -9.588 -12.001
   76    HE1  TYR  10           HE2      TYR  10  -3.010 -12.801 -10.739
   77    HE2  TYR  10           HE1      TYR  10   0.609 -11.907 -12.814
   78    HH   TYR  10           HH       TYR  10  -1.042 -14.388 -11.532
   79    H    CYS  11           H        CYS  11  -2.561  -6.101  -8.636
   80    HA   CYS  11           HA       CYS  11  -2.029  -3.978  -8.021
   81    HB2  CYS  11           2HB      CYS  11  -1.032  -5.440  -6.050
   82    HB3  CYS  11           3HB      CYS  11   0.500  -4.870  -6.706
   83    H    ASP  12           H        ASP  12  -0.921  -5.229 -10.475
   84    HA   ASP  12           HA       ASP  12   1.404  -3.462 -10.869
   85    HB2  ASP  12           2HB      ASP  12   0.864  -6.231 -11.690
   86    HB3  ASP  12           3HB      ASP  12   1.488  -5.208 -12.980
   87    H    LYS  13           H        LYS  13  -1.713  -4.466 -12.062
   88    HA   LYS  13           HA       LYS  13  -1.507  -2.768 -14.419
   89    HB2  LYS  13           2HB      LYS  13  -3.290  -4.926 -13.502
   90    HB3  LYS  13           3HB      LYS  13  -4.096  -3.630 -14.375
   91    HG2  LYS  13           2HG      LYS  13  -2.108  -4.004 -16.068
   92    HG3  LYS  13           3HG      LYS  13  -2.095  -5.606 -15.326
   93    HD2  LYS  13           2HD      LYS  13  -4.585  -5.690 -15.786
   94    HD3  LYS  13           3HD      LYS  13  -4.356  -4.249 -16.780
   95    HE2  LYS  13           2HE      LYS  13  -3.046  -5.383 -18.336
   96    HE3  LYS  13           3HE      LYS  13  -2.680  -6.693 -17.215
   97    HZ1  LYS  13           3HZ      LYS  13  -5.469  -6.272 -18.014
   98    HZ2  LYS  13           1HZ      LYS  13  -4.672  -7.706 -17.598
   99    HZ3  LYS  13           2HZ      LYS  13  -4.418  -7.008 -19.117
  100    H    CYS  14           H        CYS  14  -3.116  -1.129 -14.877
  101    HA   CYS  14           HA       CYS  14  -3.960   0.262 -12.429
  102    HB2  CYS  14           2HB      CYS  14  -3.851   2.310 -13.659
  103    HB3  CYS  14           3HB      CYS  14  -2.372   1.419 -14.007
  104    H    ILE  15           H        ILE  15  -5.425  -1.923 -13.782
  105    HA   ILE  15           HA       ILE  15  -7.537  -2.464 -14.449
  106    HB   ILE  15           HB       ILE  15  -8.593   0.079 -13.302
  107   HG12  ILE  15          2HG1      ILE  15  -7.350  -2.161 -11.693
  108   HG13  ILE  15          3HG1      ILE  15  -6.800  -0.491 -11.760
  109   HG21  ILE  15          1HG2      ILE  15 -10.465  -1.138 -12.867
  110   HG22  ILE  15          2HG2      ILE  15  -9.838  -2.077 -14.221
  111   HG23  ILE  15          3HG2      ILE  15  -9.565  -2.624 -12.567
  112   HD11  ILE  15          3HD1      ILE  15  -8.073  -0.049 -10.014
  113   HD12  ILE  15          1HD1      ILE  15  -9.498  -0.412 -10.986
  114   HD13  ILE  15          2HD1      ILE  15  -8.729  -1.685 -10.038
  115    HA   PRO  16           HA       PRO  16  -7.378   0.391 -18.089
  116    HB2  PRO  16           2HB      PRO  16  -7.365  -1.603 -19.932
  117    HB3  PRO  16           3HB      PRO  16  -5.893  -0.990 -19.168
  118    HG2  PRO  16           2HG      PRO  16  -7.490  -3.436 -18.514
  119    HG3  PRO  16           3HG      PRO  16  -5.730  -3.243 -18.615
  120    HD2  PRO  16           2HD      PRO  16  -7.061  -3.262 -16.256
  121    HD3  PRO  16           3HD      PRO  16  -5.586  -2.307 -16.513
  122    H    HIS  17           H        HIS  17  -9.394  -2.282 -17.133
  123    HA   HIS  17           HA       HIS  17 -11.375  -2.315 -19.030
  124    HB2  HIS  17           2HB      HIS  17 -11.183  -2.994 -16.189
  125    HB3  HIS  17           3HB      HIS  17 -12.812  -2.542 -16.685
  126    HD1  HIS  17           HD1      HIS  17 -13.855  -4.838 -16.645
  127    HD2  HIS  17           HD2      HIS  17 -10.404  -4.672 -18.953
  128    HE1  HIS  17           HE1      HIS  17 -13.751  -7.038 -17.858
  129    HA   PRO  18           HA       PRO  18 -13.765   1.250 -16.841
  130    HB2  PRO  18           2HB      PRO  18 -12.538   2.522 -14.780
  131    HB3  PRO  18           3HB      PRO  18 -13.548   1.087 -14.560
  132    HG2  PRO  18           2HG      PRO  18 -10.565   1.302 -14.696
  133    HG3  PRO  18           3HG      PRO  18 -11.568   0.343 -13.593
  134    HD2  PRO  18           2HD      PRO  18 -10.345  -0.732 -15.756
  135    HD3  PRO  18           3HD      PRO  18 -11.903  -1.326 -15.147
  136    H    GLY  19           H        GLY  19 -12.990   2.022 -18.954
  137    HA2  GLY  19           2HA      GLY  19 -12.517   4.458 -19.490
  138    HA3  GLY  19           3HA      GLY  19 -10.970   4.161 -18.712
  139    H    CYS  20           H        CYS  20 -11.143   1.349 -19.955
  140    HA   CYS  20           HA       CYS  20 -10.741   1.938 -22.771
  141    HB2  CYS  20           2HB      CYS  20  -8.537   1.479 -20.870
  142    HB3  CYS  20           3HB      CYS  20  -8.470   0.491 -22.326
  143    H    VAL  21           H        VAL  21  -9.820  -0.249 -23.811
  144    HA   VAL  21           HA       VAL  21 -11.406  -2.455 -22.664
  145    HB   VAL  21           HB       VAL  21 -10.951  -1.950 -25.607
  146   HG11  VAL  21          1HG1      VAL  21 -11.293  -4.322 -24.797
  147   HG12  VAL  21          2HG1      VAL  21 -12.915  -3.826 -24.313
  148   HG13  VAL  21          3HG1      VAL  21 -12.437  -3.744 -26.009
  149   HG21  VAL  21          3HG2      VAL  21 -13.329  -1.321 -25.678
  150   HG22  VAL  21          1HG2      VAL  21 -13.398  -1.432 -23.919
  151   HG23  VAL  21          2HG2      VAL  21 -12.379  -0.214 -24.687
  152    H    HIS  22           H        HIS  22  -8.634  -1.630 -24.722
  153    HA   HIS  22           HA       HIS  22  -7.233  -3.975 -23.677
  154    HB2  HIS  22           2HB      HIS  22  -7.349  -3.313 -26.626
  155    HB3  HIS  22           3HB      HIS  22  -6.455  -4.639 -25.889
  156    HD1  HIS  22           HD1      HIS  22  -8.119  -6.393 -24.526
  157    HD2  HIS  22           HD2      HIS  22  -9.789  -4.048 -27.522
  158    HE1  HIS  22           HE1      HIS  22 -10.268  -7.538 -25.157
  159    H    GLY  23           H        GLY  23  -4.855  -3.905 -24.537
  160    HA2  GLY  23           2HA      GLY  23  -3.066  -2.423 -25.282
  161    HA3  GLY  23           3HA      GLY  23  -3.946  -1.096 -24.540
  162    H    ILE  24           H        ILE  24  -2.286  -0.440 -23.205
  163    HA   ILE  24           HA       ILE  24  -1.909  -2.082 -20.833
  164    HB   ILE  24           HB       ILE  24   0.506  -1.889 -20.824
  165   HG12  ILE  24          2HG1      ILE  24   1.126  -1.184 -23.486
  166   HG13  ILE  24          3HG1      ILE  24  -0.004   0.035 -22.905
  167   HG21  ILE  24          1HG2      ILE  24   1.027  -3.501 -22.505
  168   HG22  ILE  24          2HG2      ILE  24  -0.612  -3.823 -21.942
  169   HG23  ILE  24          3HG2      ILE  24  -0.354  -3.008 -23.484
  170   HD11  ILE  24          3HD1      ILE  24   2.748  -0.597 -21.989
  171   HD12  ILE  24          1HD1      ILE  24   1.979   0.963 -22.278
  172   HD13  ILE  24          2HD1      ILE  24   1.592   0.045 -20.822
  173    H    CYS  25           H        CYS  25  -0.136  -0.697 -19.421
  174    HA   CYS  25           HA       CYS  25  -0.270   2.112 -19.602
  175    HB2  CYS  25           2HB      CYS  25  -1.855   2.669 -17.894
  176    HB3  CYS  25           3HB      CYS  25  -2.669   1.608 -19.039
  177    H    ASN  26           H        ASN  26   0.868   3.161 -17.919
  178    HA   ASN  26           HA       ASN  26   2.339   1.318 -16.150
  179    HB2  ASN  26           2HB      ASN  26   3.906   2.175 -17.709
  180    HB3  ASN  26           3HB      ASN  26   3.247   3.804 -17.593
  181   HD21  ASN  26          1HD2      ASN  26   4.043   5.169 -16.114
  182   HD22  ASN  26          2HD2      ASN  26   5.254   4.761 -14.950
  183    H    GLU  27           H        GLU  27   0.503   4.245 -16.402
  184    HA   GLU  27           HA       GLU  27   0.958   4.810 -13.551
  185    HB2  GLU  27           2HB      GLU  27   0.422   6.505 -15.909
  186    HB3  GLU  27           3HB      GLU  27  -0.428   6.967 -14.441
  187    HG2  GLU  27           2HG      GLU  27   1.575   7.321 -13.265
  188    HG3  GLU  27           3HG      GLU  27   2.532   6.490 -14.489
  189    HA   PRO  28           HA       PRO  28  -3.142   3.724 -12.435
  190    HB2  PRO  28           2HB      PRO  28  -3.795   5.656 -10.643
  191    HB3  PRO  28           3HB      PRO  28  -2.631   4.374 -10.291
  192    HG2  PRO  28           2HG      PRO  28  -2.135   7.205 -11.128
  193    HG3  PRO  28           3HG      PRO  28  -1.308   6.244  -9.888
  194    HD2  PRO  28           2HD      PRO  28  -0.267   6.644 -12.355
  195    HD3  PRO  28           3HD      PRO  28   0.009   5.153 -11.433
  196    H    TRP  29           H        TRP  29  -5.017   3.919 -13.475
  197    HA   TRP  29           HA       TRP  29  -6.753   4.771 -14.673
  198    HB2  TRP  29           2HB      TRP  29  -6.128   7.425 -13.376
  199    HB3  TRP  29           3HB      TRP  29  -7.682   6.859 -13.984
  200    HD1  TRP  29           HD1      TRP  29  -6.390   7.617 -10.836
  201    HE1  TRP  29           HE1      TRP  29  -7.266   6.093  -8.956
  202    HE3  TRP  29           HE3      TRP  29  -8.159   3.755 -13.680
  203    HZ2  TRP  29           HZ2      TRP  29  -8.539   3.586  -8.711
  204    HZ3  TRP  29           HZ3      TRP  29  -9.191   1.831 -12.546
  205    HH2  TRP  29           HH2      TRP  29  -9.375   1.750 -10.112
  206    H    GLN  30           H        GLN  30  -5.483   4.464 -16.605
  207    HA   GLN  30           HA       GLN  30  -5.247   6.895 -18.122
  208    HB2  GLN  30           2HB      GLN  30  -2.870   5.547 -17.039
  209    HB3  GLN  30           3HB      GLN  30  -2.802   5.857 -18.769
  210    HG2  GLN  30           2HG      GLN  30  -3.732   8.233 -17.708
  211    HG3  GLN  30           3HG      GLN  30  -2.529   7.684 -16.542
  212   HE21  GLN  30          1HE2      GLN  30  -2.867   7.681 -20.079
  213   HE22  GLN  30          2HE2      GLN  30  -1.303   8.340 -20.399
  214    H    CYS  31           H        CYS  31  -4.236   6.262 -20.393
  215    HA   CYS  31           HA       CYS  31  -5.038   3.564 -21.175
  216    HB2  CYS  31           2HB      CYS  31  -6.344   6.101 -22.072
  217    HB3  CYS  31           3HB      CYS  31  -6.188   4.774 -23.219
  218    H    LEU  32           H        LEU  32  -3.395   2.748 -22.277
  219    HA   LEU  32           HA       LEU  32  -1.920   4.506 -24.121
  220    HB2  LEU  32           2HB      LEU  32  -0.754   2.312 -22.413
  221    HB3  LEU  32           3HB      LEU  32   0.129   3.297 -23.578
  222    HG   LEU  32           HG       LEU  32  -1.102   4.228 -20.986
  223   HD11  LEU  32          1HD1      LEU  32   1.118   4.542 -20.228
  224   HD12  LEU  32          2HD1      LEU  32   1.785   4.231 -21.830
  225   HD13  LEU  32          3HD1      LEU  32   1.048   2.918 -20.912
  226   HD21  LEU  32          3HD2      LEU  32  -0.410   5.681 -23.389
  227   HD22  LEU  32          1HD2      LEU  32   0.538   6.224 -22.005
  228   HD23  LEU  32          2HD2      LEU  32  -1.224   6.240 -21.927
  229    H    CYS  33           H        CYS  33  -2.366   3.863 -26.118
  230    HA   CYS  33           HA       CYS  33  -2.216   0.998 -26.735
  231    HB2  CYS  33           2HB      CYS  33  -4.147   1.260 -28.293
  232    HB3  CYS  33           3HB      CYS  33  -4.582   1.459 -26.598
  233    H    GLU  34           H        GLU  34  -1.884   0.569 -29.053
  234    HA   GLU  34           HA       GLU  34   0.155   2.253 -30.104
  235    HB2  GLU  34           2HB      GLU  34  -0.948  -0.361 -30.666
  236    HB3  GLU  34           3HB      GLU  34  -0.679   0.535 -32.154
  237    HG2  GLU  34           2HG      GLU  34   1.445  -0.060 -32.058
  238    HG3  GLU  34           3HG      GLU  34   1.616   0.944 -30.620
  239    H    THR  35           H        THR  35   0.126   3.080 -32.364
  240    HA   THR  35           HA       THR  35  -1.942   4.947 -32.714
  241    HB   THR  35           HB       THR  35   0.059   3.979 -34.765
  242    HG1  THR  35           HG1      THR  35   1.395   5.488 -33.940
  243   HG21  THR  35          3HG2      THR  35  -1.780   5.165 -35.817
  244   HG22  THR  35          1HG2      THR  35  -0.335   6.174 -35.826
  245   HG23  THR  35          2HG2      THR  35  -1.621   6.487 -34.660
  246    H    ASN  36           H        ASN  36  -1.584   1.675 -33.792
  247    HA   ASN  36           HA       ASN  36  -3.262   1.633 -36.012
  248    HB2  ASN  36           2HB      ASN  36  -2.235  -0.340 -34.085
  249    HB3  ASN  36           3HB      ASN  36  -3.756  -0.794 -34.848
  250   HD21  ASN  36          1HD2      ASN  36  -0.609   0.597 -35.715
  251   HD22  ASN  36          2HD2      ASN  36  -0.422  -0.307 -37.175
  252    H    TRP  37           H        TRP  37  -4.023   1.556 -32.578
  253    HA   TRP  37           HA       TRP  37  -6.812   1.025 -32.959
  254    HB2  TRP  37           2HB      TRP  37  -5.385   2.142 -30.535
  255    HB3  TRP  37           3HB      TRP  37  -7.018   1.481 -30.565
  256    HD1  TRP  37           HD1      TRP  37  -3.385   0.277 -31.201
  257    HE1  TRP  37           HE1      TRP  37  -3.240  -2.198 -30.510
  258    HE3  TRP  37           HE3      TRP  37  -8.289  -0.517 -29.994
  259    HZ2  TRP  37           HZ2      TRP  37  -4.975  -4.220 -29.578
  260    HZ3  TRP  37           HZ3      TRP  37  -8.964  -2.750 -29.211
  261    HH2  TRP  37           HH2      TRP  37  -7.340  -4.562 -29.009
  262    H    GLY  38           H        GLY  38  -8.225   2.757 -31.498
  263    HA2  GLY  38           2HA      GLY  38  -7.614   5.479 -32.340
  264    HA3  GLY  38           3HA      GLY  38  -9.053   4.757 -33.043
  265    H    GLY  39           H        GLY  39  -8.940   7.088 -31.363
  266    HA2  GLY  39           2HA      GLY  39 -10.316   7.973 -29.736
  267    HA3  GLY  39           3HA      GLY  39 -11.012   6.374 -29.519
  268    H    GLN  40           H        GLN  40 -10.784   7.669 -27.274
  269    HA   GLN  40           HA       GLN  40  -8.221   7.396 -26.016
  270    HB2  GLN  40           2HB      GLN  40 -10.735   8.632 -25.409
  271    HB3  GLN  40           3HB      GLN  40 -10.245   7.628 -24.051
  272    HG2  GLN  40           2HG      GLN  40  -8.140   9.335 -25.190
  273    HG3  GLN  40           3HG      GLN  40  -9.473  10.181 -24.407
  274   HE21  GLN  40          1HE2      GLN  40 -10.071   9.288 -22.222
  275   HE22  GLN  40          2HE2      GLN  40  -8.766   8.856 -21.175
  276    H    LEU  41           H        LEU  41 -11.245   5.581 -26.030
  277    HA   LEU  41           HA       LEU  41 -10.494   3.739 -24.003
  278    HB2  LEU  41           2HB      LEU  41 -12.445   3.142 -26.201
  279    HB3  LEU  41           3HB      LEU  41 -12.447   2.559 -24.537
  280    HG   LEU  41           HG       LEU  41 -13.162   5.327 -25.498
  281   HD11  LEU  41          1HD1      LEU  41 -14.889   3.636 -25.841
  282   HD12  LEU  41          2HD1      LEU  41 -15.358   4.786 -24.591
  283   HD13  LEU  41          3HD1      LEU  41 -14.788   3.180 -24.141
  284   HD21  LEU  41          3HD2      LEU  41 -12.987   4.258 -22.682
  285   HD22  LEU  41          1HD2      LEU  41 -13.643   5.827 -23.149
  286   HD23  LEU  41          2HD2      LEU  41 -11.933   5.476 -23.402
  287    H    CYS  42           H        CYS  42  -9.846   3.976 -27.392
  288    HA   CYS  42           HA       CYS  42  -8.610   2.717 -28.827
  289    HB2  CYS  42           2HB      CYS  42  -7.514   1.359 -26.360
  290    HB3  CYS  42           3HB      CYS  42  -6.742   1.494 -27.937
  291    H    ASP  43           H        ASP  43 -10.863   1.796 -29.205
  292    HA   ASP  43           HA       ASP  43 -10.853  -1.096 -28.637
  293    HB2  ASP  43           2HB      ASP  43 -13.262  -1.078 -28.727
  294    HB3  ASP  43           3HB      ASP  43 -12.740   0.174 -27.603
  295    H    LYS  44           H        LYS  44 -12.478  -2.165 -30.367
  296    HA   LYS  44           HA       LYS  44 -11.103  -2.268 -32.774
  297    HB2  LYS  44           2HB      LYS  44 -14.003  -2.957 -32.264
  298    HB3  LYS  44           3HB      LYS  44 -13.064  -3.476 -33.657
  299    HG2  LYS  44           2HG      LYS  44 -12.333  -4.156 -30.821
  300    HG3  LYS  44           3HG      LYS  44 -13.336  -5.183 -31.848
  301    HD2  LYS  44           2HD      LYS  44 -11.128  -4.595 -33.422
  302    HD3  LYS  44           3HD      LYS  44 -10.455  -4.843 -31.809
  303    HE2  LYS  44           2HE      LYS  44 -12.482  -6.799 -32.693
  304    HE3  LYS  44           3HE      LYS  44 -10.942  -6.837 -33.551
  305    HZ1  LYS  44           3HZ      LYS  44 -11.329  -7.092 -30.618
  306    HZ2  LYS  44           1HZ      LYS  44  -9.825  -7.026 -31.389
  307    HZ3  LYS  44           2HZ      LYS  44 -10.869  -8.323 -31.683
  Start of MODEL    6
    1    H1   ARG   1           H        ARG   1   2.047   0.494  -6.360
    2    HA   ARG   1           HA       ARG   1   2.125  -1.049  -3.853
    3    HB2  ARG   1           2HB      ARG   1   1.289   1.804  -4.382
    4    HB3  ARG   1           3HB      ARG   1   1.008   0.979  -2.854
    5    HG2  ARG   1           2HG      ARG   1   3.579   0.543  -2.945
    6    HG3  ARG   1           3HG      ARG   1   3.567   1.908  -4.064
    7    HD2  ARG   1           2HD      ARG   1   3.968   2.795  -1.900
    8    HD3  ARG   1           3HD      ARG   1   2.302   3.194  -2.315
    9    HE   ARG   1           HE       ARG   1   2.098   0.854  -0.942
   10   HH11  ARG   1          1HH1      ARG   1   3.548   3.950  -0.283
   11   HH12  ARG   1          2HH1      ARG   1   3.305   3.846   1.429
   12   HH21  ARG   1          1HH2      ARG   1   1.773   0.706   1.311
   13   HH22  ARG   1          2HH2      ARG   1   2.296   2.000   2.335
   14    H    CYS   2           H        CYS   2   0.056  -1.345  -2.744
   15    HA   CYS   2           HA       CYS   2  -2.173  -1.599  -4.656
   16    HB2  CYS   2           2HB      CYS   2  -1.688  -3.326  -2.223
   17    HB3  CYS   2           3HB      CYS   2  -2.900  -3.571  -3.477
   18    H    GLN   3           H        GLN   3  -2.684   0.628  -3.981
   19    HA   GLN   3           HA       GLN   3  -4.101   0.678  -1.398
   20    HB2  GLN   3           2HB      GLN   3  -2.271   2.581  -2.654
   21    HB3  GLN   3           3HB      GLN   3  -3.774   3.320  -2.118
   22    HG2  GLN   3           2HG      GLN   3  -2.363   1.515  -0.234
   23    HG3  GLN   3           3HG      GLN   3  -1.671   3.108  -0.538
   24   HE21  GLN   3          1HE2      GLN   3  -4.104   1.330   1.051
   25   HE22  GLN   3          2HE2      GLN   3  -4.912   2.659   1.802
   26    H    TYR   4           H        TYR   4  -4.136   2.361  -4.546
   27    HA   TYR   4           HA       TYR   4  -6.951   1.763  -4.868
   28    HB2  TYR   4           2HB      TYR   4  -6.937   3.820  -3.475
   29    HB3  TYR   4           3HB      TYR   4  -6.019   4.639  -4.734
   30    HD1  TYR   4           HD1      TYR   4  -8.979   2.369  -4.924
   31    HD2  TYR   4           HD2      TYR   4  -7.396   6.246  -5.672
   32    HE1  TYR   4           HE1      TYR   4 -11.080   3.007  -6.032
   33    HE2  TYR   4           HE2      TYR   4  -9.493   6.895  -6.782
   34    HH   TYR   4           HH       TYR   4 -11.413   6.051  -7.727
   35    H    GLY   5           H        GLY   5  -7.208   1.199  -6.919
   36    HA2  GLY   5           2HA      GLY   5  -7.187   1.550  -9.243
   37    HA3  GLY   5           3HA      GLY   5  -5.933   2.762  -9.027
   38    H    TRP   6           H        TRP   6  -5.794  -0.458  -7.644
   39    HA   TRP   6           HA       TRP   6  -4.021  -1.417  -9.730
   40    HB2  TRP   6           2HB      TRP   6  -3.076  -0.876  -6.914
   41    HB3  TRP   6           3HB      TRP   6  -2.242  -1.980  -8.004
   42    HD1  TRP   6           HD1      TRP   6  -1.947   1.407  -6.865
   43    HE1  TRP   6           HE1      TRP   6  -0.699   2.896  -8.553
   44    HE3  TRP   6           HE3      TRP   6  -2.224  -1.618 -10.977
   45    HZ2  TRP   6           HZ2      TRP   6   0.066   2.802 -11.268
   46    HZ3  TRP   6           HZ3      TRP   6  -1.210  -0.844 -13.081
   47    HH2  TRP   6           HH2      TRP   6  -0.089   1.321 -13.222
   48    H    GLN   7           H        GLN   7  -5.677  -2.979  -9.977
   49    HA   GLN   7           HA       GLN   7  -6.061  -4.837  -7.745
   50    HB2  GLN   7           2HB      GLN   7  -7.984  -5.651  -8.894
   51    HB3  GLN   7           3HB      GLN   7  -8.040  -3.895  -8.981
   52    HG2  GLN   7           2HG      GLN   7  -7.085  -4.027 -11.263
   53    HG3  GLN   7           3HG      GLN   7  -7.196  -5.784 -11.164
   54   HE21  GLN   7          1HE2      GLN   7  -8.555  -5.622 -13.039
   55   HE22  GLN   7          2HE2      GLN   7 -10.228  -5.232 -12.859
   56    H    GLY   8           H        GLY   8  -6.641  -7.171  -8.983
   57    HA2  GLY   8           2HA      GLY   8  -5.737  -8.696 -10.649
   58    HA3  GLY   8           3HA      GLY   8  -4.225  -7.804 -10.557
   59    H    LEU   9           H        LEU   9  -3.245  -9.911 -10.224
   60    HA   LEU   9           HA       LEU   9  -3.791 -11.237  -7.699
   61    HB2  LEU   9           2HB      LEU   9  -3.328 -12.499  -9.790
   62    HB3  LEU   9           3HB      LEU   9  -1.687 -11.857  -9.767
   63    HG   LEU   9           HG       LEU   9  -1.445 -12.992  -7.499
   64   HD11  LEU   9          1HD1      LEU   9  -3.411 -13.703  -6.674
   65   HD12  LEU   9          2HD1      LEU   9  -3.102 -15.119  -7.680
   66   HD13  LEU   9          3HD1      LEU   9  -4.156 -13.833  -8.268
   67   HD21  LEU   9          3HD2      LEU   9  -0.280 -13.904  -9.333
   68   HD22  LEU   9          1HD2      LEU   9  -1.761 -14.509 -10.076
   69   HD23  LEU   9          2HD2      LEU   9  -1.145 -15.257  -8.602
   70    H    TYR  10           H        TYR  10  -1.059  -9.587  -9.266
   71    HA   TYR  10           HA       TYR  10   0.101  -9.175  -6.588
   72    HB2  TYR  10           2HB      TYR  10   1.393  -9.928  -9.180
   73    HB3  TYR  10           3HB      TYR  10   2.303  -8.973  -8.015
   74    HD1  TYR  10           HD1      TYR  10   0.284 -12.104  -8.241
   75    HD2  TYR  10           HD2      TYR  10   3.503 -10.060  -6.355
   76    HE1  TYR  10           HE1      TYR  10   0.867 -14.159  -7.023
   77    HE2  TYR  10           HE2      TYR  10   4.096 -12.110  -5.133
   78    HH   TYR  10           HH       TYR  10   3.337 -14.177  -4.528
   79    H    CYS  11           H        CYS  11  -1.762  -7.510  -8.191
   80    HA   CYS  11           HA       CYS  11  -2.093  -5.326  -8.735
   81    HB2  CYS  11           2HB      CYS  11   0.341  -4.967  -6.973
   82    HB3  CYS  11           3HB      CYS  11  -0.708  -3.661  -7.514
   83    H    ASP  12           H        ASP  12  -1.676  -5.554 -10.945
   84    HA   ASP  12           HA       ASP  12   0.674  -4.116 -11.854
   85    HB2  ASP  12           2HB      ASP  12   1.044  -6.739 -11.747
   86    HB3  ASP  12           3HB      ASP  12   0.153  -6.694 -13.266
   87    H    LYS  13           H        LYS  13  -2.274  -3.801 -11.800
   88    HA   LYS  13           HA       LYS  13  -2.582  -3.049 -14.594
   89    HB2  LYS  13           2HB      LYS  13  -4.149  -5.173 -13.247
   90    HB3  LYS  13           3HB      LYS  13  -5.066  -4.028 -14.216
   91    HG2  LYS  13           2HG      LYS  13  -4.209  -4.780 -16.171
   92    HG3  LYS  13           3HG      LYS  13  -2.646  -5.187 -15.458
   93    HD2  LYS  13           2HD      LYS  13  -3.881  -7.076 -14.261
   94    HD3  LYS  13           3HD      LYS  13  -5.208  -6.759 -15.382
   95    HE2  LYS  13           2HE      LYS  13  -2.377  -7.399 -16.203
   96    HE3  LYS  13           3HE      LYS  13  -3.686  -8.576 -16.123
   97    HZ1  LYS  13           3HZ      LYS  13  -4.146  -6.160 -17.698
   98    HZ2  LYS  13           1HZ      LYS  13  -4.672  -7.745 -17.970
   99    HZ3  LYS  13           2HZ      LYS  13  -3.080  -7.307 -18.338
  100    H    CYS  14           H        CYS  14  -3.701  -1.190 -14.849
  101    HA   CYS  14           HA       CYS  14  -4.682   0.101 -12.413
  102    HB2  CYS  14           2HB      CYS  14  -4.452   2.182 -13.570
  103    HB3  CYS  14           3HB      CYS  14  -2.998   1.245 -13.897
  104    H    ILE  15           H        ILE  15  -6.175  -1.978 -13.920
  105    HA   ILE  15           HA       ILE  15  -8.278  -2.409 -14.688
  106    HB   ILE  15           HB       ILE  15  -9.288   0.099 -13.427
  107   HG12  ILE  15          2HG1      ILE  15  -8.175  -2.274 -11.916
  108   HG13  ILE  15          3HG1      ILE  15  -7.566  -0.623 -11.868
  109   HG21  ILE  15          1HG2      ILE  15 -11.213  -1.074 -13.125
  110   HG22  ILE  15          2HG2      ILE  15 -10.572  -1.956 -14.510
  111   HG23  ILE  15          3HG2      ILE  15 -10.373  -2.606 -12.883
  112   HD11  ILE  15          3HD1      ILE  15 -10.266  -0.452 -11.171
  113   HD12  ILE  15          1HD1      ILE  15  -9.629  -1.851 -10.307
  114   HD13  ILE  15          2HD1      ILE  15  -8.865  -0.272 -10.116
  115    HA   PRO  16           HA       PRO  16  -7.910   0.640 -18.150
  116    HB2  PRO  16           2HB      PRO  16  -7.905  -1.244 -20.104
  117    HB3  PRO  16           3HB      PRO  16  -6.439  -0.729 -19.263
  118    HG2  PRO  16           2HG      PRO  16  -8.136  -3.150 -18.799
  119    HG3  PRO  16           3HG      PRO  16  -6.369  -3.013 -18.836
  120    HD2  PRO  16           2HD      PRO  16  -7.773  -3.119 -16.523
  121    HD3  PRO  16           3HD      PRO  16  -6.260  -2.204 -16.681
  122    H    HIS  17           H        HIS  17 -10.043  -2.011 -17.413
  123    HA   HIS  17           HA       HIS  17 -11.963  -1.867 -19.365
  124    HB2  HIS  17           2HB      HIS  17 -11.874  -2.727 -16.575
  125    HB3  HIS  17           3HB      HIS  17 -13.471  -2.166 -17.064
  126    HD1  HIS  17           HD1      HIS  17 -14.536  -4.481 -17.075
  127    HD2  HIS  17           HD2      HIS  17 -11.210  -4.183 -19.547
  128    HE1  HIS  17           HE1      HIS  17 -14.536  -6.582 -18.457
  129    HA   PRO  18           HA       PRO  18 -14.300   1.651 -17.049
  130    HB2  PRO  18           2HB      PRO  18 -13.099   2.761 -14.883
  131    HB3  PRO  18           3HB      PRO  18 -14.162   1.353 -14.775
  132    HG2  PRO  18           2HG      PRO  18 -11.171   1.470 -14.810
  133    HG3  PRO  18           3HG      PRO  18 -12.240   0.486 -13.794
  134    HD2  PRO  18           2HD      PRO  18 -10.985  -0.508 -15.978
  135    HD3  PRO  18           3HD      PRO  18 -12.581  -1.080 -15.450
  136    H    GLY  19           H        GLY  19 -13.420   2.501 -19.095
  137    HA2  GLY  19           2HA      GLY  19 -12.851   4.954 -19.467
  138    HA3  GLY  19           3HA      GLY  19 -11.336   4.548 -18.674
  139    H    CYS  20           H        CYS  20 -11.567   1.827 -20.081
  140    HA   CYS  20           HA       CYS  20 -11.099   2.553 -22.852
  141    HB2  CYS  20           2HB      CYS  20  -8.936   1.986 -20.946
  142    HB3  CYS  20           3HB      CYS  20  -8.866   1.022 -22.417
  143    H    VAL  21           H        VAL  21 -10.325   0.459 -24.063
  144    HA   VAL  21           HA       VAL  21 -12.033  -1.740 -23.101
  145    HB   VAL  21           HB       VAL  21 -11.161  -1.233 -25.946
  146   HG11  VAL  21          1HG1      VAL  21 -11.849  -3.574 -25.109
  147   HG12  VAL  21          2HG1      VAL  21 -13.481  -2.906 -25.054
  148   HG13  VAL  21          3HG1      VAL  21 -12.596  -2.950 -26.579
  149   HG21  VAL  21          3HG2      VAL  21 -13.836  -0.755 -25.913
  150   HG22  VAL  21          1HG2      VAL  21 -13.344  -0.085 -24.357
  151   HG23  VAL  21          2HG2      VAL  21 -12.595   0.496 -25.844
  152    H    HIS  22           H        HIS  22  -8.998  -1.064 -24.826
  153    HA   HIS  22           HA       HIS  22  -7.798  -3.400 -23.566
  154    HB2  HIS  22           2HB      HIS  22  -7.742  -3.000 -26.564
  155    HB3  HIS  22           3HB      HIS  22  -6.923  -4.278 -25.672
  156    HD1  HIS  22           HD1      HIS  22  -8.729  -5.822 -24.204
  157    HD2  HIS  22           HD2      HIS  22 -10.130  -3.785 -27.543
  158    HE1  HIS  22           HE1      HIS  22 -10.874  -6.970 -24.841
  159    H    GLY  23           H        GLY  23  -5.374  -3.504 -24.573
  160    HA2  GLY  23           2HA      GLY  23  -3.540  -2.084 -25.326
  161    HA3  GLY  23           3HA      GLY  23  -4.345  -0.737 -24.534
  162    H    ILE  24           H        ILE  24  -2.750  -0.140 -23.140
  163    HA   ILE  24           HA       ILE  24  -2.313  -1.907 -20.873
  164    HB   ILE  24           HB       ILE  24   0.136  -1.545 -20.895
  165   HG12  ILE  24          2HG1      ILE  24   0.119  -0.884 -23.782
  166   HG13  ILE  24          3HG1      ILE  24  -0.331   0.421 -22.690
  167   HG21  ILE  24          1HG2      ILE  24  -0.848  -2.916 -23.391
  168   HG22  ILE  24          2HG2      ILE  24   0.642  -3.249 -22.510
  169   HG23  ILE  24          3HG2      ILE  24  -0.919  -3.613 -21.774
  170   HD11  ILE  24          3HD1      ILE  24   1.916  -0.618 -21.510
  171   HD12  ILE  24          1HD1      ILE  24   2.270  -0.749 -23.233
  172   HD13  ILE  24          2HD1      ILE  24   1.849   0.815 -22.535
  173    H    CYS  25           H        CYS  25  -0.615  -0.614 -19.354
  174    HA   CYS  25           HA       CYS  25  -0.717   2.205 -19.388
  175    HB2  CYS  25           2HB      CYS  25  -2.339   2.685 -17.697
  176    HB3  CYS  25           3HB      CYS  25  -3.134   1.681 -18.907
  177    H    ASN  26           H        ASN  26   0.396   3.149 -17.631
  178    HA   ASN  26           HA       ASN  26   1.807   1.200 -15.929
  179    HB2  ASN  26           2HB      ASN  26   3.583   3.110 -15.871
  180    HB3  ASN  26           3HB      ASN  26   3.491   2.062 -17.283
  181   HD21  ASN  26          1HD2      ASN  26   2.756   5.220 -16.004
  182   HD22  ASN  26          2HD2      ASN  26   2.541   6.004 -17.529
  183    H    GLU  27           H        GLU  27   0.010   4.159 -16.069
  184    HA   GLU  27           HA       GLU  27   0.401   4.563 -13.181
  185    HB2  GLU  27           2HB      GLU  27   0.075   6.384 -15.447
  186    HB3  GLU  27           3HB      GLU  27  -0.979   6.769 -14.094
  187    HG2  GLU  27           2HG      GLU  27   1.137   6.594 -12.655
  188    HG3  GLU  27           3HG      GLU  27   2.010   6.701 -14.183
  189    HA   PRO  28           HA       PRO  28  -3.743   3.488 -12.232
  190    HB2  PRO  28           2HB      PRO  28  -4.413   5.329 -10.353
  191    HB3  PRO  28           3HB      PRO  28  -3.279   4.010 -10.043
  192    HG2  PRO  28           2HG      PRO  28  -2.716   6.874 -10.708
  193    HG3  PRO  28           3HG      PRO  28  -1.938   5.831  -9.503
  194    HD2  PRO  28           2HD      PRO  28  -0.826   6.349 -11.917
  195    HD3  PRO  28           3HD      PRO  28  -0.598   4.804 -11.072
  196    H    TRP  29           H        TRP  29  -5.578   3.770 -13.323
  197    HA   TRP  29           HA       TRP  29  -7.283   4.720 -14.490
  198    HB2  TRP  29           2HB      TRP  29  -6.601   7.299 -13.075
  199    HB3  TRP  29           3HB      TRP  29  -8.158   6.814 -13.740
  200    HD1  TRP  29           HD1      TRP  29  -6.905   7.388 -10.535
  201    HE1  TRP  29           HE1      TRP  29  -7.879   5.819  -8.742
  202    HE3  TRP  29           HE3      TRP  29  -8.761   3.726 -13.582
  203    HZ2  TRP  29           HZ2      TRP  29  -9.252   3.355  -8.633
  204    HZ3  TRP  29           HZ3      TRP  29  -9.891   1.796 -12.554
  205    HH2  TRP  29           HH2      TRP  29 -10.130   1.617 -10.131
  206    H    GLN  30           H        GLN  30  -5.681   4.406 -16.290
  207    HA   GLN  30           HA       GLN  30  -5.371   6.941 -17.703
  208    HB2  GLN  30           2HB      GLN  30  -3.162   5.181 -16.819
  209    HB3  GLN  30           3HB      GLN  30  -3.066   5.767 -18.475
  210    HG2  GLN  30           2HG      GLN  30  -3.659   7.741 -16.345
  211    HG3  GLN  30           3HG      GLN  30  -2.022   7.093 -16.440
  212   HE21  GLN  30          1HE2      GLN  30  -0.672   8.133 -17.710
  213   HE22  GLN  30          2HE2      GLN  30  -1.100   9.167 -19.026
  214    H    CYS  31           H        CYS  31  -4.446   6.367 -20.025
  215    HA   CYS  31           HA       CYS  31  -5.513   3.839 -21.007
  216    HB2  CYS  31           2HB      CYS  31  -6.687   6.516 -21.562
  217    HB3  CYS  31           3HB      CYS  31  -6.578   5.388 -22.909
  218    H    LEU  32           H        LEU  32  -3.897   3.011 -22.145
  219    HA   LEU  32           HA       LEU  32  -2.438   4.769 -23.997
  220    HB2  LEU  32           2HB      LEU  32  -1.201   2.548 -22.379
  221    HB3  LEU  32           3HB      LEU  32  -0.370   3.626 -23.499
  222    HG   LEU  32           HG       LEU  32  -1.667   4.488 -20.913
  223   HD11  LEU  32          1HD1      LEU  32   1.264   4.566 -21.296
  224   HD12  LEU  32          2HD1      LEU  32   0.535   2.984 -21.021
  225   HD13  LEU  32          3HD1      LEU  32   0.314   4.274 -19.839
  226   HD21  LEU  32          3HD2      LEU  32   0.332   6.247 -21.983
  227   HD22  LEU  32          1HD2      LEU  32  -1.354   6.579 -21.586
  228   HD23  LEU  32          2HD2      LEU  32  -0.929   5.961 -23.182
  229    H    CYS  33           H        CYS  33  -3.153   4.122 -25.932
  230    HA   CYS  33           HA       CYS  33  -3.724   1.329 -26.458
  231    HB2  CYS  33           2HB      CYS  33  -3.805   3.620 -28.423
  232    HB3  CYS  33           3HB      CYS  33  -4.623   2.066 -28.550
  233    H    GLU  34           H        GLU  34  -2.895   0.369 -28.540
  234    HA   GLU  34           HA       GLU  34  -0.004   0.850 -28.700
  235    HB2  GLU  34           2HB      GLU  34  -1.483  -1.499 -28.429
  236    HB3  GLU  34           3HB      GLU  34  -0.950  -1.507 -30.105
  237    HG2  GLU  34           2HG      GLU  34   1.376  -1.045 -29.224
  238    HG3  GLU  34           3HG      GLU  34   0.735  -1.412 -27.624
  239    H    THR  35           H        THR  35   0.978   0.401 -30.893
  240    HA   THR  35           HA       THR  35   0.074   2.253 -32.758
  241    HB   THR  35           HB       THR  35   1.800  -0.166 -33.320
  242    HG1  THR  35           HG1      THR  35   2.322   2.366 -32.191
  243   HG21  THR  35          3HG2      THR  35   1.438   0.611 -35.430
  244   HG22  THR  35          1HG2      THR  35   2.729   1.720 -34.968
  245   HG23  THR  35          2HG2      THR  35   1.045   2.240 -34.881
  246    H    ASN  36           H        ASN  36  -0.868  -1.040 -32.258
  247    HA   ASN  36           HA       ASN  36  -1.969  -1.510 -34.842
  248    HB2  ASN  36           2HB      ASN  36  -1.681  -2.956 -32.372
  249    HB3  ASN  36           3HB      ASN  36  -3.334  -3.111 -32.958
  250   HD21  ASN  36          1HD2      ASN  36   0.039  -3.606 -33.756
  251   HD22  ASN  36          2HD2      ASN  36  -0.229  -4.795 -34.981
  252    H    TRP  37           H        TRP  37  -3.221  -0.215 -31.824
  253    HA   TRP  37           HA       TRP  37  -5.923  -0.052 -32.874
  254    HB2  TRP  37           2HB      TRP  37  -4.898   1.090 -30.273
  255    HB3  TRP  37           3HB      TRP  37  -6.564   0.712 -30.702
  256    HD1  TRP  37           HD1      TRP  37  -3.250  -1.054 -29.826
  257    HE1  TRP  37           HE1      TRP  37  -3.802  -3.404 -28.934
  258    HE3  TRP  37           HE3      TRP  37  -8.294  -1.076 -30.663
  259    HZ2  TRP  37           HZ2      TRP  37  -6.075  -5.051 -28.627
  260    HZ3  TRP  37           HZ3      TRP  37  -9.583  -3.078 -30.042
  261    HH2  TRP  37           HH2      TRP  37  -8.495  -5.023 -29.046
  262    H    GLY  38           H        GLY  38  -6.869   2.304 -31.899
  263    HA2  GLY  38           2HA      GLY  38  -5.439   4.630 -32.256
  264    HA3  GLY  38           3HA      GLY  38  -5.952   4.159 -33.870
  265    H    GLY  39           H        GLY  39  -7.258   4.637 -30.590
  266    HA2  GLY  39           2HA      GLY  39  -9.426   6.217 -31.710
  267    HA3  GLY  39           3HA      GLY  39  -9.911   4.716 -30.936
  268    H    GLN  40           H        GLN  40 -11.073   5.770 -29.319
  269    HA   GLN  40           HA       GLN  40  -9.561   7.512 -27.513
  270    HB2  GLN  40           2HB      GLN  40 -12.196   7.586 -28.466
  271    HB3  GLN  40           3HB      GLN  40 -12.329   7.126 -26.774
  272    HG2  GLN  40           2HG      GLN  40 -10.855   9.093 -26.240
  273    HG3  GLN  40           3HG      GLN  40 -11.056   9.593 -27.918
  274   HE21  GLN  40          1HE2      GLN  40 -11.985  10.534 -25.118
  275   HE22  GLN  40          2HE2      GLN  40 -13.648  10.922 -25.376
  276    H    LEU  41           H        LEU  41 -11.387   4.498 -27.584
  277    HA   LEU  41           HA       LEU  41 -10.427   3.920 -24.860
  278    HB2  LEU  41           2HB      LEU  41 -12.699   2.469 -26.157
  279    HB3  LEU  41           3HB      LEU  41 -12.330   2.650 -24.443
  280    HG   LEU  41           HG       LEU  41 -13.353   4.857 -26.228
  281   HD11  LEU  41          1HD1      LEU  41 -15.132   3.342 -26.034
  282   HD12  LEU  41          2HD1      LEU  41 -15.422   4.547 -24.781
  283   HD13  LEU  41          3HD1      LEU  41 -14.750   2.975 -24.352
  284   HD21  LEU  41          3HD2      LEU  41 -12.168   5.869 -24.482
  285   HD22  LEU  41          1HD2      LEU  41 -12.704   4.672 -23.303
  286   HD23  LEU  41          2HD2      LEU  41 -13.843   5.865 -23.928
  287    H    CYS  42           H        CYS  42  -9.065   3.510 -27.476
  288    HA   CYS  42           HA       CYS  42  -7.847   1.932 -28.579
  289    HB2  CYS  42           2HB      CYS  42  -7.999   0.372 -25.998
  290    HB3  CYS  42           3HB      CYS  42  -6.722   0.325 -27.208
  291    H    ASP  43           H        ASP  43 -10.321   1.702 -29.415
  292    HA   ASP  43           HA       ASP  43 -10.911  -1.186 -29.343
  293    HB2  ASP  43           2HB      ASP  43 -12.792  -0.179 -28.370
  294    HB3  ASP  43           3HB      ASP  43 -12.742   1.194 -29.471
  295    H    LYS  44           H        LYS  44 -10.499   1.672 -31.306
  296    HA   LYS  44           HA       LYS  44 -10.453  -0.044 -33.695
  297    HB2  LYS  44           2HB      LYS  44 -11.351   1.955 -34.965
  298    HB3  LYS  44           3HB      LYS  44 -12.496   1.141 -33.906
  299    HG2  LYS  44           2HG      LYS  44 -11.004   3.396 -32.726
  300    HG3  LYS  44           3HG      LYS  44 -12.179   3.797 -33.981
  301    HD2  LYS  44           2HD      LYS  44 -13.624   2.068 -32.492
  302    HD3  LYS  44           3HD      LYS  44 -12.593   2.774 -31.246
  303    HE2  LYS  44           2HE      LYS  44 -13.883   4.623 -33.176
  304    HE3  LYS  44           3HE      LYS  44 -14.915   3.858 -31.968
  305    HZ1  LYS  44           3HZ      LYS  44 -12.659   4.752 -30.633
  306    HZ2  LYS  44           1HZ      LYS  44 -14.226   5.382 -30.539
  307    HZ3  LYS  44           2HZ      LYS  44 -13.125   6.018 -31.653
  Start of MODEL    7
    1    H1   ARG   1           H        ARG   1  -0.973  -2.603   2.271
    2    HA   ARG   1           HA       ARG   1  -2.750  -3.288   0.923
    3    HB2  ARG   1           2HB      ARG   1  -4.486  -1.409   0.972
    4    HB3  ARG   1           3HB      ARG   1  -3.849  -1.956   2.518
    5    HG2  ARG   1           2HG      ARG   1  -2.287   0.218   1.414
    6    HG3  ARG   1           3HG      ARG   1  -3.987   0.651   1.616
    7    HD2  ARG   1           2HD      ARG   1  -2.484  -0.723   3.812
    8    HD3  ARG   1           3HD      ARG   1  -2.349   1.020   3.585
    9    HE   ARG   1           HE       ARG   1  -5.063   0.098   3.695
   10   HH11  ARG   1          1HH1      ARG   1  -2.308   1.077   5.584
   11   HH12  ARG   1          2HH1      ARG   1  -3.253   1.554   6.956
   12   HH21  ARG   1          1HH2      ARG   1  -6.319   0.721   5.494
   13   HH22  ARG   1          2HH2      ARG   1  -5.534   1.350   6.904
   14    H    CYS   2           H        CYS   2  -1.685  -3.588  -1.104
   15    HA   CYS   2           HA       CYS   2  -1.575  -1.410  -2.991
   16    HB2  CYS   2           2HB      CYS   2   0.017  -3.449  -2.825
   17    HB3  CYS   2           3HB      CYS   2  -1.243  -4.313  -3.701
   18    H    GLN   3           H        GLN   3  -4.039  -1.191  -2.475
   19    HA   GLN   3           HA       GLN   3  -5.457  -2.509  -4.681
   20    HB2  GLN   3           2HB      GLN   3  -5.945  -3.513  -2.357
   21    HB3  GLN   3           3HB      GLN   3  -6.808  -2.014  -2.040
   22    HG2  GLN   3           2HG      GLN   3  -8.323  -2.438  -3.852
   23    HG3  GLN   3           3HG      GLN   3  -7.400  -3.858  -4.342
   24   HE21  GLN   3          1HE2      GLN   3  -8.721  -2.620  -1.285
   25   HE22  GLN   3          2HE2      GLN   3  -9.518  -4.086  -0.840
   26    H    TYR   4           H        TYR   4  -4.660  -0.257  -5.423
   27    HA   TYR   4           HA       TYR   4  -6.912   1.409  -5.696
   28    HB2  TYR   4           2HB      TYR   4  -5.862   1.858  -3.274
   29    HB3  TYR   4           3HB      TYR   4  -4.827   2.927  -4.215
   30    HD1  TYR   4           HD1      TYR   4  -6.584   4.051  -6.210
   31    HD2  TYR   4           HD2      TYR   4  -7.390   3.161  -2.128
   32    HE1  TYR   4           HE1      TYR   4  -8.339   5.774  -6.187
   33    HE2  TYR   4           HE2      TYR   4  -9.148   4.881  -2.095
   34    HH   TYR   4           HH       TYR   4 -10.645   6.017  -3.779
   35    H    GLY   5           H        GLY   5  -6.429   1.407  -7.855
   36    HA2  GLY   5           2HA      GLY   5  -5.559   2.676  -9.650
   37    HA3  GLY   5           3HA      GLY   5  -4.191   3.122  -8.641
   38    H    TRP   6           H        TRP   6  -4.039   0.151  -7.885
   39    HA   TRP   6           HA       TRP   6  -2.911  -0.878 -10.392
   40    HB2  TRP   6           2HB      TRP   6  -1.494  -0.813  -7.719
   41    HB3  TRP   6           3HB      TRP   6  -0.930  -1.708  -9.127
   42    HD1  TRP   6           HD1      TRP   6  -0.451   1.502  -7.457
   43    HE1  TRP   6           HE1      TRP   6   0.691   3.202  -9.015
   44    HE3  TRP   6           HE3      TRP   6  -1.054  -0.943 -11.906
   45    HZ2  TRP   6           HZ2      TRP   6   1.261   3.472 -11.767
   46    HZ3  TRP   6           HZ3      TRP   6  -0.182   0.105 -13.955
   47    HH2  TRP   6           HH2      TRP   6   0.950   2.267 -13.885
   48    H    GLN   7           H        GLN   7  -4.428  -2.449 -10.678
   49    HA   GLN   7           HA       GLN   7  -5.337  -4.121  -8.535
   50    HB2  GLN   7           2HB      GLN   7  -5.952  -3.740 -11.369
   51    HB3  GLN   7           3HB      GLN   7  -6.032  -5.423 -10.864
   52    HG2  GLN   7           2HG      GLN   7  -7.522  -4.673  -8.983
   53    HG3  GLN   7           3HG      GLN   7  -7.582  -3.096  -9.768
   54   HE21  GLN   7          1HE2      GLN   7  -9.931  -4.082  -9.490
   55   HE22  GLN   7          2HE2      GLN   7 -10.552  -4.805 -10.931
   56    H    GLY   8           H        GLY   8  -5.245  -6.567  -8.806
   57    HA2  GLY   8           2HA      GLY   8  -4.056  -8.530  -9.135
   58    HA3  GLY   8           3HA      GLY   8  -2.918  -7.635 -10.130
   59    H    LEU   9           H        LEU   9  -2.425  -9.631  -8.033
   60    HA   LEU   9           HA       LEU   9  -1.534  -8.477  -5.649
   61    HB2  LEU   9           2HB      LEU   9  -1.732 -10.810  -5.691
   62    HB3  LEU   9           3HB      LEU   9  -0.750 -10.953  -7.148
   63    HG   LEU   9           HG       LEU   9   1.240 -10.313  -5.817
   64   HD11  LEU   9          1HD1      LEU   9  -0.398  -9.236  -4.035
   65   HD12  LEU   9          2HD1      LEU   9   1.195  -9.849  -3.592
   66   HD13  LEU   9          3HD1      LEU   9  -0.241 -10.831  -3.299
   67   HD21  LEU   9          3HD2      LEU   9   0.776 -12.651  -6.219
   68   HD22  LEU   9          1HD2      LEU   9  -0.318 -12.702  -4.836
   69   HD23  LEU   9          2HD2      LEU   9   1.409 -12.444  -4.585
   70    H    TYR  10           H        TYR  10   0.140  -8.998  -8.723
   71    HA   TYR  10           HA       TYR  10   2.665  -8.057  -7.814
   72    HB2  TYR  10           2HB      TYR  10   1.706  -8.066 -10.675
   73    HB3  TYR  10           3HB      TYR  10   3.361  -8.185 -10.089
   74    HD1  TYR  10           HD2      TYR  10   3.083 -10.240  -7.985
   75    HD2  TYR  10           HD1      TYR  10   1.367 -10.037 -11.874
   76    HE1  TYR  10           HE2      TYR  10   2.927 -12.694  -8.038
   77    HE2  TYR  10           HE1      TYR  10   1.206 -12.490 -11.937
   78    HH   TYR  10           HH       TYR  10   1.094 -14.370 -10.328
   79    H    CYS  11           H        CYS  11  -0.203  -6.523  -9.011
   80    HA   CYS  11           HA       CYS  11  -0.801  -4.341  -9.241
   81    HB2  CYS  11           2HB      CYS  11   1.756  -3.681  -7.771
   82    HB3  CYS  11           3HB      CYS  11   0.311  -2.683  -7.898
   83    H    ASP  12           H        ASP  12  -0.205  -4.916 -11.539
   84    HA   ASP  12           HA       ASP  12   1.929  -3.111 -12.477
   85    HB2  ASP  12           2HB      ASP  12   2.245  -4.629 -14.399
   86    HB3  ASP  12           3HB      ASP  12   2.574  -5.431 -12.866
   87    H    LYS  13           H        LYS  13  -1.281  -4.425 -13.026
   88    HA   LYS  13           HA       LYS  13  -1.748  -2.727 -15.326
   89    HB2  LYS  13           2HB      LYS  13  -3.442  -4.710 -13.820
   90    HB3  LYS  13           3HB      LYS  13  -4.116  -3.685 -15.079
   91    HG2  LYS  13           2HG      LYS  13  -3.095  -4.822 -16.747
   92    HG3  LYS  13           3HG      LYS  13  -1.678  -5.208 -15.768
   93    HD2  LYS  13           2HD      LYS  13  -2.535  -7.275 -15.669
   94    HD3  LYS  13           3HD      LYS  13  -3.667  -6.598 -14.496
   95    HE2  LYS  13           2HE      LYS  13  -4.218  -6.533 -17.447
   96    HE3  LYS  13           3HE      LYS  13  -4.630  -7.934 -16.459
   97    HZ1  LYS  13           3HZ      LYS  13  -6.461  -6.301 -16.761
   98    HZ2  LYS  13           1HZ      LYS  13  -5.561  -5.180 -15.869
   99    HZ3  LYS  13           2HZ      LYS  13  -6.082  -6.616 -15.143
  100    H    CYS  14           H        CYS  14  -2.988  -0.902 -15.394
  101    HA   CYS  14           HA       CYS  14  -3.652   0.287 -12.798
  102    HB2  CYS  14           2HB      CYS  14  -3.562   2.423 -13.885
  103    HB3  CYS  14           3HB      CYS  14  -2.138   1.514 -14.381
  104    H    ILE  15           H        ILE  15  -5.320  -1.726 -14.139
  105    HA   ILE  15           HA       ILE  15  -7.502  -2.139 -14.651
  106    HB   ILE  15           HB       ILE  15  -8.338   0.412 -13.347
  107   HG12  ILE  15          2HG1      ILE  15  -7.105  -1.947 -11.908
  108   HG13  ILE  15          3HG1      ILE  15  -6.472  -0.306 -11.961
  109   HG21  ILE  15          1HG2      ILE  15 -10.236  -0.724 -12.818
  110   HG22  ILE  15          2HG2      ILE  15  -9.757  -1.645 -14.243
  111   HG23  ILE  15          3HG2      ILE  15  -9.397  -2.263 -12.631
  112   HD11  ILE  15          3HD1      ILE  15  -7.470  -0.317  -9.913
  113   HD12  ILE  15          1HD1      ILE  15  -8.795   0.286 -10.908
  114   HD13  ILE  15          2HD1      ILE  15  -8.758  -1.409 -10.421
  115    HA   PRO  16           HA       PRO  16  -7.459   0.831 -18.200
  116    HB2  PRO  16           2HB      PRO  16  -7.686  -1.094 -20.101
  117    HB3  PRO  16           3HB      PRO  16  -6.132  -0.585 -19.430
  118    HG2  PRO  16           2HG      PRO  16  -7.805  -2.968 -18.735
  119    HG3  PRO  16           3HG      PRO  16  -6.049  -2.861 -18.961
  120    HD2  PRO  16           2HD      PRO  16  -7.203  -2.895 -16.512
  121    HD3  PRO  16           3HD      PRO  16  -5.703  -2.008 -16.848
  122    H    HIS  17           H        HIS  17  -9.539  -1.770 -17.183
  123    HA   HIS  17           HA       HIS  17 -11.652  -1.635 -18.926
  124    HB2  HIS  17           2HB      HIS  17 -11.288  -2.424 -16.132
  125    HB3  HIS  17           3HB      HIS  17 -12.921  -1.868 -16.485
  126    HD1  HIS  17           HD1      HIS  17 -14.013  -4.160 -16.353
  127    HD2  HIS  17           HD2      HIS  17 -10.889  -3.984 -19.087
  128    HE1  HIS  17           HE1      HIS  17 -14.144  -6.303 -17.662
  129    HA   PRO  18           HA       PRO  18 -13.682   1.968 -16.456
  130    HB2  PRO  18           2HB      PRO  18 -12.243   3.104 -14.454
  131    HB3  PRO  18           3HB      PRO  18 -13.309   1.716 -14.203
  132    HG2  PRO  18           2HG      PRO  18 -10.337   1.784 -14.555
  133    HG3  PRO  18           3HG      PRO  18 -11.306   0.839 -13.410
  134    HD2  PRO  18           2HD      PRO  18 -10.303  -0.221 -15.691
  135    HD3  PRO  18           3HD      PRO  18 -11.842  -0.756 -14.985
  136    H    GLY  19           H        GLY  19 -13.004   2.754 -18.605
  137    HA2  GLY  19           2HA      GLY  19 -12.444   5.193 -19.087
  138    HA3  GLY  19           3HA      GLY  19 -10.860   4.776 -18.452
  139    H    CYS  20           H        CYS  20 -11.283   2.032 -19.767
  140    HA   CYS  20           HA       CYS  20 -11.105   2.693 -22.587
  141    HB2  CYS  20           2HB      CYS  20  -8.757   2.103 -20.911
  142    HB3  CYS  20           3HB      CYS  20  -8.861   1.148 -22.387
  143    H    VAL  21           H        VAL  21 -10.377   0.510 -23.771
  144    HA   VAL  21           HA       VAL  21 -12.071  -1.610 -22.622
  145    HB   VAL  21           HB       VAL  21 -11.393  -1.231 -25.538
  146   HG11  VAL  21          1HG1      VAL  21 -13.749  -2.754 -24.558
  147   HG12  VAL  21          2HG1      VAL  21 -12.760  -3.001 -25.999
  148   HG13  VAL  21          3HG1      VAL  21 -12.157  -3.500 -24.418
  149   HG21  VAL  21          3HG2      VAL  21 -12.790   0.521 -25.441
  150   HG22  VAL  21          1HG2      VAL  21 -14.061  -0.693 -25.301
  151   HG23  VAL  21          2HG2      VAL  21 -13.403   0.065 -23.852
  152    H    HIS  22           H        HIS  22  -9.178  -1.083 -24.627
  153    HA   HIS  22           HA       HIS  22  -7.906  -3.365 -23.338
  154    HB2  HIS  22           2HB      HIS  22  -8.063  -3.151 -26.350
  155    HB3  HIS  22           3HB      HIS  22  -7.266  -4.420 -25.426
  156    HD1  HIS  22           HD1      HIS  22  -9.081  -5.733 -23.739
  157    HD2  HIS  22           HD2      HIS  22 -10.532  -3.871 -27.158
  158    HE1  HIS  22           HE1      HIS  22 -11.319  -6.790 -24.181
  159    H    GLY  23           H        GLY  23  -5.591  -3.579 -24.600
  160    HA2  GLY  23           2HA      GLY  23  -3.795  -2.271 -25.564
  161    HA3  GLY  23           3HA      GLY  23  -4.520  -0.842 -24.842
  162    H    ILE  24           H        ILE  24  -2.833  -0.148 -23.618
  163    HA   ILE  24           HA       ILE  24  -2.235  -1.724 -21.248
  164    HB   ILE  24           HB       ILE  24   0.172  -1.515 -21.456
  165   HG12  ILE  24          2HG1      ILE  24   0.534  -0.894 -24.190
  166   HG13  ILE  24          3HG1      ILE  24  -0.531   0.344 -23.534
  167   HG21  ILE  24          1HG2      ILE  24  -1.014  -3.495 -22.398
  168   HG22  ILE  24          2HG2      ILE  24  -0.926  -2.729 -23.984
  169   HG23  ILE  24          3HG2      ILE  24   0.555  -3.174 -23.137
  170   HD11  ILE  24          3HD1      ILE  24   1.442   0.102 -21.624
  171   HD12  ILE  24          1HD1      ILE  24   2.307  -0.057 -23.152
  172   HD13  ILE  24          2HD1      ILE  24   1.311   1.366 -22.846
  173    H    CYS  25           H        CYS  25  -0.360  -0.295 -20.030
  174    HA   CYS  25           HA       CYS  25  -0.582   2.518 -20.280
  175    HB2  CYS  25           2HB      CYS  25  -1.931   3.055 -18.364
  176    HB3  CYS  25           3HB      CYS  25  -2.863   1.978 -19.399
  177    H    ASN  26           H        ASN  26   0.882   3.591 -18.984
  178    HA   ASN  26           HA       ASN  26   2.498   1.885 -17.205
  179    HB2  ASN  26           2HB      ASN  26   3.623   2.620 -19.337
  180    HB3  ASN  26           3HB      ASN  26   3.492   4.279 -18.759
  181   HD21  ASN  26          1HD2      ASN  26   5.092   5.048 -17.574
  182   HD22  ASN  26          2HD2      ASN  26   6.328   4.108 -16.815
  183    H    GLU  27           H        GLU  27   0.158   3.565 -16.561
  184    HA   GLU  27           HA       GLU  27   1.256   4.858 -14.253
  185    HB2  GLU  27           2HB      GLU  27   0.655   6.430 -16.639
  186    HB3  GLU  27           3HB      GLU  27  -0.219   6.989 -15.220
  187    HG2  GLU  27           2HG      GLU  27   2.029   6.962 -14.026
  188    HG3  GLU  27           3HG      GLU  27   2.744   6.800 -15.629
  189    HA   PRO  28           HA       PRO  28  -2.722   4.025 -12.605
  190    HB2  PRO  28           2HB      PRO  28  -3.080   6.080 -10.867
  191    HB3  PRO  28           3HB      PRO  28  -1.934   4.766 -10.578
  192    HG2  PRO  28           2HG      PRO  28  -1.429   7.522 -11.633
  193    HG3  PRO  28           3HG      PRO  28  -0.499   6.591 -10.443
  194    HD2  PRO  28           2HD      PRO  28   0.256   6.808 -13.034
  195    HD3  PRO  28           3HD      PRO  28   0.580   5.358 -12.063
  196    H    TRP  29           H        TRP  29  -4.585   4.205 -13.666
  197    HA   TRP  29           HA       TRP  29  -6.418   5.071 -14.696
  198    HB2  TRP  29           2HB      TRP  29  -5.677   7.722 -13.454
  199    HB3  TRP  29           3HB      TRP  29  -7.275   7.177 -13.957
  200    HD1  TRP  29           HD1      TRP  29  -5.758   7.912 -10.902
  201    HE1  TRP  29           HE1      TRP  29  -6.533   6.402  -8.967
  202    HE3  TRP  29           HE3      TRP  29  -7.788   4.088 -13.620
  203    HZ2  TRP  29           HZ2      TRP  29  -7.832   3.918  -8.637
  204    HZ3  TRP  29           HZ3      TRP  29  -8.776   2.181 -12.418
  205    HH2  TRP  29           HH2      TRP  29  -8.796   2.100  -9.978
  206    H    GLN  30           H        GLN  30  -4.987   4.714 -16.621
  207    HA   GLN  30           HA       GLN  30  -4.855   7.195 -18.154
  208    HB2  GLN  30           2HB      GLN  30  -2.542   5.495 -17.422
  209    HB3  GLN  30           3HB      GLN  30  -2.610   6.040 -19.092
  210    HG2  GLN  30           2HG      GLN  30  -3.167   8.317 -17.629
  211    HG3  GLN  30           3HG      GLN  30  -1.921   7.497 -16.690
  212   HE21  GLN  30          1HE2      GLN  30  -2.610   9.373 -19.432
  213   HE22  GLN  30          2HE2      GLN  30  -1.021   9.400 -20.110
  214    H    CYS  31           H        CYS  31  -4.097   6.516 -20.526
  215    HA   CYS  31           HA       CYS  31  -5.235   3.948 -21.301
  216    HB2  CYS  31           2HB      CYS  31  -6.445   6.603 -21.909
  217    HB3  CYS  31           3HB      CYS  31  -6.469   5.381 -23.176
  218    H    LEU  32           H        LEU  32  -3.755   3.059 -22.568
  219    HA   LEU  32           HA       LEU  32  -2.444   4.732 -24.598
  220    HB2  LEU  32           2HB      LEU  32  -1.095   2.624 -22.918
  221    HB3  LEU  32           3HB      LEU  32  -0.347   3.532 -24.230
  222    HG   LEU  32           HG       LEU  32  -1.316   4.676 -21.611
  223   HD11  LEU  32          1HD1      LEU  32   1.505   4.900 -22.326
  224   HD12  LEU  32          2HD1      LEU  32   0.966   3.241 -22.069
  225   HD13  LEU  32          3HD1      LEU  32   0.751   4.444 -20.798
  226   HD21  LEU  32          3HD2      LEU  32  -1.422   6.590 -22.752
  227   HD22  LEU  32          1HD2      LEU  32  -0.629   5.892 -24.163
  228   HD23  LEU  32          2HD2      LEU  32   0.339   6.511 -22.825
  229    H    CYS  33           H        CYS  33  -3.356   3.994 -26.419
  230    HA   CYS  33           HA       CYS  33  -3.954   1.184 -26.769
  231    HB2  CYS  33           2HB      CYS  33  -4.183   3.378 -28.831
  232    HB3  CYS  33           3HB      CYS  33  -5.013   1.826 -28.817
  233    H    GLU  34           H        GLU  34  -3.310   0.142 -28.893
  234    HA   GLU  34           HA       GLU  34  -0.439   0.606 -29.312
  235    HB2  GLU  34           2HB      GLU  34  -1.839  -1.725 -28.733
  236    HB3  GLU  34           3HB      GLU  34  -1.502  -1.850 -30.454
  237    HG2  GLU  34           2HG      GLU  34   0.864  -1.555 -30.045
  238    HG3  GLU  34           3HG      GLU  34   0.559  -1.334 -28.323
  239    H    THR  35           H        THR  35   0.347   0.004 -31.551
  240    HA   THR  35           HA       THR  35  -0.737   1.720 -33.449
  241    HB   THR  35           HB       THR  35   0.935  -0.732 -34.030
  242    HG1  THR  35           HG1      THR  35   1.689   1.925 -33.319
  243   HG21  THR  35          3HG2      THR  35   1.749   1.010 -35.841
  244   HG22  THR  35          1HG2      THR  35   0.134   1.672 -35.599
  245   HG23  THR  35          2HG2      THR  35   0.332  -0.001 -36.121
  246    H    ASN  36           H        ASN  36  -1.602  -1.531 -32.640
  247    HA   ASN  36           HA       ASN  36  -2.936  -2.169 -35.079
  248    HB2  ASN  36           2HB      ASN  36  -2.992  -3.347 -32.306
  249    HB3  ASN  36           3HB      ASN  36  -4.040  -3.950 -33.587
  250   HD21  ASN  36          1HD2      ASN  36  -2.648  -4.137 -35.753
  251   HD22  ASN  36          2HD2      ASN  36  -1.225  -5.099 -35.561
  252    H    TRP  37           H        TRP  37  -3.797  -0.433 -32.208
  253    HA   TRP  37           HA       TRP  37  -6.629  -0.423 -32.962
  254    HB2  TRP  37           2HB      TRP  37  -5.396   0.805 -30.494
  255    HB3  TRP  37           3HB      TRP  37  -7.093   0.425 -30.776
  256    HD1  TRP  37           HD1      TRP  37  -3.730  -1.335 -30.097
  257    HE1  TRP  37           HE1      TRP  37  -4.224  -3.646 -29.077
  258    HE3  TRP  37           HE3      TRP  37  -8.824  -1.344 -30.533
  259    HZ2  TRP  37           HZ2      TRP  37  -6.474  -5.259 -28.529
  260    HZ3  TRP  37           HZ3      TRP  37 -10.072  -3.309 -29.738
  261    HH2  TRP  37           HH2      TRP  37  -8.920  -5.226 -28.757
  262    H    GLY  38           H        GLY  38  -7.480   1.976 -32.004
  263    HA2  GLY  38           2HA      GLY  38  -6.063   4.272 -32.566
  264    HA3  GLY  38           3HA      GLY  38  -6.715   3.747 -34.111
  265    H    GLY  39           H        GLY  39  -7.739   4.351 -30.752
  266    HA2  GLY  39           2HA      GLY  39  -9.976   5.921 -31.741
  267    HA3  GLY  39           3HA      GLY  39 -10.410   4.451 -30.882
  268    H    GLN  40           H        GLN  40 -11.448   5.651 -29.251
  269    HA   GLN  40           HA       GLN  40  -9.765   7.401 -27.621
  270    HB2  GLN  40           2HB      GLN  40 -12.093   8.080 -28.357
  271    HB3  GLN  40           3HB      GLN  40 -12.709   6.843 -27.268
  272    HG2  GLN  40           2HG      GLN  40 -12.364   8.095 -25.452
  273    HG3  GLN  40           3HG      GLN  40 -10.802   8.675 -26.027
  274   HE21  GLN  40          1HE2      GLN  40 -11.214  10.069 -28.173
  275   HE22  GLN  40          2HE2      GLN  40 -12.337  11.359 -27.931
  276    H    LEU  41           H        LEU  41 -11.670   4.437 -27.412
  277    HA   LEU  41           HA       LEU  41 -10.485   3.934 -24.762
  278    HB2  LEU  41           2HB      LEU  41 -12.882   2.484 -25.813
  279    HB3  LEU  41           3HB      LEU  41 -12.369   2.717 -24.143
  280    HG   LEU  41           HG       LEU  41 -13.510   4.871 -25.922
  281   HD11  LEU  41          1HD1      LEU  41 -14.931   3.814 -23.540
  282   HD12  LEU  41          2HD1      LEU  41 -14.966   2.857 -25.021
  283   HD13  LEU  41          3HD1      LEU  41 -15.572   4.513 -25.027
  284   HD21  LEU  41          3HD2      LEU  41 -12.427   4.816 -23.147
  285   HD22  LEU  41          1HD2      LEU  41 -13.787   5.878 -23.513
  286   HD23  LEU  41          2HD2      LEU  41 -12.271   6.051 -24.397
  287    H    CYS  42           H        CYS  42  -9.350   3.399 -27.462
  288    HA   CYS  42           HA       CYS  42  -8.254   1.755 -28.598
  289    HB2  CYS  42           2HB      CYS  42  -8.223   0.296 -25.955
  290    HB3  CYS  42           3HB      CYS  42  -7.051   0.176 -27.263
  291    H    ASP  43           H        ASP  43 -10.861   1.567 -29.122
  292    HA   ASP  43           HA       ASP  43 -11.438  -1.320 -28.975
  293    HB2  ASP  43           2HB      ASP  43 -13.104  -0.076 -27.727
  294    HB3  ASP  43           3HB      ASP  43 -13.371   1.003 -29.094
  295    H    LYS  44           H        LYS  44 -11.279   1.537 -30.975
  296    HA   LYS  44           HA       LYS  44 -11.159  -0.128 -33.347
  297    HB2  LYS  44           2HB      LYS  44 -12.857   1.233 -34.546
  298    HB3  LYS  44           3HB      LYS  44 -13.535   0.279 -33.233
  299    HG2  LYS  44           2HG      LYS  44 -14.588   2.270 -32.883
  300    HG3  LYS  44           3HG      LYS  44 -13.164   2.487 -31.863
  301    HD2  LYS  44           2HD      LYS  44 -12.609   4.297 -33.028
  302    HD3  LYS  44           3HD      LYS  44 -12.489   3.318 -34.492
  303    HE2  LYS  44           2HE      LYS  44 -14.985   3.574 -34.727
  304    HE3  LYS  44           3HE      LYS  44 -14.909   4.759 -33.425
  305    HZ1  LYS  44           3HZ      LYS  44 -14.787   6.029 -35.344
  306    HZ2  LYS  44           1HZ      LYS  44 -13.775   4.934 -36.143
  307    HZ3  LYS  44           2HZ      LYS  44 -13.164   5.890 -34.890
  Start of MODEL    8
    1    H1   ARG   1           H        ARG   1   0.309  -2.499   1.971
    2    HA   ARG   1           HA       ARG   1  -2.163  -3.613   1.010
    3    HB2  ARG   1           2HB      ARG   1  -3.555  -1.692   1.772
    4    HB3  ARG   1           3HB      ARG   1  -3.002  -2.726   3.083
    5    HG2  ARG   1           2HG      ARG   1  -1.895  -1.064   4.066
    6    HG3  ARG   1           3HG      ARG   1  -1.184  -0.523   2.545
    7    HD2  ARG   1           2HD      ARG   1  -4.065   0.003   2.877
    8    HD3  ARG   1           3HD      ARG   1  -2.995   0.895   3.957
    9    HE   ARG   1           HE       ARG   1  -1.892   1.203   1.475
   10   HH11  ARG   1          1HH1      ARG   1  -5.003   1.845   2.900
   11   HH12  ARG   1          2HH1      ARG   1  -5.347   3.188   1.862
   12   HH21  ARG   1          1HH2      ARG   1  -2.333   2.971   0.102
   13   HH22  ARG   1          2HH2      ARG   1  -3.828   3.827   0.270
   14    H    CYS   2           H        CYS   2  -2.596  -2.885  -0.990
   15    HA   CYS   2           HA       CYS   2  -0.787  -0.948  -2.154
   16    HB2  CYS   2           2HB      CYS   2  -2.516  -3.089  -3.118
   17    HB3  CYS   2           3HB      CYS   2  -2.635  -1.637  -4.107
   18    H    GLN   3           H        GLN   3  -1.549   0.843  -3.471
   19    HA   GLN   3           HA       GLN   3  -3.592   2.338  -2.106
   20    HB2  GLN   3           2HB      GLN   3  -1.327   2.955  -3.657
   21    HB3  GLN   3           3HB      GLN   3  -2.706   3.580  -4.551
   22    HG2  GLN   3           2HG      GLN   3  -3.394   4.570  -2.240
   23    HG3  GLN   3           3HG      GLN   3  -1.687   4.347  -1.859
   24   HE21  GLN   3          1HE2      GLN   3  -0.128   5.431  -3.174
   25   HE22  GLN   3          2HE2      GLN   3  -0.545   6.893  -3.993
   26    H    TYR   4           H        TYR   4  -4.865   3.812  -3.944
   27    HA   TYR   4           HA       TYR   4  -6.681   1.876  -5.128
   28    HB2  TYR   4           2HB      TYR   4  -7.556   3.782  -3.805
   29    HB3  TYR   4           3HB      TYR   4  -6.891   4.891  -4.999
   30    HD1  TYR   4           HD1      TYR   4  -8.838   1.712  -5.300
   31    HD2  TYR   4           HD2      TYR   4  -8.611   5.867  -6.188
   32    HE1  TYR   4           HE1      TYR   4 -10.915   1.541  -6.607
   33    HE2  TYR   4           HE2      TYR   4 -10.687   5.707  -7.496
   34    HH   TYR   4           HH       TYR   4 -12.759   3.072  -7.343
   35    H    GLY   5           H        GLY   5  -6.541   1.258  -7.175
   36    HA2  GLY   5           2HA      GLY   5  -6.608   1.940  -9.517
   37    HA3  GLY   5           3HA      GLY   5  -5.394   3.150  -9.131
   38    H    TRP   6           H        TRP   6  -5.011   0.068  -7.670
   39    HA   TRP   6           HA       TRP   6  -3.348  -0.993  -9.791
   40    HB2  TRP   6           2HB      TRP   6  -2.197  -0.046  -7.166
   41    HB3  TRP   6           3HB      TRP   6  -1.379  -1.216  -8.197
   42    HD1  TRP   6           HD1      TRP   6  -1.345   2.328  -7.518
   43    HE1  TRP   6           HE1      TRP   6  -0.348   3.670  -9.476
   44    HE3  TRP   6           HE3      TRP   6  -1.541  -1.266 -11.149
   45    HZ2  TRP   6           HZ2      TRP   6   0.273   3.259 -12.198
   46    HZ3  TRP   6           HZ3      TRP   6  -0.727  -0.711 -13.403
   47    HH2  TRP   6           HH2      TRP   6   0.161   1.506 -13.915
   48    H    GLN   7           H        GLN   7  -5.366  -2.374  -9.319
   49    HA   GLN   7           HA       GLN   7  -4.882  -4.229  -7.098
   50    HB2  GLN   7           2HB      GLN   7  -7.153  -4.893  -7.271
   51    HB3  GLN   7           3HB      GLN   7  -7.145  -3.139  -7.399
   52    HG2  GLN   7           2HG      GLN   7  -7.373  -3.293  -9.811
   53    HG3  GLN   7           3HG      GLN   7  -7.326  -5.053  -9.715
   54   HE21  GLN   7          1HE2      GLN   7  -9.377  -4.949 -10.820
   55   HE22  GLN   7          2HE2      GLN   7 -10.822  -4.679  -9.913
   56    H    GLY   8           H        GLY   8  -5.792  -6.555  -7.762
   57    HA2  GLY   8           2HA      GLY   8  -5.853  -8.192  -9.554
   58    HA3  GLY   8           3HA      GLY   8  -4.596  -7.268 -10.364
   59    H    LEU   9           H        LEU   9  -2.991  -8.740 -10.514
   60    HA   LEU   9           HA       LEU   9  -2.234 -10.271  -8.145
   61    HB2  LEU   9           2HB      LEU   9  -2.095 -10.677 -10.985
   62    HB3  LEU   9           3HB      LEU   9  -0.495 -10.858 -10.269
   63    HG   LEU   9           HG       LEU   9  -1.651 -13.002 -10.472
   64   HD11  LEU   9          1HD1      LEU   9  -1.612 -13.542  -7.927
   65   HD12  LEU   9          2HD1      LEU   9  -0.993 -11.898  -7.778
   66   HD13  LEU   9          3HD1      LEU   9  -0.122 -13.083  -8.752
   67   HD21  LEU   9          3HD2      LEU   9  -3.948 -11.947 -10.165
   68   HD22  LEU   9          1HD2      LEU   9  -3.626 -12.022  -8.433
   69   HD23  LEU   9          2HD2      LEU   9  -3.671 -13.505  -9.386
   70    H    TYR  10           H        TYR  10  -0.824  -9.381  -6.799
   71    HA   TYR  10           HA       TYR  10   0.917  -8.177  -5.967
   72    HB2  TYR  10           2HB      TYR  10   2.090  -8.894  -8.660
   73    HB3  TYR  10           3HB      TYR  10   3.010  -8.193  -7.333
   74    HD1  TYR  10           HD1      TYR  10   1.284 -11.197  -8.542
   75    HD2  TYR  10           HD2      TYR  10   3.605  -9.516  -5.398
   76    HE1  TYR  10           HE1      TYR  10   1.693 -13.451  -7.647
   77    HE2  TYR  10           HE2      TYR  10   4.023 -11.765  -4.495
   78    HH   TYR  10           HH       TYR  10   2.853 -14.032  -4.590
   79    H    CYS  11           H        CYS  11  -1.193  -6.810  -7.549
   80    HA   CYS  11           HA       CYS  11  -1.686  -4.753  -8.395
   81    HB2  CYS  11           2HB      CYS  11   0.804  -3.854  -6.938
   82    HB3  CYS  11           3HB      CYS  11  -0.617  -2.889  -7.327
   83    H    ASP  12           H        ASP  12  -1.033  -5.709 -10.513
   84    HA   ASP  12           HA       ASP  12   1.128  -4.095 -11.682
   85    HB2  ASP  12           2HB      ASP  12   1.757  -6.549 -11.293
   86    HB3  ASP  12           3HB      ASP  12   0.591  -6.929 -12.558
   87    H    LYS  13           H        LYS  13  -1.553  -3.386 -11.693
   88    HA   LYS  13           HA       LYS  13  -2.020  -3.110 -14.496
   89    HB2  LYS  13           2HB      LYS  13  -3.468  -5.183 -12.985
   90    HB3  LYS  13           3HB      LYS  13  -4.496  -4.107 -13.923
   91    HG2  LYS  13           2HG      LYS  13  -2.572  -4.699 -15.739
   92    HG3  LYS  13           3HG      LYS  13  -2.642  -6.197 -14.808
   93    HD2  LYS  13           2HD      LYS  13  -4.894  -6.552 -15.328
   94    HD3  LYS  13           3HD      LYS  13  -5.141  -4.871 -15.809
   95    HE2  LYS  13           2HE      LYS  13  -4.300  -5.204 -17.889
   96    HE3  LYS  13           3HE      LYS  13  -3.130  -6.404 -17.341
   97    HZ1  LYS  13           3HZ      LYS  13  -5.284  -7.019 -18.754
   98    HZ2  LYS  13           1HZ      LYS  13  -5.929  -7.178 -17.198
   99    HZ3  LYS  13           2HZ      LYS  13  -4.576  -8.086 -17.649
  100    H    CYS  14           H        CYS  14  -3.328  -1.383 -14.946
  101    HA   CYS  14           HA       CYS  14  -4.193   0.184 -12.633
  102    HB2  CYS  14           2HB      CYS  14  -4.181   2.091 -14.078
  103    HB3  CYS  14           3HB      CYS  14  -2.704   1.188 -14.400
  104    H    ILE  15           H        ILE  15  -5.666  -2.160 -13.758
  105    HA   ILE  15           HA       ILE  15  -7.793  -2.791 -14.284
  106    HB   ILE  15           HB       ILE  15  -8.855  -0.214 -13.218
  107   HG12  ILE  15          2HG1      ILE  15  -7.469  -2.334 -11.563
  108   HG13  ILE  15          3HG1      ILE  15  -6.967  -0.657 -11.750
  109   HG21  ILE  15          1HG2      ILE  15 -10.668  -1.449 -12.619
  110   HG22  ILE  15          2HG2      ILE  15 -10.088  -2.447 -13.951
  111   HG23  ILE  15          3HG2      ILE  15  -9.714  -2.894 -12.287
  112   HD11  ILE  15          3HD1      ILE  15  -8.133  -0.183  -9.936
  113   HD12  ILE  15          1HD1      ILE  15  -9.603  -0.554 -10.836
  114   HD13  ILE  15          2HD1      ILE  15  -8.810  -1.811  -9.887
  115    HA   PRO  16           HA       PRO  16  -7.911  -0.139 -18.076
  116    HB2  PRO  16           2HB      PRO  16  -7.941  -2.231 -19.806
  117    HB3  PRO  16           3HB      PRO  16  -6.448  -1.541 -19.160
  118    HG2  PRO  16           2HG      PRO  16  -7.938  -3.986 -18.287
  119    HG3  PRO  16           3HG      PRO  16  -6.192  -3.754 -18.495
  120    HD2  PRO  16           2HD      PRO  16  -7.393  -3.675 -16.069
  121    HD3  PRO  16           3HD      PRO  16  -5.961  -2.700 -16.459
  122    H    HIS  17           H        HIS  17  -9.797  -2.804 -16.867
  123    HA   HIS  17           HA       HIS  17 -11.876  -2.993 -18.646
  124    HB2  HIS  17           2HB      HIS  17 -11.509  -3.510 -15.790
  125    HB3  HIS  17           3HB      HIS  17 -13.174  -3.120 -16.212
  126    HD1  HIS  17           HD1      HIS  17 -14.176  -5.420 -16.014
  127    HD2  HIS  17           HD2      HIS  17 -10.832  -5.330 -18.478
  128    HE1  HIS  17           HE1      HIS  17 -14.085  -7.683 -17.106
  129    HA   PRO  18           HA       PRO  18 -14.242   0.629 -16.528
  130    HB2  PRO  18           2HB      PRO  18 -12.943   2.046 -14.611
  131    HB3  PRO  18           3HB      PRO  18 -13.898   0.601 -14.257
  132    HG2  PRO  18           2HG      PRO  18 -10.934   0.882 -14.569
  133    HG3  PRO  18           3HG      PRO  18 -11.850  -0.038 -13.361
  134    HD2  PRO  18           2HD      PRO  18 -10.715  -1.203 -15.526
  135    HD3  PRO  18           3HD      PRO  18 -12.221  -1.800 -14.800
  136    H    GLY  19           H        GLY  19 -13.602   1.298 -18.720
  137    HA2  GLY  19           2HA      GLY  19 -13.212   3.738 -19.375
  138    HA3  GLY  19           3HA      GLY  19 -11.601   3.465 -18.729
  139    H    CYS  20           H        CYS  20 -10.702   1.220 -19.687
  140    HA   CYS  20           HA       CYS  20 -10.777   1.609 -22.593
  141    HB2  CYS  20           2HB      CYS  20  -8.765   0.103 -20.908
  142    HB3  CYS  20           3HB      CYS  20  -8.640   0.419 -22.635
  143    H    VAL  21           H        VAL  21  -9.938  -0.721 -23.593
  144    HA   VAL  21           HA       VAL  21 -11.813  -2.766 -22.618
  145    HB   VAL  21           HB       VAL  21 -11.403  -2.115 -25.538
  146   HG11  VAL  21          1HG1      VAL  21 -11.973  -4.487 -24.846
  147   HG12  VAL  21          2HG1      VAL  21 -13.523  -3.848 -24.297
  148   HG13  VAL  21          3HG1      VAL  21 -13.068  -3.721 -25.996
  149   HG21  VAL  21          3HG2      VAL  21 -12.609  -0.302 -24.479
  150   HG22  VAL  21          1HG2      VAL  21 -13.713  -1.252 -25.472
  151   HG23  VAL  21          2HG2      VAL  21 -13.716  -1.445 -23.719
  152    H    HIS  22           H        HIS  22  -9.048  -2.083 -24.737
  153    HA   HIS  22           HA       HIS  22  -7.821  -4.585 -23.866
  154    HB2  HIS  22           2HB      HIS  22  -8.088  -3.837 -26.785
  155    HB3  HIS  22           3HB      HIS  22  -7.240  -5.242 -26.148
  156    HD1  HIS  22           HD1      HIS  22  -8.960  -6.853 -24.625
  157    HD2  HIS  22           HD2      HIS  22 -10.594  -4.432 -27.580
  158    HE1  HIS  22           HE1      HIS  22 -11.217  -7.840 -25.131
  159    H    GLY  23           H        GLY  23  -5.503  -4.704 -24.468
  160    HA2  GLY  23           2HA      GLY  23  -3.548  -3.512 -25.313
  161    HA3  GLY  23           3HA      GLY  23  -4.329  -2.017 -24.819
  162    H    ILE  24           H        ILE  24  -2.462  -1.456 -23.616
  163    HA   ILE  24           HA       ILE  24  -2.358  -2.796 -21.004
  164    HB   ILE  24           HB       ILE  24   0.063  -2.600 -20.916
  165   HG12  ILE  24          2HG1      ILE  24  -0.120  -1.639 -23.780
  166   HG13  ILE  24          3HG1      ILE  24   0.274  -0.627 -22.395
  167   HG21  ILE  24          1HG2      ILE  24   0.224  -4.629 -21.804
  168   HG22  ILE  24          2HG2      ILE  24  -1.383  -4.397 -22.491
  169   HG23  ILE  24          3HG2      ILE  24   0.047  -3.986 -23.437
  170   HD11  ILE  24          3HD1      ILE  24   2.237  -2.164 -22.002
  171   HD12  ILE  24          1HD1      ILE  24   1.896  -2.848 -23.591
  172   HD13  ILE  24          2HD1      ILE  24   2.314  -1.141 -23.436
  173    H    CYS  25           H        CYS  25  -0.645  -1.309 -19.636
  174    HA   CYS  25           HA       CYS  25  -0.832   1.492 -20.088
  175    HB2  CYS  25           2HB      CYS  25  -2.370   2.126 -18.365
  176    HB3  CYS  25           3HB      CYS  25  -3.185   0.946 -19.387
  177    H    ASN  26           H        ASN  26   0.330   2.715 -18.547
  178    HA   ASN  26           HA       ASN  26   1.941   1.079 -16.699
  179    HB2  ASN  26           2HB      ASN  26   3.838   2.355 -17.180
  180    HB3  ASN  26           3HB      ASN  26   3.059   2.204 -18.752
  181   HD21  ASN  26          1HD2      ASN  26   1.550   4.007 -19.314
  182   HD22  ASN  26          2HD2      ASN  26   2.042   5.608 -18.887
  183    H    GLU  27           H        GLU  27  -0.006   3.918 -17.112
  184    HA   GLU  27           HA       GLU  27   0.539   4.734 -14.340
  185    HB2  GLU  27           2HB      GLU  27  -0.125   6.195 -16.805
  186    HB3  GLU  27           3HB      GLU  27  -1.014   6.729 -15.385
  187    HG2  GLU  27           2HG      GLU  27   1.237   6.878 -14.220
  188    HG3  GLU  27           3HG      GLU  27   1.953   6.702 -15.822
  189    HA   PRO  28           HA       PRO  28  -3.451   3.574 -12.938
  190    HB2  PRO  28           2HB      PRO  28  -4.111   5.623 -11.283
  191    HB3  PRO  28           3HB      PRO  28  -2.874   4.425 -10.883
  192    HG2  PRO  28           2HG      PRO  28  -2.548   7.194 -11.976
  193    HG3  PRO  28           3HG      PRO  28  -1.622   6.377 -10.702
  194    HD2  PRO  28           2HD      PRO  28  -0.714   6.609 -13.243
  195    HD3  PRO  28           3HD      PRO  28  -0.328   5.215 -12.214
  196    H    TRP  29           H        TRP  29  -5.391   3.606 -13.875
  197    HA   TRP  29           HA       TRP  29  -7.231   4.285 -15.026
  198    HB2  TRP  29           2HB      TRP  29  -6.600   7.080 -14.072
  199    HB3  TRP  29           3HB      TRP  29  -8.172   6.421 -14.518
  200    HD1  TRP  29           HD1      TRP  29  -6.712   7.543 -11.556
  201    HE1  TRP  29           HE1      TRP  29  -7.439   6.221  -9.471
  202    HE3  TRP  29           HE3      TRP  29  -8.560   3.365 -13.850
  203    HZ2  TRP  29           HZ2      TRP  29  -8.637   3.735  -8.878
  204    HZ3  TRP  29           HZ3      TRP  29  -9.478   1.560 -12.452
  205    HH2  TRP  29           HH2      TRP  29  -9.514   1.743 -10.017
  206    H    GLN  30           H        GLN  30  -4.598   4.299 -16.300
  207    HA   GLN  30           HA       GLN  30  -4.994   6.391 -18.331
  208    HB2  GLN  30           2HB      GLN  30  -2.697   5.629 -16.938
  209    HB3  GLN  30           3HB      GLN  30  -2.490   4.945 -18.544
  210    HG2  GLN  30           2HG      GLN  30  -3.447   7.663 -18.682
  211    HG3  GLN  30           3HG      GLN  30  -1.958   7.549 -17.746
  212   HE21  GLN  30          1HE2      GLN  30  -0.266   6.100 -18.810
  213   HE22  GLN  30          2HE2      GLN  30  -0.028   6.337 -20.505
  214    H    CYS  31           H        CYS  31  -3.641   5.402 -20.443
  215    HA   CYS  31           HA       CYS  31  -4.458   2.700 -21.034
  216    HB2  CYS  31           2HB      CYS  31  -6.390   4.547 -21.460
  217    HB3  CYS  31           3HB      CYS  31  -5.551   4.615 -23.007
  218    H    LEU  32           H        LEU  32  -3.293   1.812 -22.684
  219    HA   LEU  32           HA       LEU  32  -1.661   3.578 -24.355
  220    HB2  LEU  32           2HB      LEU  32  -0.562   1.227 -22.821
  221    HB3  LEU  32           3HB      LEU  32   0.332   2.233 -23.959
  222    HG   LEU  32           HG       LEU  32  -0.781   3.119 -21.298
  223   HD11  LEU  32          1HD1      LEU  32   1.883   3.504 -21.173
  224   HD12  LEU  32          2HD1      LEU  32   1.818   2.061 -22.184
  225   HD13  LEU  32          3HD1      LEU  32   1.069   2.053 -20.588
  226   HD21  LEU  32          3HD2      LEU  32   1.119   4.924 -22.370
  227   HD22  LEU  32          1HD2      LEU  32  -0.588   5.204 -22.025
  228   HD23  LEU  32          2HD2      LEU  32  -0.094   4.619 -23.615
  229    H    CYS  33           H        CYS  33  -2.013   3.047 -26.397
  230    HA   CYS  33           HA       CYS  33  -2.072   0.237 -27.173
  231    HB2  CYS  33           2HB      CYS  33  -4.099   0.641 -28.597
  232    HB3  CYS  33           3HB      CYS  33  -4.413   0.665 -26.865
  233    H    GLU  34           H        GLU  34  -2.096   0.030 -29.613
  234    HA   GLU  34           HA       GLU  34  -0.043   1.725 -30.676
  235    HB2  GLU  34           2HB      GLU  34  -1.192  -0.835 -31.295
  236    HB3  GLU  34           3HB      GLU  34  -1.140   0.151 -32.749
  237    HG2  GLU  34           2HG      GLU  34   1.279   0.593 -32.237
  238    HG3  GLU  34           3HG      GLU  34   1.155  -0.634 -30.978
  239    H    THR  35           H        THR  35  -0.288   2.587 -32.970
  240    HA   THR  35           HA       THR  35  -2.311   4.562 -32.982
  241    HB   THR  35           HB       THR  35  -0.548   3.682 -35.278
  242    HG1  THR  35           HG1      THR  35   0.670   4.377 -33.478
  243   HG21  THR  35          3HG2      THR  35  -0.936   6.014 -36.075
  244   HG22  THR  35          1HG2      THR  35  -2.149   6.199 -34.809
  245   HG23  THR  35          2HG2      THR  35  -2.385   5.009 -36.090
  246    H    ASN  36           H        ASN  36  -2.143   1.352 -34.267
  247    HA   ASN  36           HA       ASN  36  -4.033   1.501 -36.318
  248    HB2  ASN  36           2HB      ASN  36  -2.707  -0.581 -34.801
  249    HB3  ASN  36           3HB      ASN  36  -4.383  -1.011 -35.128
  250   HD21  ASN  36          1HD2      ASN  36  -1.769   0.624 -36.894
  251   HD22  ASN  36          2HD2      ASN  36  -1.927  -0.317 -38.334
  252    H    TRP  37           H        TRP  37  -4.480   0.729 -32.875
  253    HA   TRP  37           HA       TRP  37  -7.243   0.320 -32.946
  254    HB2  TRP  37           2HB      TRP  37  -5.488   1.351 -30.709
  255    HB3  TRP  37           3HB      TRP  37  -7.168   0.864 -30.503
  256    HD1  TRP  37           HD1      TRP  37  -3.791  -0.689 -31.597
  257    HE1  TRP  37           HE1      TRP  37  -3.818  -3.181 -30.951
  258    HE3  TRP  37           HE3      TRP  37  -8.577  -1.017 -29.829
  259    HZ2  TRP  37           HZ2      TRP  37  -5.629  -5.039 -29.841
  260    HZ3  TRP  37           HZ3      TRP  37  -9.379  -3.188 -28.994
  261    HH2  TRP  37           HH2      TRP  37  -7.935  -5.156 -29.001
  262    H    GLY  38           H        GLY  38  -5.533   3.261 -31.845
  263    HA2  GLY  38           2HA      GLY  38  -6.101   5.482 -32.068
  264    HA3  GLY  38           3HA      GLY  38  -7.307   4.998 -33.251
  265    H    GLY  39           H        GLY  39  -6.906   6.459 -30.340
  266    HA2  GLY  39           2HA      GLY  39  -9.158   7.290 -29.516
  267    HA3  GLY  39           3HA      GLY  39  -9.548   5.584 -29.355
  268    H    GLN  40           H        GLN  40  -9.683   7.412 -27.231
  269    HA   GLN  40           HA       GLN  40  -7.320   7.215 -25.619
  270    HB2  GLN  40           2HB      GLN  40  -9.959   8.472 -25.418
  271    HB3  GLN  40           3HB      GLN  40  -9.355   7.860 -23.884
  272    HG2  GLN  40           2HG      GLN  40  -8.791  10.231 -24.323
  273    HG3  GLN  40           3HG      GLN  40  -7.390   9.200 -24.039
  274   HE21  GLN  40          1HE2      GLN  40  -8.863  11.407 -26.121
  275   HE22  GLN  40          2HE2      GLN  40  -7.759  11.278 -27.443
  276    H    LEU  41           H        LEU  41 -10.317   5.434 -25.937
  277    HA   LEU  41           HA       LEU  41  -9.782   3.825 -23.583
  278    HB2  LEU  41           2HB      LEU  41 -11.905   3.270 -25.624
  279    HB3  LEU  41           3HB      LEU  41 -11.888   2.860 -23.910
  280    HG   LEU  41           HG       LEU  41 -12.308   5.592 -25.118
  281   HD11  LEU  41          1HD1      LEU  41 -14.513   5.409 -24.069
  282   HD12  LEU  41          2HD1      LEU  41 -14.124   3.772 -23.542
  283   HD13  LEU  41          3HD1      LEU  41 -14.249   4.138 -25.262
  284   HD21  LEU  41          3HD2      LEU  41 -12.883   5.594 -22.368
  285   HD22  LEU  41          1HD2      LEU  41 -11.592   6.456 -23.204
  286   HD23  LEU  41          2HD2      LEU  41 -11.293   4.849 -22.543
  287    H    CYS  42           H        CYS  42  -9.429   3.632 -27.043
  288    HA   CYS  42           HA       CYS  42  -8.397   2.125 -28.398
  289    HB2  CYS  42           2HB      CYS  42  -7.307   0.859 -25.882
  290    HB3  CYS  42           3HB      CYS  42  -6.624   0.783 -27.503
  291    H    ASP  43           H        ASP  43 -10.740   1.443 -28.599
  292    HA   ASP  43           HA       ASP  43 -11.070  -1.341 -27.688
  293    HB2  ASP  43           2HB      ASP  43 -13.489  -1.002 -27.879
  294    HB3  ASP  43           3HB      ASP  43 -12.776   0.179 -26.783
  295    H    LYS  44           H        LYS  44 -11.138   0.849 -30.400
  296    HA   LYS  44           HA       LYS  44 -11.754  -1.389 -32.206
  297    HB2  LYS  44           2HB      LYS  44 -12.312   0.300 -33.880
  298    HB3  LYS  44           3HB      LYS  44 -13.245   0.549 -32.410
  299    HG2  LYS  44           2HG      LYS  44 -10.801   2.053 -32.301
  300    HG3  LYS  44           3HG      LYS  44 -11.690   2.419 -33.781
  301    HD2  LYS  44           2HD      LYS  44 -13.741   2.636 -32.234
  302    HD3  LYS  44           3HD      LYS  44 -12.558   2.743 -30.928
  303    HE2  LYS  44           2HE      LYS  44 -13.175   4.963 -31.665
  304    HE3  LYS  44           3HE      LYS  44 -11.493   4.639 -32.082
  305    HZ1  LYS  44           3HZ      LYS  44 -11.944   4.625 -34.288
  306    HZ2  LYS  44           1HZ      LYS  44 -13.195   5.656 -33.804
  307    HZ3  LYS  44           2HZ      LYS  44 -13.512   4.021 -34.097
  Start of MODEL    9
    1    H1   ARG   1           H        ARG   1   2.504  -0.173  -2.286
    2    HA   ARG   1           HA       ARG   1   0.925   1.344  -1.470
    3    HB2  ARG   1           2HB      ARG   1   2.233   3.136  -2.786
    4    HB3  ARG   1           3HB      ARG   1   1.057   2.859  -4.064
    5    HG2  ARG   1           2HG      ARG   1  -0.745   3.538  -2.632
    6    HG3  ARG   1           3HG      ARG   1   0.347   3.657  -1.251
    7    HD2  ARG   1           2HD      ARG   1   1.612   5.410  -2.500
    8    HD3  ARG   1           3HD      ARG   1   0.359   5.358  -3.739
    9    HE   ARG   1           HE       ARG   1  -0.951   5.792  -1.353
   10   HH11  ARG   1          1HH1      ARG   1   1.491   7.404  -3.240
   11   HH12  ARG   1          2HH1      ARG   1   1.046   8.990  -2.701
   12   HH21  ARG   1          1HH2      ARG   1  -1.546   7.874  -0.636
   13   HH22  ARG   1          2HH2      ARG   1  -0.681   9.256  -1.219
   14    H    CYS   2           H        CYS   2   0.608  -1.097  -2.953
   15    HA   CYS   2           HA       CYS   2  -1.445  -0.872  -4.891
   16    HB2  CYS   2           2HB      CYS   2  -0.035  -2.858  -4.753
   17    HB3  CYS   2           3HB      CYS   2  -0.655  -3.212  -3.144
   18    H    GLN   3           H        GLN   3  -3.370  -0.015  -4.460
   19    HA   GLN   3           HA       GLN   3  -5.159  -1.221  -2.637
   20    HB2  GLN   3           2HB      GLN   3  -3.502   0.408  -1.285
   21    HB3  GLN   3           3HB      GLN   3  -4.714   1.583  -1.780
   22    HG2  GLN   3           2HG      GLN   3  -6.117   0.893  -0.216
   23    HG3  GLN   3           3HG      GLN   3  -5.977  -0.781  -0.750
   24   HE21  GLN   3          1HE2      GLN   3  -4.451  -2.126   0.221
   25   HE22  GLN   3          2HE2      GLN   3  -3.724  -1.736   1.739
   26    H    TYR   4           H        TYR   4  -4.516   2.028  -3.965
   27    HA   TYR   4           HA       TYR   4  -7.240   2.005  -5.084
   28    HB2  TYR   4           2HB      TYR   4  -6.156   3.871  -3.431
   29    HB3  TYR   4           3HB      TYR   4  -5.770   4.565  -5.002
   30    HD1  TYR   4           HD1      TYR   4  -7.946   4.225  -6.700
   31    HD2  TYR   4           HD2      TYR   4  -8.046   4.769  -2.481
   32    HE1  TYR   4           HE1      TYR   4 -10.234   5.111  -6.875
   33    HE2  TYR   4           HE2      TYR   4 -10.334   5.656  -2.644
   34    HH   TYR   4           HH       TYR   4 -11.718   6.839  -4.546
   35    H    GLY   5           H        GLY   5  -7.397   1.741  -7.205
   36    HA2  GLY   5           2HA      GLY   5  -6.971   2.057  -9.460
   37    HA3  GLY   5           3HA      GLY   5  -5.613   3.084  -9.024
   38    H    TRP   6           H        TRP   6  -5.828  -0.084  -7.651
   39    HA   TRP   6           HA       TRP   6  -4.119  -1.269  -9.678
   40    HB2  TRP   6           2HB      TRP   6  -3.191  -0.718  -6.860
   41    HB3  TRP   6           3HB      TRP   6  -2.449  -1.951  -7.876
   42    HD1  TRP   6           HD1      TRP   6  -1.804   1.418  -6.865
   43    HE1  TRP   6           HE1      TRP   6  -0.381   2.702  -8.583
   44    HE3  TRP   6           HE3      TRP   6  -2.364  -1.702 -10.877
   45    HZ2  TRP   6           HZ2      TRP   6   0.400   2.429 -11.282
   46    HZ3  TRP   6           HZ3      TRP   6  -1.246  -1.118 -12.990
   47    HH2  TRP   6           HH2      TRP   6   0.106   0.905 -13.186
   48    H    GLN   7           H        GLN   7  -5.646  -2.845 -10.016
   49    HA   GLN   7           HA       GLN   7  -6.341  -4.544  -7.717
   50    HB2  GLN   7           2HB      GLN   7  -8.284  -5.249  -8.922
   51    HB3  GLN   7           3HB      GLN   7  -8.215  -3.494  -9.010
   52    HG2  GLN   7           2HG      GLN   7  -7.299  -3.634 -11.263
   53    HG3  GLN   7           3HG      GLN   7  -7.346  -5.394 -11.176
   54   HE21  GLN   7          1HE2      GLN   7  -8.694  -5.420 -13.011
   55   HE22  GLN   7          2HE2      GLN   7 -10.374  -5.036 -12.894
   56    H    GLY   8           H        GLY   8  -7.029  -6.871  -8.838
   57    HA2  GLY   8           2HA      GLY   8  -6.237  -8.537 -10.414
   58    HA3  GLY   8           3HA      GLY   8  -4.682  -7.719 -10.412
   59    H    LEU   9           H        LEU   9  -3.612  -9.664  -9.904
   60    HA   LEU   9           HA       LEU   9  -4.180 -10.808  -7.265
   61    HB2  LEU   9           2HB      LEU   9  -4.077 -12.421  -9.035
   62    HB3  LEU   9           3HB      LEU   9  -2.523 -11.794  -9.579
   63    HG   LEU   9           HG       LEU   9  -1.445 -12.651  -7.583
   64   HD11  LEU   9          1HD1      LEU   9  -2.675 -14.021  -5.974
   65   HD12  LEU   9          2HD1      LEU   9  -4.183 -13.647  -6.807
   66   HD13  LEU   9          3HD1      LEU   9  -3.276 -12.363  -6.008
   67   HD21  LEU   9          3HD2      LEU   9  -2.037 -14.100  -9.664
   68   HD22  LEU   9          1HD2      LEU   9  -3.122 -14.928  -8.546
   69   HD23  LEU   9          2HD2      LEU   9  -1.391 -14.870  -8.214
   70    H    TYR  10           H        TYR  10  -1.295  -9.985  -9.200
   71    HA   TYR  10           HA       TYR  10   0.144  -9.444  -6.701
   72    HB2  TYR  10           2HB      TYR  10   1.178  -9.859  -9.513
   73    HB3  TYR  10           3HB      TYR  10   2.186  -9.542  -8.106
   74    HD1  TYR  10           HD2      TYR  10   1.881 -11.220  -6.109
   75    HD2  TYR  10           HD1      TYR  10   0.769 -12.054 -10.130
   76    HE1  TYR  10           HE2      TYR  10   1.980 -13.630  -5.630
   77    HE2  TYR  10           HE1      TYR  10   0.863 -14.466  -9.663
   78    HH   TYR  10           HH       TYR  10   2.186 -15.943  -7.867
   79    H    CYS  11           H        CYS  11  -1.824  -7.628  -7.984
   80    HA   CYS  11           HA       CYS  11  -2.085  -5.428  -8.515
   81    HB2  CYS  11           2HB      CYS  11   0.528  -5.062  -7.041
   82    HB3  CYS  11           3HB      CYS  11  -0.749  -3.870  -7.257
   83    H    ASP  12           H        ASP  12  -1.820  -5.629 -10.755
   84    HA   ASP  12           HA       ASP  12   0.469  -4.208 -11.797
   85    HB2  ASP  12           2HB      ASP  12   1.122  -5.928 -13.402
   86    HB3  ASP  12           3HB      ASP  12   1.287  -6.533 -11.756
   87    H    LYS  13           H        LYS  13  -2.469  -3.938 -11.610
   88    HA   LYS  13           HA       LYS  13  -2.946  -3.361 -14.437
   89    HB2  LYS  13           2HB      LYS  13  -4.392  -5.333 -12.822
   90    HB3  LYS  13           3HB      LYS  13  -5.444  -4.156 -13.598
   91    HG2  LYS  13           2HG      LYS  13  -4.599  -4.734 -15.762
   92    HG3  LYS  13           3HG      LYS  13  -3.367  -5.779 -15.051
   93    HD2  LYS  13           2HD      LYS  13  -6.199  -6.332 -14.359
   94    HD3  LYS  13           3HD      LYS  13  -5.671  -6.724 -15.997
   95    HE2  LYS  13           2HE      LYS  13  -4.064  -7.600 -13.627
   96    HE3  LYS  13           3HE      LYS  13  -5.481  -8.518 -14.135
   97    HZ1  LYS  13           3HZ      LYS  13  -4.220  -9.494 -15.651
   98    HZ2  LYS  13           1HZ      LYS  13  -2.888  -8.541 -15.229
   99    HZ3  LYS  13           2HZ      LYS  13  -3.971  -8.005 -16.412
  100    H    CYS  14           H        CYS  14  -3.764  -1.387 -14.730
  101    HA   CYS  14           HA       CYS  14  -4.617   0.115 -12.369
  102    HB2  CYS  14           2HB      CYS  14  -4.185   2.100 -13.628
  103    HB3  CYS  14           3HB      CYS  14  -2.834   1.007 -13.914
  104    H    ILE  15           H        ILE  15  -6.309  -1.885 -13.774
  105    HA   ILE  15           HA       ILE  15  -8.448  -2.150 -14.516
  106    HB   ILE  15           HB       ILE  15  -9.203   0.513 -13.401
  107   HG12  ILE  15          2HG1      ILE  15  -8.320  -1.866 -11.754
  108   HG13  ILE  15          3HG1      ILE  15  -7.555  -0.282 -11.799
  109   HG21  ILE  15          1HG2      ILE  15 -11.232  -0.449 -13.035
  110   HG22  ILE  15          2HG2      ILE  15 -10.685  -1.465 -14.368
  111   HG23  ILE  15          3HG2      ILE  15 -10.544  -2.039 -12.706
  112   HD11  ILE  15          3HD1      ILE  15  -8.754   0.007  -9.919
  113   HD12  ILE  15          1HD1      ILE  15 -10.022   0.442 -11.065
  114   HD13  ILE  15          2HD1      ILE  15  -9.972  -1.183 -10.380
  115    HA   PRO  16           HA       PRO  16  -7.791   0.651 -18.142
  116    HB2  PRO  16           2HB      PRO  16  -7.975  -1.332 -19.988
  117    HB3  PRO  16           3HB      PRO  16  -6.463  -0.915 -19.172
  118    HG2  PRO  16           2HG      PRO  16  -8.387  -3.130 -18.578
  119    HG3  PRO  16           3HG      PRO  16  -6.615  -3.169 -18.618
  120    HD2  PRO  16           2HD      PRO  16  -8.018  -3.007 -16.307
  121    HD3  PRO  16           3HD      PRO  16  -6.423  -2.254 -16.511
  122    H    HIS  17           H        HIS  17 -10.171  -1.734 -17.263
  123    HA   HIS  17           HA       HIS  17 -12.073  -1.512 -19.228
  124    HB2  HIS  17           2HB      HIS  17 -12.053  -2.239 -16.404
  125    HB3  HIS  17           3HB      HIS  17 -13.585  -1.526 -16.901
  126    HD1  HIS  17           HD1      HIS  17 -14.998  -3.606 -16.945
  127    HD2  HIS  17           HD2      HIS  17 -11.505  -3.992 -19.161
  128    HE1  HIS  17           HE1      HIS  17 -15.228  -5.779 -18.190
  129    HA   PRO  18           HA       PRO  18 -14.051   2.339 -17.117
  130    HB2  PRO  18           2HB      PRO  18 -12.741   3.446 -15.012
  131    HB3  PRO  18           3HB      PRO  18 -13.936   2.156 -14.829
  132    HG2  PRO  18           2HG      PRO  18 -10.948   1.979 -14.862
  133    HG3  PRO  18           3HG      PRO  18 -12.106   1.162 -13.796
  134    HD2  PRO  18           2HD      PRO  18 -10.959  -0.069 -15.917
  135    HD3  PRO  18           3HD      PRO  18 -12.602  -0.453 -15.364
  136    H    GLY  19           H        GLY  19 -13.111   3.000 -19.199
  137    HA2  GLY  19           2HA      GLY  19 -12.307   5.348 -19.721
  138    HA3  GLY  19           3HA      GLY  19 -10.842   4.863 -18.880
  139    H    CYS  20           H        CYS  20 -11.356   2.087 -20.141
  140    HA   CYS  20           HA       CYS  20 -10.745   2.610 -22.931
  141    HB2  CYS  20           2HB      CYS  20  -8.714   1.860 -20.936
  142    HB3  CYS  20           3HB      CYS  20  -8.722   0.857 -22.383
  143    H    VAL  21           H        VAL  21 -10.090   0.312 -23.937
  144    HA   VAL  21           HA       VAL  21 -12.024  -1.646 -22.878
  145    HB   VAL  21           HB       VAL  21 -11.351  -1.235 -25.793
  146   HG11  VAL  21          1HG1      VAL  21 -13.028  -2.808 -26.275
  147   HG12  VAL  21          2HG1      VAL  21 -12.106  -3.518 -24.949
  148   HG13  VAL  21          3HG1      VAL  21 -13.666  -2.757 -24.632
  149   HG21  VAL  21          3HG2      VAL  21 -12.667   0.571 -25.647
  150   HG22  VAL  21          1HG2      VAL  21 -13.995  -0.579 -25.487
  151   HG23  VAL  21          2HG2      VAL  21 -13.258   0.124 -24.047
  152    H    HIS  22           H        HIS  22  -9.076  -1.240 -24.817
  153    HA   HIS  22           HA       HIS  22  -8.045  -3.725 -23.676
  154    HB2  HIS  22           2HB      HIS  22  -7.952  -3.163 -26.645
  155    HB3  HIS  22           3HB      HIS  22  -7.339  -4.594 -25.823
  156    HD1  HIS  22           HD1      HIS  22  -9.431  -5.845 -24.374
  157    HD2  HIS  22           HD2      HIS  22 -10.354  -3.633 -27.768
  158    HE1  HIS  22           HE1      HIS  22 -11.694  -6.657 -25.111
  159    H    GLY  23           H        GLY  23  -5.659  -4.010 -24.497
  160    HA2  GLY  23           2HA      GLY  23  -3.671  -2.803 -25.234
  161    HA3  GLY  23           3HA      GLY  23  -4.374  -1.352 -24.535
  162    H    ILE  24           H        ILE  24  -2.705  -0.880 -23.152
  163    HA   ILE  24           HA       ILE  24  -2.572  -2.533 -20.762
  164    HB   ILE  24           HB       ILE  24  -0.101  -2.499 -20.712
  165   HG12  ILE  24          2HG1      ILE  24  -0.060  -1.898 -23.642
  166   HG13  ILE  24          3HG1      ILE  24  -0.135  -0.558 -22.503
  167   HG21  ILE  24          1HG2      ILE  24  -1.445  -4.437 -21.573
  168   HG22  ILE  24          2HG2      ILE  24  -1.108  -3.857 -23.203
  169   HG23  ILE  24          3HG2      ILE  24   0.218  -4.363 -22.156
  170   HD11  ILE  24          3HD1      ILE  24   2.057  -2.474 -23.043
  171   HD12  ILE  24          1HD1      ILE  24   2.113  -0.736 -22.746
  172   HD13  ILE  24          2HD1      ILE  24   1.882  -1.854 -21.402
  173    H    CYS  25           H        CYS  25  -0.759  -1.368 -19.267
  174    HA   CYS  25           HA       CYS  25  -0.552   1.450 -19.488
  175    HB2  CYS  25           2HB      CYS  25  -2.091   2.180 -17.808
  176    HB3  CYS  25           3HB      CYS  25  -2.999   1.193 -18.948
  177    H    ASN  26           H        ASN  26   0.675   2.379 -17.798
  178    HA   ASN  26           HA       ASN  26   1.921   0.401 -16.004
  179    HB2  ASN  26           2HB      ASN  26   3.562   1.100 -17.592
  180    HB3  ASN  26           3HB      ASN  26   3.117   2.794 -17.405
  181   HD21  ASN  26          1HD2      ASN  26   4.581   3.896 -16.348
  182   HD22  ASN  26          2HD2      ASN  26   5.543   3.324 -15.032
  183    H    GLU  27           H        GLU  27   0.414   3.507 -16.293
  184    HA   GLU  27           HA       GLU  27   0.882   4.024 -13.434
  185    HB2  GLU  27           2HB      GLU  27   0.599   5.772 -15.800
  186    HB3  GLU  27           3HB      GLU  27  -0.201   6.336 -14.340
  187    HG2  GLU  27           2HG      GLU  27   1.900   6.208 -13.121
  188    HG3  GLU  27           3HG      GLU  27   2.710   5.607 -14.566
  189    HA   PRO  28           HA       PRO  28  -3.345   3.450 -12.416
  190    HB2  PRO  28           2HB      PRO  28  -3.798   5.448 -10.635
  191    HB3  PRO  28           3HB      PRO  28  -2.808   4.032 -10.259
  192    HG2  PRO  28           2HG      PRO  28  -1.949   6.781 -11.077
  193    HG3  PRO  28           3HG      PRO  28  -1.276   5.726  -9.821
  194    HD2  PRO  28           2HD      PRO  28  -0.136   5.994 -12.262
  195    HD3  PRO  28           3HD      PRO  28  -0.067   4.481 -11.338
  196    H    TRP  29           H        TRP  29  -5.128   3.861 -13.548
  197    HA   TRP  29           HA       TRP  29  -6.731   4.925 -14.760
  198    HB2  TRP  29           2HB      TRP  29  -5.800   7.487 -13.463
  199    HB3  TRP  29           3HB      TRP  29  -7.400   7.120 -14.102
  200    HD1  TRP  29           HD1      TRP  29  -6.089   7.729 -10.930
  201    HE1  TRP  29           HE1      TRP  29  -7.194   6.343  -9.063
  202    HE3  TRP  29           HE3      TRP  29  -8.280   4.106 -13.796
  203    HZ2  TRP  29           HZ2      TRP  29  -8.783   4.022  -8.836
  204    HZ3  TRP  29           HZ3      TRP  29  -9.575   2.339 -12.676
  205    HH2  TRP  29           HH2      TRP  29  -9.820   2.299 -10.247
  206    H    GLN  30           H        GLN  30  -5.213   4.382 -16.557
  207    HA   GLN  30           HA       GLN  30  -4.713   6.776 -18.119
  208    HB2  GLN  30           2HB      GLN  30  -2.574   5.094 -16.983
  209    HB3  GLN  30           3HB      GLN  30  -2.411   5.449 -18.697
  210    HG2  GLN  30           2HG      GLN  30  -3.091   7.860 -17.382
  211    HG3  GLN  30           3HG      GLN  30  -1.793   7.093 -16.470
  212   HE21  GLN  30          1HE2      GLN  30  -0.130   6.040 -18.121
  213   HE22  GLN  30          2HE2      GLN  30   0.458   7.151 -19.306
  214    H    CYS  31           H        CYS  31  -3.816   6.057 -20.370
  215    HA   CYS  31           HA       CYS  31  -4.904   3.462 -21.170
  216    HB2  CYS  31           2HB      CYS  31  -5.872   6.141 -22.084
  217    HB3  CYS  31           3HB      CYS  31  -5.860   4.804 -23.230
  218    H    LEU  32           H        LEU  32  -3.433   2.440 -22.341
  219    HA   LEU  32           HA       LEU  32  -1.677   4.016 -24.100
  220    HB2  LEU  32           2HB      LEU  32  -0.854   1.632 -22.448
  221    HB3  LEU  32           3HB      LEU  32   0.176   2.532 -23.560
  222    HG   LEU  32           HG       LEU  32  -1.013   3.606 -21.002
  223   HD11  LEU  32          1HD1      LEU  32   0.893   3.089 -19.929
  224   HD12  LEU  32          2HD1      LEU  32   1.899   3.392 -21.345
  225   HD13  LEU  32          3HD1      LEU  32   1.040   1.860 -21.185
  226   HD21  LEU  32          3HD2      LEU  32   1.167   5.123 -22.059
  227   HD22  LEU  32          1HD2      LEU  32  -0.485   5.638 -21.717
  228   HD23  LEU  32          2HD2      LEU  32  -0.083   4.956 -23.293
  229    H    CYS  33           H        CYS  33  -1.945   3.442 -26.143
  230    HA   CYS  33           HA       CYS  33  -2.191   0.627 -26.845
  231    HB2  CYS  33           2HB      CYS  33  -4.391   2.554 -26.994
  232    HB3  CYS  33           3HB      CYS  33  -4.072   1.743 -28.524
  233    H    GLU  34           H        GLU  34  -2.275   0.440 -29.345
  234    HA   GLU  34           HA       GLU  34  -0.014   1.920 -30.347
  235    HB2  GLU  34           2HB      GLU  34  -1.445  -0.519 -31.044
  236    HB3  GLU  34           3HB      GLU  34  -1.034   0.436 -32.461
  237    HG2  GLU  34           2HG      GLU  34   0.637  -1.319 -31.722
  238    HG3  GLU  34           3HG      GLU  34   1.258   0.300 -32.034
  239    H    THR  35           H        THR  35   0.004   3.114 -32.329
  240    HA   THR  35           HA       THR  35  -2.056   5.014 -32.532
  241    HB   THR  35           HB       THR  35   0.085   4.349 -34.563
  242    HG1  THR  35           HG1      THR  35   1.203   6.057 -33.527
  243   HG21  THR  35          3HG2      THR  35  -1.636   6.809 -34.235
  244   HG22  THR  35          1HG2      THR  35  -1.706   5.653 -35.565
  245   HG23  THR  35          2HG2      THR  35  -0.275   6.661 -35.347
  246    H    ASN  36           H        ASN  36  -1.547   1.956 -34.112
  247    HA   ASN  36           HA       ASN  36  -3.120   2.240 -36.383
  248    HB2  ASN  36           2HB      ASN  36  -2.714  -0.192 -34.630
  249    HB3  ASN  36           3HB      ASN  36  -3.443  -0.232 -36.233
  250   HD21  ASN  36          1HD2      ASN  36  -1.972   1.202 -37.813
  251   HD22  ASN  36          2HD2      ASN  36  -0.321   0.692 -37.837
  252    H    TRP  37           H        TRP  37  -4.077   1.264 -33.106
  253    HA   TRP  37           HA       TRP  37  -6.761   0.731 -33.592
  254    HB2  TRP  37           2HB      TRP  37  -5.394   1.828 -31.131
  255    HB3  TRP  37           3HB      TRP  37  -7.086   1.340 -31.160
  256    HD1  TRP  37           HD1      TRP  37  -3.602  -0.239 -31.812
  257    HE1  TRP  37           HE1      TRP  37  -3.716  -2.715 -31.120
  258    HE3  TRP  37           HE3      TRP  37  -8.556  -0.510 -30.575
  259    HZ2  TRP  37           HZ2      TRP  37  -5.649  -4.542 -30.175
  260    HZ3  TRP  37           HZ3      TRP  37  -9.458  -2.659 -29.786
  261    HH2  TRP  37           HH2      TRP  37  -8.034  -4.632 -29.592
  262    H    GLY  38           H        GLY  38  -5.540   3.739 -32.097
  263    HA2  GLY  38           2HA      GLY  38  -6.095   5.933 -32.781
  264    HA3  GLY  38           3HA      GLY  38  -7.408   5.274 -33.747
  265    H    GLY  39           H        GLY  39  -7.075   7.353 -31.460
  266    HA2  GLY  39           2HA      GLY  39  -8.922   8.182 -30.211
  267    HA3  GLY  39           3HA      GLY  39  -9.551   6.544 -30.107
  268    H    GLN  40           H        GLN  40  -9.671   7.699 -27.815
  269    HA   GLN  40           HA       GLN  40  -7.195   7.315 -26.323
  270    HB2  GLN  40           2HB      GLN  40  -8.487   9.341 -25.881
  271    HB3  GLN  40           3HB      GLN  40  -9.890   8.372 -25.452
  272    HG2  GLN  40           2HG      GLN  40  -9.211   8.345 -23.354
  273    HG3  GLN  40           3HG      GLN  40  -7.757   7.478 -23.845
  274   HE21  GLN  40          1HE2      GLN  40  -8.214   9.531 -21.770
  275   HE22  GLN  40          2HE2      GLN  40  -7.074  10.784 -22.106
  276    H    LEU  41           H        LEU  41 -10.580   6.215 -26.172
  277    HA   LEU  41           HA       LEU  41 -10.222   4.339 -24.121
  278    HB2  LEU  41           2HB      LEU  41 -12.196   4.016 -26.359
  279    HB3  LEU  41           3HB      LEU  41 -12.349   3.502 -24.681
  280    HG   LEU  41           HG       LEU  41 -12.501   6.319 -25.743
  281   HD11  LEU  41          1HD1      LEU  41 -14.544   4.608 -24.336
  282   HD12  LEU  41          2HD1      LEU  41 -14.503   4.926 -26.070
  283   HD13  LEU  41          3HD1      LEU  41 -14.779   6.249 -24.938
  284   HD21  LEU  41          3HD2      LEU  41 -12.598   5.337 -22.893
  285   HD22  LEU  41          1HD2      LEU  41 -12.930   6.985 -23.426
  286   HD23  LEU  41          2HD2      LEU  41 -11.314   6.305 -23.618
  287    H    CYS  42           H        CYS  42  -9.445   4.226 -27.488
  288    HA   CYS  42           HA       CYS  42  -8.459   2.655 -28.805
  289    HB2  CYS  42           2HB      CYS  42  -6.703   2.648 -27.160
  290    HB3  CYS  42           3HB      CYS  42  -7.635   1.601 -26.095
  291    H    ASP  43           H        ASP  43 -10.371   1.838 -29.681
  292    HA   ASP  43           HA       ASP  43 -10.985  -0.890 -28.846
  293    HB2  ASP  43           2HB      ASP  43 -13.462  -0.373 -29.124
  294    HB3  ASP  43           3HB      ASP  43 -12.696   0.256 -27.668
  295    H    LYS  44           H        LYS  44 -12.881  -1.646 -30.505
  296    HA   LYS  44           HA       LYS  44 -11.764  -1.082 -33.167
  297    HB2  LYS  44           2HB      LYS  44 -13.336  -3.483 -32.215
  298    HB3  LYS  44           3HB      LYS  44 -12.668  -3.270 -33.828
  299    HG2  LYS  44           2HG      LYS  44 -10.778  -4.199 -33.161
  300    HG3  LYS  44           3HG      LYS  44 -10.558  -2.905 -31.980
  301    HD2  LYS  44           2HD      LYS  44 -10.577  -4.701 -30.570
  302    HD3  LYS  44           3HD      LYS  44 -12.307  -4.352 -30.615
  303    HE2  LYS  44           2HE      LYS  44 -12.694  -6.394 -31.395
  304    HE3  LYS  44           3HE      LYS  44 -11.706  -6.040 -32.812
  305    HZ1  LYS  44           3HZ      LYS  44  -9.771  -6.820 -31.674
  306    HZ2  LYS  44           1HZ      LYS  44 -10.966  -8.012 -31.551
  307    HZ3  LYS  44           2HZ      LYS  44 -10.624  -7.017 -30.226
  Start of MODEL   10
    1    H1   ARG   1           H        ARG   1  -0.347   3.009   0.387
    2    HA   ARG   1           HA       ARG   1   0.778   2.605  -2.220
    3    HB2  ARG   1           2HB      ARG   1   1.442   1.460   0.493
    4    HB3  ARG   1           3HB      ARG   1   2.335   1.055  -0.966
    5    HG2  ARG   1           2HG      ARG   1   2.014   3.931  -0.424
    6    HG3  ARG   1           3HG      ARG   1   3.021   3.035   0.715
    7    HD2  ARG   1           2HD      ARG   1   4.258   2.114  -1.274
    8    HD3  ARG   1           3HD      ARG   1   3.366   3.266  -2.267
    9    HE   ARG   1           HE       ARG   1   4.492   4.780  -0.290
   10   HH11  ARG   1          1HH1      ARG   1   5.688   2.563  -2.693
   11   HH12  ARG   1          2HH1      ARG   1   7.220   3.357  -2.852
   12   HH21  ARG   1          1HH2      ARG   1   6.506   5.834  -0.490
   13   HH22  ARG   1          2HH2      ARG   1   7.684   5.216  -1.597
   14    H    CYS   2           H        CYS   2  -0.320   1.360  -3.608
   15    HA   CYS   2           HA       CYS   2  -1.279  -0.475  -4.549
   16    HB2  CYS   2           2HB      CYS   2   0.774  -1.563  -3.554
   17    HB3  CYS   2           3HB      CYS   2  -0.225  -2.025  -2.180
   18    H    GLN   3           H        GLN   3  -3.127   0.971  -3.472
   19    HA   GLN   3           HA       GLN   3  -5.083  -0.912  -2.551
   20    HB2  GLN   3           2HB      GLN   3  -3.734  -0.094  -0.485
   21    HB3  GLN   3           3HB      GLN   3  -4.629   1.405  -0.698
   22    HG2  GLN   3           2HG      GLN   3  -6.688  -0.242  -0.742
   23    HG3  GLN   3           3HG      GLN   3  -5.578  -1.270   0.163
   24   HE21  GLN   3          1HE2      GLN   3  -6.480  -1.175   2.138
   25   HE22  GLN   3          2HE2      GLN   3  -6.673   0.275   3.058
   26    H    TYR   4           H        TYR   4  -4.632   0.978  -4.748
   27    HA   TYR   4           HA       TYR   4  -7.249   1.996  -4.987
   28    HB2  TYR   4           2HB      TYR   4  -6.512   3.685  -3.399
   29    HB3  TYR   4           3HB      TYR   4  -5.104   4.044  -4.391
   30    HD1  TYR   4           HD2      TYR   4  -8.667   3.565  -5.378
   31    HD2  TYR   4           HD1      TYR   4  -5.374   6.244  -5.093
   32    HE1  TYR   4           HE2      TYR   4  -9.960   5.274  -6.586
   33    HE2  TYR   4           HE1      TYR   4  -6.658   7.961  -6.299
   34    HH   TYR   4           HH       TYR   4  -8.514   8.365  -7.503
   35    H    GLY   5           H        GLY   5  -7.555   1.622  -7.077
   36    HA2  GLY   5           2HA      GLY   5  -7.317   1.891  -9.362
   37    HA3  GLY   5           3HA      GLY   5  -5.925   2.920  -9.058
   38    H    TRP   6           H        TRP   6  -6.155  -0.302  -7.740
   39    HA   TRP   6           HA       TRP   6  -4.460  -1.397  -9.842
   40    HB2  TRP   6           2HB      TRP   6  -3.610  -1.174  -6.951
   41    HB3  TRP   6           3HB      TRP   6  -2.846  -2.265  -8.104
   42    HD1  TRP   6           HD1      TRP   6  -2.162   0.896  -6.620
   43    HE1  TRP   6           HE1      TRP   6  -0.709   2.402  -8.119
   44    HE3  TRP   6           HE3      TRP   6  -2.753  -1.567 -11.061
   45    HZ2  TRP   6           HZ2      TRP   6   0.081   2.529 -10.826
   46    HZ3  TRP   6           HZ3      TRP   6  -1.615  -0.688 -13.058
   47    HH2  TRP   6           HH2      TRP   6  -0.228   1.318 -12.941
   48    H    GLN   7           H        GLN   7  -5.057  -3.412 -10.299
   49    HA   GLN   7           HA       GLN   7  -6.228  -5.076  -8.191
   50    HB2  GLN   7           2HB      GLN   7  -8.076  -5.749  -9.567
   51    HB3  GLN   7           3HB      GLN   7  -8.062  -3.992  -9.494
   52    HG2  GLN   7           2HG      GLN   7  -7.135  -3.842 -11.692
   53    HG3  GLN   7           3HG      GLN   7  -6.906  -5.588 -11.765
   54   HE21  GLN   7          1HE2      GLN   7  -8.149  -5.739 -13.636
   55   HE22  GLN   7          2HE2      GLN   7  -9.871  -5.595 -13.605
   56    H    GLY   8           H        GLY   8  -6.837  -7.313  -9.591
   57    HA2  GLY   8           2HA      GLY   8  -5.948  -8.930 -11.095
   58    HA3  GLY   8           3HA      GLY   8  -4.454  -8.007 -11.157
   59    H    LEU   9           H        LEU   9  -3.026  -9.579 -10.590
   60    HA   LEU   9           HA       LEU   9  -3.413 -11.521  -8.610
   61    HB2  LEU   9           2HB      LEU   9  -1.448 -10.896 -10.451
   62    HB3  LEU   9           3HB      LEU   9  -0.644 -10.685  -8.897
   63    HG   LEU   9           HG       LEU   9  -0.291 -12.923  -9.841
   64   HD11  LEU   9          1HD1      LEU   9  -1.647 -14.036  -7.730
   65   HD12  LEU   9          2HD1      LEU   9  -1.455 -12.356  -7.232
   66   HD13  LEU   9          3HD1      LEU   9  -0.039 -13.316  -7.660
   67   HD21  LEU   9          3HD2      LEU   9  -2.565 -12.974 -10.966
   68   HD22  LEU   9          1HD2      LEU   9  -3.220 -13.430  -9.393
   69   HD23  LEU   9          2HD2      LEU   9  -2.036 -14.467 -10.189
   70    H    TYR  10           H        TYR  10  -1.761  -8.378  -8.454
   71    HA   TYR  10           HA       TYR  10  -2.402  -8.156  -5.646
   72    HB2  TYR  10           2HB      TYR  10   0.416  -8.537  -6.619
   73    HB3  TYR  10           3HB      TYR  10   0.086  -7.616  -5.156
   74    HD1  TYR  10           HD1      TYR  10  -1.020  -8.743  -3.220
   75    HD2  TYR  10           HD2      TYR  10   0.331 -10.910  -6.623
   76    HE1  TYR  10           HE1      TYR  10  -1.115 -10.829  -1.921
   77    HE2  TYR  10           HE2      TYR  10   0.239 -13.003  -5.334
   78    HH   TYR  10           HH       TYR  10   0.145 -13.834  -3.178
   79    H    CYS  11           H        CYS  11  -0.305  -6.786  -8.183
   80    HA   CYS  11           HA       CYS  11  -1.716  -4.314  -8.216
   81    HB2  CYS  11           2HB      CYS  11   0.547  -4.585  -6.393
   82    HB3  CYS  11           3HB      CYS  11   0.765  -3.274  -7.548
   83    H    ASP  12           H        ASP  12  -1.732  -4.141 -10.367
   84    HA   ASP  12           HA       ASP  12   0.573  -3.401 -11.800
   85    HB2  ASP  12           2HB      ASP  12   0.127  -6.237 -11.606
   86    HB3  ASP  12           3HB      ASP  12  -0.061  -5.719 -13.279
   87    H    LYS  13           H        LYS  13  -2.654  -4.813 -11.947
   88    HA   LYS  13           HA       LYS  13  -3.199  -3.565 -14.513
   89    HB2  LYS  13           2HB      LYS  13  -4.207  -5.800 -13.129
   90    HB3  LYS  13           3HB      LYS  13  -5.536  -4.652 -13.222
   91    HG2  LYS  13           2HG      LYS  13  -5.415  -4.586 -15.600
   92    HG3  LYS  13           3HG      LYS  13  -3.914  -5.515 -15.603
   93    HD2  LYS  13           2HD      LYS  13  -6.070  -6.867 -14.191
   94    HD3  LYS  13           3HD      LYS  13  -6.465  -6.536 -15.879
   95    HE2  LYS  13           2HE      LYS  13  -3.958  -7.454 -16.168
   96    HE3  LYS  13           3HE      LYS  13  -4.427  -8.334 -14.715
   97    HZ1  LYS  13           3HZ      LYS  13  -6.265  -9.290 -15.855
   98    HZ2  LYS  13           1HZ      LYS  13  -4.902  -9.513 -16.831
   99    HZ3  LYS  13           2HZ      LYS  13  -6.027  -8.310 -17.213
  100    H    CYS  14           H        CYS  14  -4.118  -1.638 -14.773
  101    HA   CYS  14           HA       CYS  14  -5.082  -0.222 -12.401
  102    HB2  CYS  14           2HB      CYS  14  -4.785   1.801 -13.642
  103    HB3  CYS  14           3HB      CYS  14  -3.358   0.809 -13.923
  104    H    ILE  15           H        ILE  15  -6.626  -2.319 -13.832
  105    HA   ILE  15           HA       ILE  15  -8.738  -2.721 -14.593
  106    HB   ILE  15           HB       ILE  15  -9.681  -0.134 -13.442
  107   HG12  ILE  15          2HG1      ILE  15  -8.642  -2.472 -11.828
  108   HG13  ILE  15          3HG1      ILE  15  -7.988  -0.839 -11.845
  109   HG21  ILE  15          1HG2      ILE  15 -11.640  -1.239 -13.102
  110   HG22  ILE  15          2HG2      ILE  15 -11.018  -2.196 -14.446
  111   HG23  ILE  15          3HG2      ILE  15 -10.845  -2.783 -12.792
  112   HD11  ILE  15          3HD1      ILE  15 -10.690  -0.574 -11.172
  113   HD12  ILE  15          1HD1      ILE  15 -10.082  -1.942 -10.239
  114   HD13  ILE  15          2HD1      ILE  15  -9.287  -0.371 -10.122
  115    HA   PRO  16           HA       PRO  16  -8.266   0.173 -18.174
  116    HB2  PRO  16           2HB      PRO  16  -8.301  -1.789 -20.050
  117    HB3  PRO  16           3HB      PRO  16  -6.825  -1.279 -19.220
  118    HG2  PRO  16           2HG      PRO  16  -8.591  -3.633 -18.669
  119    HG3  PRO  16           3HG      PRO  16  -6.820  -3.546 -18.700
  120    HD2  PRO  16           2HD      PRO  16  -8.240  -3.518 -16.395
  121    HD3  PRO  16           3HD      PRO  16  -6.702  -2.651 -16.579
  122    H    HIS  17           H        HIS  17 -10.475  -2.385 -17.340
  123    HA   HIS  17           HA       HIS  17 -12.379  -2.269 -19.311
  124    HB2  HIS  17           2HB      HIS  17 -12.323  -3.027 -16.494
  125    HB3  HIS  17           3HB      HIS  17 -13.900  -2.427 -17.000
  126    HD1  HIS  17           HD1      HIS  17 -15.228  -4.524 -17.223
  127    HD2  HIS  17           HD2      HIS  17 -11.539  -4.788 -19.117
  128    HE1  HIS  17           HE1      HIS  17 -15.260  -6.715 -18.456
  129    HA   PRO  18           HA       PRO  18 -14.632   1.402 -17.156
  130    HB2  PRO  18           2HB      PRO  18 -13.413   2.568 -15.029
  131    HB3  PRO  18           3HB      PRO  18 -14.514   1.194 -14.871
  132    HG2  PRO  18           2HG      PRO  18 -11.521   1.229 -14.891
  133    HG3  PRO  18           3HG      PRO  18 -12.623   0.317 -13.842
  134    HD2  PRO  18           2HD      PRO  18 -11.383  -0.800 -15.975
  135    HD3  PRO  18           3HD      PRO  18 -12.997  -1.306 -15.435
  136    H    GLY  19           H        GLY  19 -13.738   2.162 -19.223
  137    HA2  GLY  19           2HA      GLY  19 -13.087   4.586 -19.668
  138    HA3  GLY  19           3HA      GLY  19 -11.577   4.142 -18.885
  139    H    CYS  20           H        CYS  20 -10.746   1.901 -19.901
  140    HA   CYS  20           HA       CYS  20 -10.472   2.477 -22.761
  141    HB2  CYS  20           2HB      CYS  20  -8.701   1.446 -20.683
  142    HB3  CYS  20           3HB      CYS  20  -8.668   0.464 -22.145
  143    H    VAL  21           H        VAL  21  -9.842   0.245 -23.953
  144    HA   VAL  21           HA       VAL  21 -11.927  -1.725 -23.289
  145    HB   VAL  21           HB       VAL  21 -11.244  -0.862 -26.101
  146   HG11  VAL  21          1HG1      VAL  21 -12.986  -2.260 -26.821
  147   HG12  VAL  21          2HG1      VAL  21 -12.107  -3.216 -25.626
  148   HG13  VAL  21          3HG1      VAL  21 -13.630  -2.441 -25.189
  149   HG21  VAL  21          3HG2      VAL  21 -13.537  -0.062 -24.318
  150   HG22  VAL  21          1HG2      VAL  21 -12.337   0.988 -25.070
  151   HG23  VAL  21          2HG2      VAL  21 -13.534   0.163 -26.067
  152    H    HIS  22           H        HIS  22  -8.980  -1.109 -25.176
  153    HA   HIS  22           HA       HIS  22  -8.036  -3.785 -24.473
  154    HB2  HIS  22           2HB      HIS  22  -7.908  -2.740 -27.306
  155    HB3  HIS  22           3HB      HIS  22  -7.388  -4.322 -26.734
  156    HD1  HIS  22           HD1      HIS  22  -9.558  -5.678 -25.521
  157    HD2  HIS  22           HD2      HIS  22 -10.328  -2.864 -28.479
  158    HE1  HIS  22           HE1      HIS  22 -11.859  -6.218 -26.379
  159    H    GLY  23           H        GLY  23  -5.698  -4.060 -24.893
  160    HA2  GLY  23           2HA      GLY  23  -3.583  -2.980 -25.464
  161    HA3  GLY  23           3HA      GLY  23  -4.271  -1.474 -24.875
  162    H    ILE  24           H        ILE  24  -2.794  -1.013 -23.308
  163    HA   ILE  24           HA       ILE  24  -2.957  -2.622 -20.895
  164    HB   ILE  24           HB       ILE  24  -0.508  -2.683 -20.587
  165   HG12  ILE  24          2HG1      ILE  24  -0.406  -1.813 -23.483
  166   HG13  ILE  24          3HG1      ILE  24   0.038  -0.807 -22.109
  167   HG21  ILE  24          1HG2      ILE  24  -0.158  -4.623 -21.843
  168   HG22  ILE  24          2HG2      ILE  24  -1.908  -4.544 -21.648
  169   HG23  ILE  24          3HG2      ILE  24  -1.168  -4.054 -23.171
  170   HD11  ILE  24          3HD1      ILE  24   1.433  -3.227 -23.185
  171   HD12  ILE  24          1HD1      ILE  24   2.060  -1.595 -22.956
  172   HD13  ILE  24          2HD1      ILE  24   1.740  -2.622 -21.558
  173    H    CYS  25           H        CYS  25  -1.263  -1.489 -19.243
  174    HA   CYS  25           HA       CYS  25  -1.055   1.353 -19.528
  175    HB2  CYS  25           2HB      CYS  25  -2.600   2.035 -17.835
  176    HB3  CYS  25           3HB      CYS  25  -3.486   1.014 -18.963
  177    H    ASN  26           H        ASN  26   0.276   2.284 -17.977
  178    HA   ASN  26           HA       ASN  26   1.433   0.419 -16.010
  179    HB2  ASN  26           2HB      ASN  26   3.610   1.263 -16.427
  180    HB3  ASN  26           3HB      ASN  26   2.903   0.974 -18.014
  181   HD21  ASN  26          1HD2      ASN  26   4.488   3.171 -16.072
  182   HD22  ASN  26          2HD2      ASN  26   4.231   4.594 -17.016
  183    H    GLU  27           H        GLU  27  -0.715   2.458 -15.769
  184    HA   GLU  27           HA       GLU  27   0.273   3.708 -13.365
  185    HB2  GLU  27           2HB      GLU  27  -0.017   5.212 -15.864
  186    HB3  GLU  27           3HB      GLU  27  -0.894   5.917 -14.513
  187    HG2  GLU  27           2HG      GLU  27   1.178   5.915 -13.193
  188    HG3  GLU  27           3HG      GLU  27   2.044   5.271 -14.586
  189    HA   PRO  28           HA       PRO  28  -3.896   3.296 -12.065
  190    HB2  PRO  28           2HB      PRO  28  -4.227   5.458 -10.458
  191    HB3  PRO  28           3HB      PRO  28  -3.232   4.069 -10.006
  192    HG2  PRO  28           2HG      PRO  28  -2.394   6.716 -11.125
  193    HG3  PRO  28           3HG      PRO  28  -1.661   5.773  -9.814
  194    HD2  PRO  28           2HD      PRO  28  -0.658   5.795 -12.330
  195    HD3  PRO  28           3HD      PRO  28  -0.552   4.373 -11.272
  196    H    TRP  29           H        TRP  29  -5.584   3.560 -13.379
  197    HA   TRP  29           HA       TRP  29  -7.225   4.519 -14.626
  198    HB2  TRP  29           2HB      TRP  29  -6.464   7.145 -13.345
  199    HB3  TRP  29           3HB      TRP  29  -8.025   6.687 -14.018
  200    HD1  TRP  29           HD1      TRP  29  -6.825   7.399 -10.823
  201    HE1  TRP  29           HE1      TRP  29  -7.904   5.981  -8.966
  202    HE3  TRP  29           HE3      TRP  29  -8.760   3.638 -13.695
  203    HZ2  TRP  29           HZ2      TRP  29  -9.380   3.585  -8.747
  204    HZ3  TRP  29           HZ3      TRP  29  -9.991   1.821 -12.584
  205    HH2  TRP  29           HH2      TRP  29 -10.294   1.796 -10.161
  206    H    GLN  30           H        GLN  30  -5.036   4.079 -16.046
  207    HA   GLN  30           HA       GLN  30  -4.760   6.496 -17.705
  208    HB2  GLN  30           2HB      GLN  30  -2.703   4.904 -16.431
  209    HB3  GLN  30           3HB      GLN  30  -2.488   4.936 -18.176
  210    HG2  GLN  30           2HG      GLN  30  -2.983   7.481 -16.705
  211    HG3  GLN  30           3HG      GLN  30  -1.379   6.749 -16.679
  212   HE21  GLN  30          1HE2      GLN  30  -0.054   7.374 -18.217
  213   HE22  GLN  30          2HE2      GLN  30  -0.505   8.022 -19.753
  214    H    CYS  31           H        CYS  31  -3.609   5.656 -19.904
  215    HA   CYS  31           HA       CYS  31  -4.747   3.152 -20.819
  216    HB2  CYS  31           2HB      CYS  31  -5.801   5.826 -21.628
  217    HB3  CYS  31           3HB      CYS  31  -5.710   4.560 -22.848
  218    H    LEU  32           H        LEU  32  -3.657   2.290 -22.532
  219    HA   LEU  32           HA       LEU  32  -1.752   3.958 -23.988
  220    HB2  LEU  32           2HB      LEU  32  -0.963   1.388 -22.625
  221    HB3  LEU  32           3HB      LEU  32   0.072   2.399 -23.631
  222    HG   LEU  32           HG       LEU  32  -1.095   3.225 -20.973
  223   HD11  LEU  32          1HD1      LEU  32   0.802   1.368 -21.228
  224   HD12  LEU  32          2HD1      LEU  32   0.801   2.559 -19.928
  225   HD13  LEU  32          3HD1      LEU  32   1.810   2.810 -21.353
  226   HD21  LEU  32          3HD2      LEU  32  -0.005   4.735 -23.098
  227   HD22  LEU  32          1HD2      LEU  32   1.190   4.713 -21.801
  228   HD23  LEU  32          2HD2      LEU  32  -0.448   5.284 -21.481
  229    H    CYS  33           H        CYS  33  -1.375   3.303 -26.063
  230    HA   CYS  33           HA       CYS  33  -1.799   0.724 -27.080
  231    HB2  CYS  33           2HB      CYS  33  -4.199   2.274 -26.733
  232    HB3  CYS  33           3HB      CYS  33  -3.914   1.998 -28.448
  233    H    GLU  34           H        GLU  34  -1.985   0.784 -29.559
  234    HA   GLU  34           HA       GLU  34   0.071   2.503 -30.529
  235    HB2  GLU  34           2HB      GLU  34  -1.213   0.120 -31.380
  236    HB3  GLU  34           3HB      GLU  34  -1.376   1.293 -32.680
  237    HG2  GLU  34           2HG      GLU  34   1.212   1.640 -32.112
  238    HG3  GLU  34           3HG      GLU  34   1.030  -0.042 -31.615
  239    H    THR  35           H        THR  35  -0.113   3.962 -32.348
  240    HA   THR  35           HA       THR  35  -2.249   5.813 -32.022
  241    HB   THR  35           HB       THR  35  -0.291   5.778 -34.318
  242    HG1  THR  35           HG1      THR  35   1.032   5.749 -32.574
  243   HG21  THR  35          3HG2      THR  35  -0.636   8.152 -34.364
  244   HG22  THR  35          1HG2      THR  35  -1.603   8.092 -32.891
  245   HG23  THR  35          2HG2      THR  35  -2.217   7.373 -34.380
  246    H    ASN  36           H        ASN  36  -1.566   3.241 -34.291
  247    HA   ASN  36           HA       ASN  36  -3.320   3.929 -36.350
  248    HB2  ASN  36           2HB      ASN  36  -1.657   1.765 -35.747
  249    HB3  ASN  36           3HB      ASN  36  -3.268   1.066 -35.882
  250   HD21  ASN  36          1HD2      ASN  36  -1.443   3.610 -37.559
  251   HD22  ASN  36          2HD2      ASN  36  -1.759   3.020 -39.152
  252    H    TRP  37           H        TRP  37  -3.918   2.584 -33.202
  253    HA   TRP  37           HA       TRP  37  -6.490   1.522 -33.666
  254    HB2  TRP  37           2HB      TRP  37  -4.990   2.412 -31.230
  255    HB3  TRP  37           3HB      TRP  37  -6.703   2.024 -31.100
  256    HD1  TRP  37           HD1      TRP  37  -3.320   0.382 -31.887
  257    HE1  TRP  37           HE1      TRP  37  -3.559  -2.162 -31.573
  258    HE3  TRP  37           HE3      TRP  37  -8.364   0.132 -31.088
  259    HZ2  TRP  37           HZ2      TRP  37  -5.613  -4.027 -31.056
  260    HZ3  TRP  37           HZ3      TRP  37  -9.387  -2.070 -30.692
  261    HH2  TRP  37           HH2      TRP  37  -8.039  -4.106 -30.677
  262    H    GLY  38           H        GLY  38  -8.359   2.535 -32.157
  263    HA2  GLY  38           2HA      GLY  38  -9.185   4.886 -33.519
  264    HA3  GLY  38           3HA      GLY  38 -10.011   4.134 -32.162
  265    H    GLY  39           H        GLY  39 -10.376   5.665 -30.692
  266    HA2  GLY  39           2HA      GLY  39  -8.676   7.943 -30.372
  267    HA3  GLY  39           3HA      GLY  39 -10.051   7.521 -29.364
  268    H    GLN  40           H        GLN  40  -8.874   8.137 -27.501
  269    HA   GLN  40           HA       GLN  40  -6.385   6.933 -26.821
  270    HB2  GLN  40           2HB      GLN  40  -8.153   8.911 -25.709
  271    HB3  GLN  40           3HB      GLN  40  -7.665   7.779 -24.455
  272    HG2  GLN  40           2HG      GLN  40  -6.199   9.757 -24.633
  273    HG3  GLN  40           3HG      GLN  40  -5.352   8.227 -24.858
  274   HE21  GLN  40          1HE2      GLN  40  -3.982   8.172 -26.478
  275   HE22  GLN  40          2HE2      GLN  40  -4.039   9.152 -27.899
  276    H    LEU  41           H        LEU  41  -9.755   6.231 -26.067
  277    HA   LEU  41           HA       LEU  41  -9.387   4.320 -24.074
  278    HB2  LEU  41           2HB      LEU  41 -11.523   4.155 -26.180
  279    HB3  LEU  41           3HB      LEU  41 -11.599   3.607 -24.507
  280    HG   LEU  41           HG       LEU  41 -11.633   6.456 -25.493
  281   HD11  LEU  41          1HD1      LEU  41 -13.853   6.523 -24.605
  282   HD12  LEU  41          2HD1      LEU  41 -13.690   4.899 -23.938
  283   HD13  LEU  41          3HD1      LEU  41 -13.734   5.134 -25.685
  284   HD21  LEU  41          3HD2      LEU  41 -10.778   5.375 -22.964
  285   HD22  LEU  41          1HD2      LEU  41 -12.216   6.378 -22.764
  286   HD23  LEU  41          2HD2      LEU  41 -10.775   7.046 -23.531
  287    H    CYS  42           H        CYS  42  -8.817   4.145 -27.473
  288    HA   CYS  42           HA       CYS  42  -8.023   2.506 -28.836
  289    HB2  CYS  42           2HB      CYS  42  -6.190   2.360 -27.285
  290    HB3  CYS  42           3HB      CYS  42  -7.144   1.386 -26.171
  291    H    ASP  43           H        ASP  43  -9.902   1.730 -29.715
  292    HA   ASP  43           HA       ASP  43 -10.747  -0.889 -28.762
  293    HB2  ASP  43           2HB      ASP  43 -13.126  -0.315 -28.826
  294    HB3  ASP  43           3HB      ASP  43 -12.278   0.674 -27.641
  295    H    LYS  44           H        LYS  44 -12.092  -2.032 -30.347
  296    HA   LYS  44           HA       LYS  44 -11.186  -1.434 -33.042
  297    HB2  LYS  44           2HB      LYS  44 -11.898  -3.644 -33.613
  298    HB3  LYS  44           3HB      LYS  44 -11.077  -3.742 -32.061
  299    HG2  LYS  44           2HG      LYS  44 -13.693  -3.353 -31.334
  300    HG3  LYS  44           3HG      LYS  44 -13.827  -4.375 -32.767
  301    HD2  LYS  44           2HD      LYS  44 -11.739  -5.491 -31.313
  302    HD3  LYS  44           3HD      LYS  44 -12.932  -5.042 -30.092
  303    HE2  LYS  44           2HE      LYS  44 -14.547  -6.445 -30.969
  304    HE3  LYS  44           3HE      LYS  44 -13.806  -6.468 -32.568
  305    HZ1  LYS  44           3HZ      LYS  44 -12.539  -8.203 -32.025
  306    HZ2  LYS  44           1HZ      LYS  44 -13.576  -8.416 -30.705
  307    HZ3  LYS  44           2HZ      LYS  44 -12.125  -7.568 -30.513
  Start of MODEL   11
    1    H1   ARG   1           H        ARG   1   1.412  -0.815   0.925
    2    HA   ARG   1           HA       ARG   1  -0.177  -3.031  -0.194
    3    HB2  ARG   1           2HB      ARG   1  -0.343  -1.818   2.386
    4    HB3  ARG   1           3HB      ARG   1  -1.806  -1.424   1.493
    5    HG2  ARG   1           2HG      ARG   1  -2.404  -3.669   1.249
    6    HG3  ARG   1           3HG      ARG   1  -0.782  -4.235   1.656
    7    HD2  ARG   1           2HD      ARG   1  -1.086  -3.901   3.912
    8    HD3  ARG   1           3HD      ARG   1  -2.314  -2.659   3.670
    9    HE   ARG   1           HE       ARG   1  -3.921  -4.298   3.600
   10   HH11  ARG   1          1HH1      ARG   1  -0.765  -5.748   3.355
   11   HH12  ARG   1          2HH1      ARG   1  -1.352  -7.368   3.540
   12   HH21  ARG   1          1HH2      ARG   1  -4.705  -6.426   3.845
   13   HH22  ARG   1          2HH2      ARG   1  -3.594  -7.752   3.818
   14    H    CYS   2           H        CYS   2  -0.870  -2.435  -2.139
   15    HA   CYS   2           HA       CYS   2  -1.506   0.378  -2.646
   16    HB2  CYS   2           2HB      CYS   2  -1.395  -0.162  -4.991
   17    HB3  CYS   2           3HB      CYS   2   0.024  -0.842  -4.200
   18    H    GLN   3           H        GLN   3  -3.428   0.805  -4.054
   19    HA   GLN   3           HA       GLN   3  -5.562  -1.012  -4.267
   20    HB2  GLN   3           2HB      GLN   3  -7.085  -0.096  -2.565
   21    HB3  GLN   3           3HB      GLN   3  -5.669  -0.847  -1.841
   22    HG2  GLN   3           2HG      GLN   3  -4.704   1.551  -1.826
   23    HG3  GLN   3           3HG      GLN   3  -6.384   2.046  -2.027
   24   HE21  GLN   3          1HE2      GLN   3  -4.732  -0.455  -0.124
   25   HE22  GLN   3          2HE2      GLN   3  -5.435  -0.008   1.389
   26    H    TYR   4           H        TYR   4  -4.549   2.339  -3.935
   27    HA   TYR   4           HA       TYR   4  -6.791   3.416  -5.352
   28    HB2  TYR   4           2HB      TYR   4  -5.668   4.849  -3.796
   29    HB3  TYR   4           3HB      TYR   4  -4.114   4.580  -4.577
   30    HD1  TYR   4           HD2      TYR   4  -7.402   5.379  -6.130
   31    HD2  TYR   4           HD1      TYR   4  -3.451   6.707  -5.275
   32    HE1  TYR   4           HE2      TYR   4  -7.771   7.363  -7.536
   33    HE2  TYR   4           HE1      TYR   4  -3.809   8.695  -6.678
   34    HH   TYR   4           HH       TYR   4  -5.623  10.028  -7.553
   35    H    GLY   5           H        GLY   5  -7.035   2.610  -7.378
   36    HA2  GLY   5           2HA      GLY   5  -6.674   2.439  -9.641
   37    HA3  GLY   5           3HA      GLY   5  -5.376   3.608  -9.446
   38    H    TRP   6           H        TRP   6  -5.219   0.737  -7.555
   39    HA   TRP   6           HA       TRP   6  -3.551  -0.652  -9.495
   40    HB2  TRP   6           2HB      TRP   6  -2.508   0.196  -6.782
   41    HB3  TRP   6           3HB      TRP   6  -1.673  -0.870  -7.909
   42    HD1  TRP   6           HD1      TRP   6  -1.786   2.641  -6.913
   43    HE1  TRP   6           HE1      TRP   6  -0.661   4.145  -8.673
   44    HE3  TRP   6           HE3      TRP   6  -1.532  -0.690 -10.783
   45    HZ2  TRP   6           HZ2      TRP   6   0.217   3.946 -11.348
   46    HZ3  TRP   6           HZ3      TRP   6  -0.536   0.046 -12.909
   47    HH2  TRP   6           HH2      TRP   6   0.320   2.317 -13.184
   48    H    GLN   7           H        GLN   7  -5.064  -2.308  -9.473
   49    HA   GLN   7           HA       GLN   7  -5.111  -3.895  -6.996
   50    HB2  GLN   7           2HB      GLN   7  -7.406  -4.425  -7.273
   51    HB3  GLN   7           3HB      GLN   7  -7.282  -2.681  -7.460
   52    HG2  GLN   7           2HG      GLN   7  -7.392  -2.910  -9.873
   53    HG3  GLN   7           3HG      GLN   7  -7.453  -4.665  -9.717
   54   HE21  GLN   7          1HE2      GLN   7  -9.422  -5.157 -10.438
   55   HE22  GLN   7          2HE2      GLN   7 -10.900  -4.513  -9.816
   56    H    GLY   8           H        GLY   8  -6.361  -6.133  -7.808
   57    HA2  GLY   8           2HA      GLY   8  -6.339  -7.875  -9.418
   58    HA3  GLY   8           3HA      GLY   8  -5.067  -7.025 -10.283
   59    H    LEU   9           H        LEU   9  -4.002  -9.115 -10.351
   60    HA   LEU   9           HA       LEU   9  -3.187 -10.519  -8.060
   61    HB2  LEU   9           2HB      LEU   9  -3.133 -11.514 -10.265
   62    HB3  LEU   9           3HB      LEU   9  -1.923 -10.346 -10.791
   63    HG   LEU   9           HG       LEU   9  -0.314 -11.338  -9.208
   64   HD11  LEU   9          1HD1      LEU   9  -2.522 -13.329  -8.712
   65   HD12  LEU   9          2HD1      LEU   9  -1.845 -12.194  -7.545
   66   HD13  LEU   9          3HD1      LEU   9  -0.851 -13.507  -8.176
   67   HD21  LEU   9          3HD2      LEU   9  -1.498 -13.463 -10.979
   68   HD22  LEU   9          1HD2      LEU   9   0.189 -13.248 -10.512
   69   HD23  LEU   9          2HD2      LEU   9  -0.578 -12.092 -11.601
   70    H    TYR  10           H        TYR  10  -1.909  -7.692  -9.632
   71    HA   TYR  10           HA       TYR  10  -0.045  -7.320  -7.434
   72    HB2  TYR  10           2HB      TYR  10   0.809  -7.588 -10.311
   73    HB3  TYR  10           3HB      TYR  10   1.777  -6.708  -9.133
   74    HD1  TYR  10           HD2      TYR  10   2.125  -8.109  -6.847
   75    HD2  TYR  10           HD1      TYR  10   1.400  -9.778 -10.693
   76    HE1  TYR  10           HE2      TYR  10   3.167 -10.216  -6.123
   77    HE2  TYR  10           HE1      TYR  10   2.439 -11.890  -9.979
   78    HH   TYR  10           HH       TYR  10   3.797 -12.822  -8.370
   79    H    CYS  11           H        CYS  11   1.163  -5.128  -7.821
   80    HA   CYS  11           HA       CYS  11  -0.921  -3.172  -8.398
   81    HB2  CYS  11           2HB      CYS  11   1.829  -2.650  -7.264
   82    HB3  CYS  11           3HB      CYS  11   0.418  -1.599  -7.187
   83    H    ASP  12           H        ASP  12  -0.095  -4.321 -10.706
   84    HA   ASP  12           HA       ASP  12   1.659  -2.293 -11.928
   85    HB2  ASP  12           2HB      ASP  12   1.311  -5.221 -12.470
   86    HB3  ASP  12           3HB      ASP  12   1.846  -4.151 -13.763
   87    H    LYS  13           H        LYS  13  -1.415  -3.885 -12.019
   88    HA   LYS  13           HA       LYS  13  -2.129  -2.727 -14.591
   89    HB2  LYS  13           2HB      LYS  13  -3.700  -4.433 -12.652
   90    HB3  LYS  13           3HB      LYS  13  -4.309  -3.875 -14.205
   91    HG2  LYS  13           2HG      LYS  13  -3.567  -5.857 -14.934
   92    HG3  LYS  13           3HG      LYS  13  -1.998  -5.048 -14.971
   93    HD2  LYS  13           2HD      LYS  13  -1.209  -6.229 -13.220
   94    HD3  LYS  13           3HD      LYS  13  -2.753  -6.186 -12.366
   95    HE2  LYS  13           2HE      LYS  13  -2.112  -7.961 -14.720
   96    HE3  LYS  13           3HE      LYS  13  -2.088  -8.468 -13.031
   97    HZ1  LYS  13           3HZ      LYS  13  -4.383  -7.820 -14.743
   98    HZ2  LYS  13           1HZ      LYS  13  -4.511  -7.558 -13.076
   99    HZ3  LYS  13           2HZ      LYS  13  -4.175  -9.107 -13.665
  100    H    CYS  14           H        CYS  14  -3.531  -1.054 -14.902
  101    HA   CYS  14           HA       CYS  14  -4.310   0.440 -12.491
  102    HB2  CYS  14           2HB      CYS  14  -4.231   2.441 -13.796
  103    HB3  CYS  14           3HB      CYS  14  -2.756   1.544 -14.139
  104    H    ILE  15           H        ILE  15  -5.775  -1.802 -13.789
  105    HA   ILE  15           HA       ILE  15  -7.891  -2.373 -14.417
  106    HB   ILE  15           HB       ILE  15  -8.958   0.158 -13.254
  107   HG12  ILE  15          2HG1      ILE  15  -7.648  -2.058 -11.666
  108   HG13  ILE  15          3HG1      ILE  15  -7.124  -0.380 -11.750
  109   HG21  ILE  15          1HG2      ILE  15 -10.192  -2.018 -14.139
  110   HG22  ILE  15          2HG2      ILE  15  -9.872  -2.559 -12.492
  111   HG23  ILE  15          3HG2      ILE  15 -10.802  -1.087 -12.772
  112   HD11  ILE  15          3HD1      ILE  15  -8.225  -0.559  -9.708
  113   HD12  ILE  15          1HD1      ILE  15  -9.409   0.194 -10.776
  114   HD13  ILE  15          2HD1      ILE  15  -9.534  -1.523 -10.393
  115    HA   PRO  16           HA       PRO  16  -7.847   0.474 -18.066
  116    HB2  PRO  16           2HB      PRO  16  -7.851  -1.523 -19.904
  117    HB3  PRO  16           3HB      PRO  16  -6.370  -0.892 -19.174
  118    HG2  PRO  16           2HG      PRO  16  -7.924  -3.355 -18.479
  119    HG3  PRO  16           3HG      PRO  16  -6.169  -3.142 -18.619
  120    HD2  PRO  16           2HD      PRO  16  -7.447  -3.169 -16.233
  121    HD3  PRO  16           3HD      PRO  16  -5.990  -2.198 -16.524
  122    H    HIS  17           H        HIS  17  -9.809  -2.223 -17.064
  123    HA   HIS  17           HA       HIS  17 -11.832  -2.280 -18.916
  124    HB2  HIS  17           2HB      HIS  17 -11.570  -2.953 -16.079
  125    HB3  HIS  17           3HB      HIS  17 -13.215  -2.525 -16.542
  126    HD1  HIS  17           HD1      HIS  17 -14.048  -4.944 -16.271
  127    HD2  HIS  17           HD2      HIS  17 -11.001  -4.515 -19.063
  128    HE1  HIS  17           HE1      HIS  17 -13.983  -7.117 -17.535
  129    HA   PRO  18           HA       PRO  18 -14.214   1.257 -16.677
  130    HB2  PRO  18           2HB      PRO  18 -12.958   2.546 -14.645
  131    HB3  PRO  18           3HB      PRO  18 -13.944   1.100 -14.401
  132    HG2  PRO  18           2HG      PRO  18 -10.968   1.351 -14.605
  133    HG3  PRO  18           3HG      PRO  18 -11.935   0.380 -13.478
  134    HD2  PRO  18           2HD      PRO  18 -10.748  -0.682 -15.668
  135    HD3  PRO  18           3HD      PRO  18 -12.284  -1.294 -15.023
  136    H    GLY  19           H        GLY  19 -13.500   2.038 -18.807
  137    HA2  GLY  19           2HA      GLY  19 -13.100   4.385 -19.508
  138    HA3  GLY  19           3HA      GLY  19 -11.628   4.312 -18.550
  139    H    CYS  20           H        CYS  20 -12.465   1.480 -20.299
  140    HA   CYS  20           HA       CYS  20 -11.313   2.050 -22.794
  141    HB2  CYS  20           2HB      CYS  20  -9.409   1.693 -20.695
  142    HB3  CYS  20           3HB      CYS  20  -9.302   0.311 -21.780
  143    H    VAL  21           H        VAL  21 -10.293  -0.260 -23.645
  144    HA   VAL  21           HA       VAL  21 -12.222  -2.336 -22.843
  145    HB   VAL  21           HB       VAL  21 -11.356  -1.831 -25.690
  146   HG11  VAL  21          1HG1      VAL  21 -12.198  -4.144 -24.704
  147   HG12  VAL  21          2HG1      VAL  21 -13.773  -3.389 -24.955
  148   HG13  VAL  21          3HG1      VAL  21 -12.663  -3.589 -26.312
  149   HG21  VAL  21          3HG2      VAL  21 -13.425  -0.560 -24.088
  150   HG22  VAL  21          1HG2      VAL  21 -12.785  -0.115 -25.670
  151   HG23  VAL  21          2HG2      VAL  21 -14.064  -1.323 -25.544
  152    H    HIS  22           H        HIS  22  -9.250  -1.771 -24.728
  153    HA   HIS  22           HA       HIS  22  -8.030  -4.077 -23.419
  154    HB2  HIS  22           2HB      HIS  22  -8.000  -3.769 -26.426
  155    HB3  HIS  22           3HB      HIS  22  -7.297  -5.084 -25.489
  156    HD1  HIS  22           HD1      HIS  22  -9.280  -6.362 -23.942
  157    HD2  HIS  22           HD2      HIS  22 -10.395  -4.447 -27.457
  158    HE1  HIS  22           HE1      HIS  22 -11.497  -7.363 -24.579
  159    H    GLY  23           H        GLY  23  -5.642  -4.246 -24.152
  160    HA2  GLY  23           2HA      GLY  23  -3.735  -2.999 -25.027
  161    HA3  GLY  23           3HA      GLY  23  -4.555  -1.526 -24.530
  162    H    ILE  24           H        ILE  24  -2.488  -1.068 -23.469
  163    HA   ILE  24           HA       ILE  24  -2.379  -2.332 -20.810
  164    HB   ILE  24           HB       ILE  24   0.057  -2.023 -20.791
  165   HG12  ILE  24          2HG1      ILE  24   0.306  -1.687 -23.693
  166   HG13  ILE  24          3HG1      ILE  24  -0.377  -0.283 -22.881
  167   HG21  ILE  24          1HG2      ILE  24  -0.376  -3.567 -23.281
  168   HG22  ILE  24          2HG2      ILE  24   0.476  -4.012 -21.803
  169   HG23  ILE  24          3HG2      ILE  24  -1.286  -4.061 -21.853
  170   HD11  ILE  24          3HD1      ILE  24   2.323  -1.038 -23.089
  171   HD12  ILE  24          1HD1      ILE  24   1.636   0.334 -22.220
  172   HD13  ILE  24          2HD1      ILE  24   1.868  -1.207 -21.394
  173    H    CYS  25           H        CYS  25  -0.708  -0.822 -19.454
  174    HA   CYS  25           HA       CYS  25  -0.924   1.977 -19.915
  175    HB2  CYS  25           2HB      CYS  25  -2.463   2.598 -18.189
  176    HB3  CYS  25           3HB      CYS  25  -3.267   1.402 -19.200
  177    H    ASN  26           H        ASN  26   0.229   3.218 -18.380
  178    HA   ASN  26           HA       ASN  26   1.869   1.605 -16.538
  179    HB2  ASN  26           2HB      ASN  26   3.744   2.934 -17.012
  180    HB3  ASN  26           3HB      ASN  26   2.983   2.716 -18.585
  181   HD21  ASN  26          1HD2      ASN  26   4.057   4.930 -16.266
  182   HD22  ASN  26          2HD2      ASN  26   3.482   6.373 -17.023
  183    H    GLU  27           H        GLU  27  -0.130   4.405 -16.941
  184    HA   GLU  27           HA       GLU  27   0.411   5.220 -14.165
  185    HB2  GLU  27           2HB      GLU  27  -0.193   6.698 -16.625
  186    HB3  GLU  27           3HB      GLU  27  -1.146   7.213 -15.240
  187    HG2  GLU  27           2HG      GLU  27   0.805   7.738 -13.990
  188    HG3  GLU  27           3HG      GLU  27   1.850   6.978 -15.189
  189    HA   PRO  28           HA       PRO  28  -3.594   4.058 -12.806
  190    HB2  PRO  28           2HB      PRO  28  -4.265   6.097 -11.144
  191    HB3  PRO  28           3HB      PRO  28  -3.033   4.894 -10.741
  192    HG2  PRO  28           2HG      PRO  28  -2.693   7.669 -11.812
  193    HG3  PRO  28           3HG      PRO  28  -1.781   6.843 -10.536
  194    HD2  PRO  28           2HD      PRO  28  -0.849   7.090 -13.066
  195    HD3  PRO  28           3HD      PRO  28  -0.474   5.688 -12.044
  196    H    TRP  29           H        TRP  29  -5.469   4.077 -13.860
  197    HA   TRP  29           HA       TRP  29  -7.302   4.768 -15.016
  198    HB2  TRP  29           2HB      TRP  29  -6.735   7.547 -13.982
  199    HB3  TRP  29           3HB      TRP  29  -8.287   6.871 -14.470
  200    HD1  TRP  29           HD1      TRP  29  -6.908   7.958 -11.461
  201    HE1  TRP  29           HE1      TRP  29  -7.643   6.576  -9.418
  202    HE3  TRP  29           HE3      TRP  29  -8.617   3.788 -13.874
  203    HZ2  TRP  29           HZ2      TRP  29  -8.795   4.052  -8.898
  204    HZ3  TRP  29           HZ3      TRP  29  -9.520   1.935 -12.531
  205    HH2  TRP  29           HH2      TRP  29  -9.605   2.066 -10.094
  206    H    GLN  30           H        GLN  30  -5.445   4.378 -16.717
  207    HA   GLN  30           HA       GLN  30  -5.663   6.580 -18.607
  208    HB2  GLN  30           2HB      GLN  30  -3.128   5.671 -17.361
  209    HB3  GLN  30           3HB      GLN  30  -3.091   5.978 -19.092
  210    HG2  GLN  30           2HG      GLN  30  -4.302   8.213 -18.327
  211    HG3  GLN  30           3HG      GLN  30  -3.433   7.859 -16.835
  212   HE21  GLN  30          1HE2      GLN  30  -2.817   7.814 -20.333
  213   HE22  GLN  30          2HE2      GLN  30  -1.274   8.585 -20.243
  214    H    CYS  31           H        CYS  31  -4.513   5.844 -20.754
  215    HA   CYS  31           HA       CYS  31  -4.909   2.971 -21.183
  216    HB2  CYS  31           2HB      CYS  31  -6.225   5.195 -22.745
  217    HB3  CYS  31           3HB      CYS  31  -6.093   3.547 -23.349
  218    H    LEU  32           H        LEU  32  -3.550   2.060 -22.658
  219    HA   LEU  32           HA       LEU  32  -1.888   3.805 -24.315
  220    HB2  LEU  32           2HB      LEU  32  -0.791   1.697 -22.460
  221    HB3  LEU  32           3HB      LEU  32   0.145   2.605 -23.646
  222    HG   LEU  32           HG       LEU  32  -1.212   3.740 -21.201
  223   HD11  LEU  32          1HD1      LEU  32   0.950   4.005 -20.283
  224   HD12  LEU  32          2HD1      LEU  32   1.729   3.555 -21.799
  225   HD13  LEU  32          3HD1      LEU  32   0.858   2.342 -20.862
  226   HD21  LEU  32          3HD2      LEU  32   0.675   5.509 -22.355
  227   HD22  LEU  32          1HD2      LEU  32  -1.064   5.732 -22.163
  228   HD23  LEU  32          2HD2      LEU  32  -0.427   4.991 -23.631
  229    H    CYS  33           H        CYS  33  -2.476   3.090 -26.272
  230    HA   CYS  33           HA       CYS  33  -2.143   0.221 -26.822
  231    HB2  CYS  33           2HB      CYS  33  -4.080   0.268 -28.316
  232    HB3  CYS  33           3HB      CYS  33  -4.548   0.717 -26.679
  233    H    GLU  34           H        GLU  34  -2.124  -0.121 -29.312
  234    HA   GLU  34           HA       GLU  34   0.046   1.437 -30.332
  235    HB2  GLU  34           2HB      GLU  34  -1.300  -1.043 -31.003
  236    HB3  GLU  34           3HB      GLU  34  -0.966  -0.088 -32.441
  237    HG2  GLU  34           2HG      GLU  34   1.410   0.106 -31.593
  238    HG3  GLU  34           3HG      GLU  34   0.985  -1.139 -30.420
  239    H    THR  35           H        THR  35  -0.239   1.927 -32.883
  240    HA   THR  35           HA       THR  35  -2.075   4.137 -32.961
  241    HB   THR  35           HB       THR  35  -0.250   3.054 -35.116
  242    HG1  THR  35           HG1      THR  35   0.820   5.174 -34.402
  243   HG21  THR  35          3HG2      THR  35  -2.004   4.338 -36.138
  244   HG22  THR  35          1HG2      THR  35  -0.544   5.326 -36.111
  245   HG23  THR  35          2HG2      THR  35  -1.829   5.619 -34.939
  246    H    ASN  36           H        ASN  36  -1.978   0.886 -34.205
  247    HA   ASN  36           HA       ASN  36  -3.859   1.089 -36.264
  248    HB2  ASN  36           2HB      ASN  36  -2.418  -0.971 -35.010
  249    HB3  ASN  36           3HB      ASN  36  -4.113  -1.419 -34.848
  250   HD21  ASN  36          1HD2      ASN  36  -1.593  -0.566 -37.130
  251   HD22  ASN  36          2HD2      ASN  36  -2.313  -1.333 -38.500
  252    H    TRP  37           H        TRP  37  -4.301   0.386 -32.813
  253    HA   TRP  37           HA       TRP  37  -7.060  -0.049 -32.858
  254    HB2  TRP  37           2HB      TRP  37  -5.305   1.077 -30.667
  255    HB3  TRP  37           3HB      TRP  37  -6.981   0.586 -30.437
  256    HD1  TRP  37           HD1      TRP  37  -3.558  -0.948 -31.364
  257    HE1  TRP  37           HE1      TRP  37  -3.580  -3.428 -30.676
  258    HE3  TRP  37           HE3      TRP  37  -8.428  -1.328 -29.858
  259    HZ2  TRP  37           HZ2      TRP  37  -5.419  -5.298 -29.633
  260    HZ3  TRP  37           HZ3      TRP  37  -9.240  -3.498 -29.029
  261    HH2  TRP  37           HH2      TRP  37  -7.766  -5.440 -28.920
  262    H    GLY  38           H        GLY  38  -5.504   2.914 -31.612
  263    HA2  GLY  38           2HA      GLY  38  -6.040   5.134 -32.063
  264    HA3  GLY  38           3HA      GLY  38  -7.315   4.580 -33.139
  265    H    GLY  39           H        GLY  39  -8.032   6.640 -31.704
  266    HA2  GLY  39           2HA      GLY  39  -9.710   7.360 -30.306
  267    HA3  GLY  39           3HA      GLY  39 -10.181   5.677 -30.118
  268    H    GLN  40           H        GLN  40 -10.620   6.680 -27.902
  269    HA   GLN  40           HA       GLN  40  -8.205   6.788 -26.251
  270    HB2  GLN  40           2HB      GLN  40 -10.420   8.375 -26.242
  271    HB3  GLN  40           3HB      GLN  40 -10.820   7.229 -24.969
  272    HG2  GLN  40           2HG      GLN  40  -8.450   7.764 -24.081
  273    HG3  GLN  40           3HG      GLN  40  -8.576   9.193 -25.105
  274   HE21  GLN  40          1HE2      GLN  40 -10.616   7.406 -22.811
  275   HE22  GLN  40          2HE2      GLN  40 -11.177   8.801 -21.962
  276    H    LEU  41           H        LEU  41 -11.161   4.958 -26.718
  277    HA   LEU  41           HA       LEU  41 -10.779   3.301 -24.405
  278    HB2  LEU  41           2HB      LEU  41 -12.495   2.562 -26.742
  279    HB3  LEU  41           3HB      LEU  41 -12.728   2.196 -25.034
  280    HG   LEU  41           HG       LEU  41 -13.140   4.865 -26.380
  281   HD11  LEU  41          1HD1      LEU  41 -15.494   4.441 -25.507
  282   HD12  LEU  41          2HD1      LEU  41 -14.992   2.764 -25.299
  283   HD13  LEU  41          3HD1      LEU  41 -14.971   3.497 -26.903
  284   HD21  LEU  41          3HD2      LEU  41 -12.828   4.097 -23.555
  285   HD22  LEU  41          1HD2      LEU  41 -14.214   5.125 -23.919
  286   HD23  LEU  41          2HD2      LEU  41 -12.587   5.656 -24.345
  287    H    CYS  42           H        CYS  42  -9.767   3.247 -27.715
  288    HA   CYS  42           HA       CYS  42  -8.538   1.780 -28.951
  289    HB2  CYS  42           2HB      CYS  42  -7.522   0.988 -26.213
  290    HB3  CYS  42           3HB      CYS  42  -6.740   0.602 -27.742
  291    H    ASP  43           H        ASP  43 -10.670   0.721 -29.370
  292    HA   ASP  43           HA       ASP  43 -10.759  -1.997 -28.237
  293    HB2  ASP  43           2HB      ASP  43 -13.124  -2.045 -28.794
  294    HB3  ASP  43           3HB      ASP  43 -12.776  -0.619 -27.820
  295    H    LYS  44           H        LYS  44 -10.514  -0.111 -31.135
  296    HA   LYS  44           HA       LYS  44 -11.151  -2.112 -33.020
  297    HB2  LYS  44           2HB      LYS  44  -9.635   0.468 -33.112
  298    HB3  LYS  44           3HB      LYS  44  -9.563  -0.620 -34.492
  299    HG2  LYS  44           2HG      LYS  44 -11.397   0.418 -35.201
  300    HG3  LYS  44           3HG      LYS  44 -12.252  -0.500 -33.959
  301    HD2  LYS  44           2HD      LYS  44 -12.359   1.293 -32.518
  302    HD3  LYS  44           3HD      LYS  44 -10.939   2.075 -33.217
  303    HE2  LYS  44           2HE      LYS  44 -12.536   2.188 -35.340
  304    HE3  LYS  44           3HE      LYS  44 -13.777   2.137 -34.089
  305    HZ1  LYS  44           3HZ      LYS  44 -13.238   4.404 -34.574
  306    HZ2  LYS  44           1HZ      LYS  44 -11.587   4.126 -34.329
  307    HZ3  LYS  44           2HZ      LYS  44 -12.660   4.042 -33.025
  Start of MODEL   12
    1    H1   ARG   1           H        ARG   1  -0.070  -1.282  -0.588
    2    HA   ARG   1           HA       ARG   1  -2.076   0.281  -0.215
    3    HB2  ARG   1           2HB      ARG   1  -0.407   1.993  -2.057
    4    HB3  ARG   1           3HB      ARG   1  -1.949   2.400  -1.316
    5    HG2  ARG   1           2HG      ARG   1  -0.785   2.242   0.914
    6    HG3  ARG   1           3HG      ARG   1   0.731   2.151   0.016
    7    HD2  ARG   1           2HD      ARG   1   0.611   4.406   0.386
    8    HD3  ARG   1           3HD      ARG   1  -0.220   4.297  -1.166
    9    HE   ARG   1           HE       ARG   1  -2.106   5.047  -0.134
   10   HH11  ARG   1          1HH1      ARG   1   0.010   3.698   2.279
   11   HH12  ARG   1          2HH1      ARG   1  -1.001   4.155   3.609
   12   HH21  ARG   1          1HH2      ARG   1  -3.446   5.655   1.609
   13   HH22  ARG   1          2HH2      ARG   1  -2.967   5.268   3.227
   14    H    CYS   2           H        CYS   2  -1.854  -2.040  -1.445
   15    HA   CYS   2           HA       CYS   2  -2.075  -1.773  -4.315
   16    HB2  CYS   2           2HB      CYS   2  -2.128  -4.052  -2.376
   17    HB3  CYS   2           3HB      CYS   2  -2.776  -4.292  -3.995
   18    H    GLN   3           H        GLN   3  -3.905  -0.206  -4.043
   19    HA   GLN   3           HA       GLN   3  -6.377  -1.564  -4.550
   20    HB2  GLN   3           2HB      GLN   3  -6.122  -1.322  -1.974
   21    HB3  GLN   3           3HB      GLN   3  -6.480   0.376  -2.262
   22    HG2  GLN   3           2HG      GLN   3  -8.639  -0.056  -2.948
   23    HG3  GLN   3           3HG      GLN   3  -8.281  -1.732  -3.364
   24   HE21  GLN   3          1HE2      GLN   3 -10.230  -0.256  -1.505
   25   HE22  GLN   3          2HE2      GLN   3 -10.126  -1.151  -0.031
   26    H    TYR   4           H        TYR   4  -4.739   1.494  -3.888
   27    HA   TYR   4           HA       TYR   4  -6.659   2.981  -5.479
   28    HB2  TYR   4           2HB      TYR   4  -5.806   4.059  -3.489
   29    HB3  TYR   4           3HB      TYR   4  -4.146   3.833  -4.028
   30    HD1  TYR   4           HD1      TYR   4  -7.086   5.028  -5.973
   31    HD2  TYR   4           HD2      TYR   4  -3.320   6.004  -4.253
   32    HE1  TYR   4           HE1      TYR   4  -7.154   7.221  -7.085
   33    HE2  TYR   4           HE2      TYR   4  -3.377   8.200  -5.358
   34    HH   TYR   4           HH       TYR   4  -6.213   9.373  -6.971
   35    H    GLY   5           H        GLY   5  -6.416   2.231  -7.571
   36    HA2  GLY   5           2HA      GLY   5  -5.543   2.720  -9.703
   37    HA3  GLY   5           3HA      GLY   5  -4.040   3.227  -8.946
   38    H    TRP   6           H        TRP   6  -4.234   0.622  -7.323
   39    HA   TRP   6           HA       TRP   6  -3.420  -1.235  -9.452
   40    HB2  TRP   6           2HB      TRP   6  -1.938  -0.966  -6.834
   41    HB3  TRP   6           3HB      TRP   6  -1.471  -1.914  -8.244
   42    HD1  TRP   6           HD1      TRP   6  -0.863   1.354  -6.647
   43    HE1  TRP   6           HE1      TRP   6   0.425   2.916  -8.237
   44    HE3  TRP   6           HE3      TRP   6  -1.399  -1.289 -10.990
   45    HZ2  TRP   6           HZ2      TRP   6   1.121   3.014 -10.971
   46    HZ3  TRP   6           HZ3      TRP   6  -0.392  -0.392 -13.049
   47    HH2  TRP   6           HH2      TRP   6   0.841   1.716 -13.037
   48    H    GLN   7           H        GLN   7  -4.229  -3.235  -9.261
   49    HA   GLN   7           HA       GLN   7  -6.126  -3.800  -7.209
   50    HB2  GLN   7           2HB      GLN   7  -5.229  -5.034  -9.706
   51    HB3  GLN   7           3HB      GLN   7  -5.654  -6.207  -8.467
   52    HG2  GLN   7           2HG      GLN   7  -7.822  -4.906  -8.204
   53    HG3  GLN   7           3HG      GLN   7  -7.385  -4.097  -9.708
   54   HE21  GLN   7          1HE2      GLN   7  -6.865  -5.573 -11.544
   55   HE22  GLN   7          2HE2      GLN   7  -7.837  -6.989 -11.724
   56    H    GLY   8           H        GLY   8  -5.960  -6.241  -6.323
   57    HA2  GLY   8           2HA      GLY   8  -3.474  -6.253  -4.758
   58    HA3  GLY   8           3HA      GLY   8  -4.977  -7.041  -4.302
   59    H    LEU   9           H        LEU   9  -5.331  -8.198  -6.991
   60    HA   LEU   9           HA       LEU   9  -4.250 -10.705  -6.590
   61    HB2  LEU   9           2HB      LEU   9  -6.004  -9.727  -8.324
   62    HB3  LEU   9           3HB      LEU   9  -4.602  -9.778  -9.390
   63    HG   LEU   9           HG       LEU   9  -4.393 -12.222  -8.823
   64   HD11  LEU   9          1HD1      LEU   9  -5.731 -12.106  -6.740
   65   HD12  LEU   9          2HD1      LEU   9  -6.275 -13.358  -7.857
   66   HD13  LEU   9          3HD1      LEU   9  -7.173 -11.846  -7.722
   67   HD21  LEU   9          3HD2      LEU   9  -6.561 -10.953 -10.389
   68   HD22  LEU   9          1HD2      LEU   9  -6.677 -12.692 -10.122
   69   HD23  LEU   9          2HD2      LEU   9  -5.252 -12.014 -10.911
   70    H    TYR  10           H        TYR  10  -3.087  -8.329  -8.988
   71    HA   TYR  10           HA       TYR  10  -0.420  -9.565  -8.761
   72    HB2  TYR  10           2HB      TYR  10  -1.930  -8.509 -11.118
   73    HB3  TYR  10           3HB      TYR  10  -0.172  -8.425 -11.124
   74    HD1  TYR  10           HD1      TYR  10  -3.079 -10.657 -11.188
   75    HD2  TYR  10           HD2      TYR  10   1.169 -10.439 -11.268
   76    HE1  TYR  10           HE1      TYR  10  -2.979 -12.999 -11.936
   77    HE2  TYR  10           HE2      TYR  10   1.281 -12.779 -12.017
   78    HH   TYR  10           HH       TYR  10  -0.080 -14.794 -11.968
   79    H    CYS  11           H        CYS  11  -2.273  -6.620  -8.775
   80    HA   CYS  11           HA       CYS  11  -1.768  -4.474  -8.221
   81    HB2  CYS  11           2HB      CYS  11  -0.618  -5.909  -6.317
   82    HB3  CYS  11           3HB      CYS  11   0.857  -5.296  -7.057
   83    H    ASP  12           H        ASP  12  -0.761  -5.684 -10.740
   84    HA   ASP  12           HA       ASP  12   1.491  -3.853 -11.254
   85    HB2  ASP  12           2HB      ASP  12   1.249  -6.611 -11.776
   86    HB3  ASP  12           3HB      ASP  12   1.130  -5.809 -13.339
   87    H    LYS  13           H        LYS  13  -1.648  -4.961 -12.331
   88    HA   LYS  13           HA       LYS  13  -1.638  -3.267 -14.678
   89    HB2  LYS  13           2HB      LYS  13  -3.751  -5.021 -13.423
   90    HB3  LYS  13           3HB      LYS  13  -4.037  -4.048 -14.860
   91    HG2  LYS  13           2HG      LYS  13  -1.689  -5.499 -15.358
   92    HG3  LYS  13           3HG      LYS  13  -2.829  -6.631 -14.628
   93    HD2  LYS  13           2HD      LYS  13  -3.253  -6.750 -16.935
   94    HD3  LYS  13           3HD      LYS  13  -4.537  -5.723 -16.292
   95    HE2  LYS  13           2HE      LYS  13  -3.922  -4.400 -18.024
   96    HE3  LYS  13           3HE      LYS  13  -2.721  -3.841 -16.861
   97    HZ1  LYS  13           3HZ      LYS  13  -2.175  -4.807 -19.324
   98    HZ2  LYS  13           1HZ      LYS  13  -1.894  -6.160 -18.347
   99    HZ3  LYS  13           2HZ      LYS  13  -1.067  -4.715 -18.049
  100    H    CYS  14           H        CYS  14  -2.873  -1.422 -14.989
  101    HA   CYS  14           HA       CYS  14  -3.614  -0.029 -12.528
  102    HB2  CYS  14           2HB      CYS  14  -3.529   2.003 -13.830
  103    HB3  CYS  14           3HB      CYS  14  -2.075   1.065 -14.156
  104    H    ILE  15           H        ILE  15  -5.264  -2.145 -13.833
  105    HA   ILE  15           HA       ILE  15  -7.436  -2.571 -14.381
  106    HB   ILE  15           HB       ILE  15  -8.296  -0.027 -13.079
  107   HG12  ILE  15          2HG1      ILE  15  -7.061  -2.382 -11.637
  108   HG13  ILE  15          3HG1      ILE  15  -6.436  -0.737 -11.682
  109   HG21  ILE  15          1HG2      ILE  15 -10.192  -1.173 -12.568
  110   HG22  ILE  15          2HG2      ILE  15  -9.697  -2.091 -13.989
  111   HG23  ILE  15          3HG2      ILE  15  -9.347  -2.708 -12.375
  112   HD11  ILE  15          3HD1      ILE  15  -7.571  -0.302  -9.842
  113   HD12  ILE  15          1HD1      ILE  15  -9.072  -0.566 -10.728
  114   HD13  ILE  15          2HD1      ILE  15  -8.303  -1.906  -9.876
  115    HA   PRO  16           HA       PRO  16  -7.387   0.406 -17.926
  116    HB2  PRO  16           2HB      PRO  16  -7.584  -1.517 -19.832
  117    HB3  PRO  16           3HB      PRO  16  -6.039  -0.996 -19.148
  118    HG2  PRO  16           2HG      PRO  16  -7.698  -3.395 -18.471
  119    HG3  PRO  16           3HG      PRO  16  -5.942  -3.272 -18.683
  120    HD2  PRO  16           2HD      PRO  16  -7.114  -3.321 -16.243
  121    HD3  PRO  16           3HD      PRO  16  -5.618  -2.421 -16.566
  122    H    HIS  17           H        HIS  17  -9.454  -2.213 -16.929
  123    HA   HIS  17           HA       HIS  17 -11.554  -2.094 -18.688
  124    HB2  HIS  17           2HB      HIS  17 -11.200  -2.893 -15.900
  125    HB3  HIS  17           3HB      HIS  17 -12.833  -2.333 -16.247
  126    HD1  HIS  17           HD1      HIS  17 -13.985  -4.580 -16.192
  127    HD2  HIS  17           HD2      HIS  17 -10.751  -4.480 -18.799
  128    HE1  HIS  17           HE1      HIS  17 -14.107  -6.726 -17.498
  129    HA   PRO  18           HA       PRO  18 -13.633   1.491 -16.232
  130    HB2  PRO  18           2HB      PRO  18 -12.220   2.637 -14.218
  131    HB3  PRO  18           3HB      PRO  18 -13.276   1.240 -13.976
  132    HG2  PRO  18           2HG      PRO  18 -10.302   1.332 -14.305
  133    HG3  PRO  18           3HG      PRO  18 -11.273   0.379 -13.168
  134    HD2  PRO  18           2HD      PRO  18 -10.243  -0.672 -15.441
  135    HD3  PRO  18           3HD      PRO  18 -11.783  -1.219 -14.749
  136    H    GLY  19           H        GLY  19 -12.967   2.305 -18.365
  137    HA2  GLY  19           2HA      GLY  19 -12.470   4.629 -19.040
  138    HA3  GLY  19           3HA      GLY  19 -10.987   4.485 -18.107
  139    H    CYS  20           H        CYS  20 -11.927   1.705 -19.873
  140    HA   CYS  20           HA       CYS  20 -10.860   2.248 -22.396
  141    HB2  CYS  20           2HB      CYS  20  -8.843   2.158 -20.486
  142    HB3  CYS  20           3HB      CYS  20  -8.806   0.555 -21.213
  143    H    VAL  21           H        VAL  21  -9.749  -0.104 -23.169
  144    HA   VAL  21           HA       VAL  21 -11.592  -2.205 -22.263
  145    HB   VAL  21           HB       VAL  21 -11.005  -1.678 -25.177
  146   HG11  VAL  21          1HG1      VAL  21 -11.683  -4.016 -24.100
  147   HG12  VAL  21          2HG1      VAL  21 -13.296  -3.314 -24.250
  148   HG13  VAL  21          3HG1      VAL  21 -12.275  -3.495 -25.677
  149   HG21  VAL  21          3HG2      VAL  21 -12.347   0.144 -24.377
  150   HG22  VAL  21          1HG2      VAL  21 -13.384  -0.948 -25.294
  151   HG23  VAL  21          2HG2      VAL  21 -13.429  -0.962 -23.531
  152    H    HIS  22           H        HIS  22  -8.766  -1.480 -24.299
  153    HA   HIS  22           HA       HIS  22  -7.445  -3.851 -23.206
  154    HB2  HIS  22           2HB      HIS  22  -7.402  -3.242 -26.163
  155    HB3  HIS  22           3HB      HIS  22  -6.750  -4.662 -25.349
  156    HD1  HIS  22           HD1      HIS  22  -8.866  -5.941 -23.900
  157    HD2  HIS  22           HD2      HIS  22  -9.718  -3.852 -27.389
  158    HE1  HIS  22           HE1      HIS  22 -11.073  -6.843 -24.702
  159    H    GLY  23           H        GLY  23  -5.092  -3.815 -24.498
  160    HA2  GLY  23           2HA      GLY  23  -3.235  -2.459 -25.086
  161    HA3  GLY  23           3HA      GLY  23  -4.080  -1.064 -24.432
  162    H    ILE  24           H        ILE  24  -1.667  -1.020 -23.627
  163    HA   ILE  24           HA       ILE  24  -1.558  -2.382 -21.016
  164    HB   ILE  24           HB       ILE  24   0.899  -1.963 -21.099
  165   HG12  ILE  24          2HG1      ILE  24   0.747  -1.538 -24.038
  166   HG13  ILE  24          3HG1      ILE  24   0.392  -0.154 -23.011
  167   HG21  ILE  24          1HG2      ILE  24  -0.612  -3.936 -22.362
  168   HG22  ILE  24          2HG2      ILE  24   0.651  -3.513 -23.516
  169   HG23  ILE  24          3HG2      ILE  24   1.084  -4.033 -21.888
  170   HD11  ILE  24          3HD1      ILE  24   2.922  -1.780 -23.030
  171   HD12  ILE  24          1HD1      ILE  24   2.711  -0.133 -23.625
  172   HD13  ILE  24          2HD1      ILE  24   2.571  -0.473 -21.900
  173    H    CYS  25           H        CYS  25   0.139  -1.014 -19.575
  174    HA   CYS  25           HA       CYS  25  -0.004   1.807 -19.748
  175    HB2  CYS  25           2HB      CYS  25  -1.576   2.329 -18.023
  176    HB3  CYS  25           3HB      CYS  25  -2.390   1.256 -19.156
  177    H    ASN  26           H        ASN  26   1.145   2.853 -18.072
  178    HA   ASN  26           HA       ASN  26   2.662   1.013 -16.341
  179    HB2  ASN  26           2HB      ASN  26   4.513   2.666 -16.460
  180    HB3  ASN  26           3HB      ASN  26   4.106   1.983 -18.032
  181   HD21  ASN  26          1HD2      ASN  26   4.387   4.807 -16.161
  182   HD22  ASN  26          2HD2      ASN  26   3.854   5.935 -17.356
  183    H    GLU  27           H        GLU  27   0.784   3.915 -16.539
  184    HA   GLU  27           HA       GLU  27   1.279   4.469 -13.693
  185    HB2  GLU  27           2HB      GLU  27   0.682   6.163 -16.030
  186    HB3  GLU  27           3HB      GLU  27  -0.185   6.594 -14.563
  187    HG2  GLU  27           2HG      GLU  27   1.881   6.857 -13.360
  188    HG3  GLU  27           3HG      GLU  27   2.802   6.282 -14.748
  189    HA   PRO  28           HA       PRO  28  -2.772   3.288 -12.498
  190    HB2  PRO  28           2HB      PRO  28  -3.429   5.196 -10.682
  191    HB3  PRO  28           3HB      PRO  28  -2.229   3.937 -10.362
  192    HG2  PRO  28           2HG      PRO  28  -1.813   6.783 -11.192
  193    HG3  PRO  28           3HG      PRO  28  -0.940   5.834  -9.975
  194    HD2  PRO  28           2HD      PRO  28   0.040   6.270 -12.462
  195    HD3  PRO  28           3HD      PRO  28   0.368   4.780 -11.554
  196    H    TRP  29           H        TRP  29  -4.812   3.512 -13.225
  197    HA   TRP  29           HA       TRP  29  -6.582   4.324 -14.402
  198    HB2  TRP  29           2HB      TRP  29  -5.832   7.015 -13.254
  199    HB3  TRP  29           3HB      TRP  29  -7.429   6.463 -13.751
  200    HD1  TRP  29           HD1      TRP  29  -5.930   7.298 -10.712
  201    HE1  TRP  29           HE1      TRP  29  -6.733   5.866  -8.730
  202    HE3  TRP  29           HE3      TRP  29  -7.971   3.393 -13.305
  203    HZ2  TRP  29           HZ2      TRP  29  -8.055   3.406  -8.320
  204    HZ3  TRP  29           HZ3      TRP  29  -8.985   1.540 -12.043
  205    HH2  TRP  29           HH2      TRP  29  -9.024   1.548  -9.602
  206    H    GLN  30           H        GLN  30  -4.921   3.894 -16.222
  207    HA   GLN  30           HA       GLN  30  -5.085   6.133 -18.032
  208    HB2  GLN  30           2HB      GLN  30  -2.572   5.405 -16.712
  209    HB3  GLN  30           3HB      GLN  30  -2.456   5.460 -18.465
  210    HG2  GLN  30           2HG      GLN  30  -3.780   7.760 -17.995
  211    HG3  GLN  30           3HG      GLN  30  -2.822   7.632 -16.521
  212   HE21  GLN  30          1HE2      GLN  30  -2.581   9.590 -18.606
  213   HE22  GLN  30          2HE2      GLN  30  -0.986   9.445 -19.252
  214    H    CYS  31           H        CYS  31  -3.970   5.463 -20.201
  215    HA   CYS  31           HA       CYS  31  -4.059   2.597 -20.682
  216    HB2  CYS  31           2HB      CYS  31  -6.389   3.928 -21.010
  217    HB3  CYS  31           3HB      CYS  31  -5.678   4.164 -22.604
  218    H    LEU  32           H        LEU  32  -2.927   1.954 -22.500
  219    HA   LEU  32           HA       LEU  32  -1.814   4.005 -24.253
  220    HB2  LEU  32           2HB      LEU  32  -0.085   2.010 -22.798
  221    HB3  LEU  32           3HB      LEU  32   0.458   3.211 -23.969
  222    HG   LEU  32           HG       LEU  32  -0.749   3.861 -21.281
  223   HD11  LEU  32          1HD1      LEU  32   1.862   4.677 -21.231
  224   HD12  LEU  32          2HD1      LEU  32   1.963   3.133 -22.078
  225   HD13  LEU  32          3HD1      LEU  32   1.231   3.214 -20.475
  226   HD21  LEU  32          3HD2      LEU  32   0.910   5.829 -22.673
  227   HD22  LEU  32          1HD2      LEU  32  -0.633   6.026 -21.842
  228   HD23  LEU  32          2HD2      LEU  32  -0.597   5.438 -23.504
  229    H    CYS  33           H        CYS  33  -2.408   3.316 -26.198
  230    HA   CYS  33           HA       CYS  33  -1.976   0.478 -26.861
  231    HB2  CYS  33           2HB      CYS  33  -3.921   0.771 -28.478
  232    HB3  CYS  33           3HB      CYS  33  -4.332   0.714 -26.767
  233    H    GLU  34           H        GLU  34  -1.758   0.109 -29.245
  234    HA   GLU  34           HA       GLU  34   0.301   1.746 -30.283
  235    HB2  GLU  34           2HB      GLU  34  -0.582  -0.795 -30.777
  236    HB3  GLU  34           3HB      GLU  34  -1.126   0.052 -32.218
  237    HG2  GLU  34           2HG      GLU  34   0.912  -0.384 -33.002
  238    HG3  GLU  34           3HG      GLU  34   1.424   0.964 -31.987
  239    H    THR  35           H        THR  35   0.227   2.709 -32.507
  240    HA   THR  35           HA       THR  35  -1.809   4.690 -32.610
  241    HB   THR  35           HB       THR  35   0.255   3.985 -34.705
  242    HG1  THR  35           HG1      THR  35   0.281   5.683 -32.438
  243   HG21  THR  35          3HG2      THR  35  -1.642   6.287 -34.381
  244   HG22  THR  35          1HG2      THR  35  -1.318   5.311 -35.813
  245   HG23  THR  35          2HG2      THR  35  -0.121   6.479 -35.253
  246    H    ASN  36           H        ASN  36  -1.409   1.573 -34.062
  247    HA   ASN  36           HA       ASN  36  -3.438   2.045 -36.085
  248    HB2  ASN  36           2HB      ASN  36  -1.936  -0.476 -35.344
  249    HB3  ASN  36           3HB      ASN  36  -3.018  -0.305 -36.723
  250   HD21  ASN  36          1HD2      ASN  36  -0.029   0.875 -35.297
  251   HD22  ASN  36          2HD2      ASN  36   0.711   1.345 -36.786
  252    H    TRP  37           H        TRP  37  -4.634   2.565 -33.782
  253    HA   TRP  37           HA       TRP  37  -6.425   0.269 -33.424
  254    HB2  TRP  37           2HB      TRP  37  -4.872   1.694 -31.321
  255    HB3  TRP  37           3HB      TRP  37  -6.523   1.220 -30.932
  256    HD1  TRP  37           HD1      TRP  37  -3.198  -0.388 -32.084
  257    HE1  TRP  37           HE1      TRP  37  -3.152  -2.817 -31.236
  258    HE3  TRP  37           HE3      TRP  37  -7.888  -0.631 -30.065
  259    HZ2  TRP  37           HZ2      TRP  37  -4.877  -4.601 -29.890
  260    HZ3  TRP  37           HZ3      TRP  37  -8.613  -2.735 -29.016
  261    HH2  TRP  37           HH2      TRP  37  -7.137  -4.678 -28.932
  262    H    GLY  38           H        GLY  38  -5.986   3.682 -32.461
  263    HA2  GLY  38           2HA      GLY  38  -7.392   5.485 -32.868
  264    HA3  GLY  38           3HA      GLY  38  -8.490   4.400 -33.707
  265    H    GLY  39           H        GLY  39 -10.120   5.710 -32.546
  266    HA2  GLY  39           2HA      GLY  39 -11.753   5.831 -30.935
  267    HA3  GLY  39           3HA      GLY  39 -11.169   4.279 -30.351
  268    H    GLN  40           H        GLN  40 -12.129   6.257 -28.641
  269    HA   GLN  40           HA       GLN  40  -9.836   7.610 -27.488
  270    HB2  GLN  40           2HB      GLN  40 -12.407   8.349 -27.640
  271    HB3  GLN  40           3HB      GLN  40 -12.446   7.554 -26.072
  272    HG2  GLN  40           2HG      GLN  40 -10.168   9.205 -26.085
  273    HG3  GLN  40           3HG      GLN  40 -11.495  10.154 -26.753
  274   HE21  GLN  40          1HE2      GLN  40 -10.692   8.016 -24.050
  275   HE22  GLN  40          2HE2      GLN  40 -11.666   8.836 -22.883
  276    H    LEU  41           H        LEU  41 -11.711   4.742 -26.981
  277    HA   LEU  41           HA       LEU  41 -10.411   4.280 -24.390
  278    HB2  LEU  41           2HB      LEU  41 -12.596   2.625 -25.621
  279    HB3  LEU  41           3HB      LEU  41 -12.077   2.661 -23.937
  280    HG   LEU  41           HG       LEU  41 -13.515   4.889 -25.379
  281   HD11  LEU  41          1HD1      LEU  41 -15.200   4.154 -23.458
  282   HD12  LEU  41          2HD1      LEU  41 -14.423   2.596 -23.739
  283   HD13  LEU  41          3HD1      LEU  41 -15.226   3.433 -25.068
  284   HD21  LEU  41          3HD2      LEU  41 -13.736   5.829 -23.093
  285   HD22  LEU  41          1HD2      LEU  41 -12.073   5.784 -23.678
  286   HD23  LEU  41          2HD2      LEU  41 -12.631   4.583 -22.513
  287    H    CYS  42           H        CYS  42  -9.123   4.023 -27.052
  288    HA   CYS  42           HA       CYS  42  -7.756   2.608 -28.202
  289    HB2  CYS  42           2HB      CYS  42  -7.636   1.455 -25.418
  290    HB3  CYS  42           3HB      CYS  42  -6.650   0.829 -26.736
  291    H    ASP  43           H        ASP  43 -10.510   2.054 -28.466
  292    HA   ASP  43           HA       ASP  43 -10.645  -0.876 -28.503
  293    HB2  ASP  43           2HB      ASP  43 -13.017  -0.660 -28.716
  294    HB3  ASP  43           3HB      ASP  43 -12.508   0.465 -27.460
  295    H    LYS  44           H        LYS  44 -12.307  -1.456 -30.496
  296    HA   LYS  44           HA       LYS  44 -10.690  -1.344 -32.792
  297    HB2  LYS  44           2HB      LYS  44 -12.721  -2.259 -33.962
  298    HB3  LYS  44           3HB      LYS  44 -12.207  -3.170 -32.548
  299    HG2  LYS  44           2HG      LYS  44 -14.108  -1.164 -31.782
  300    HG3  LYS  44           3HG      LYS  44 -14.753  -2.147 -33.099
  301    HD2  LYS  44           2HD      LYS  44 -13.389  -3.651 -30.971
  302    HD3  LYS  44           3HD      LYS  44 -14.867  -2.825 -30.472
  303    HE2  LYS  44           2HE      LYS  44 -15.447  -5.034 -31.191
  304    HE3  LYS  44           3HE      LYS  44 -16.033  -3.890 -32.398
  305    HZ1  LYS  44           3HZ      LYS  44 -13.420  -5.241 -32.689
  306    HZ2  LYS  44           1HZ      LYS  44 -14.354  -4.484 -33.880
  307    HZ3  LYS  44           2HZ      LYS  44 -14.852  -5.962 -33.226
  Start of MODEL   13
    1    H1   ARG   1           H        ARG   1   4.725   0.486  -2.733
    2    HA   ARG   1           HA       ARG   1   2.884  -0.178  -1.287
    3    HB2  ARG   1           2HB      ARG   1   3.473   2.446  -0.261
    4    HB3  ARG   1           3HB      ARG   1   1.760   2.327  -0.643
    5    HG2  ARG   1           2HG      ARG   1   3.256   0.357   1.072
    6    HG3  ARG   1           3HG      ARG   1   2.322   1.720   1.693
    7    HD2  ARG   1           2HD      ARG   1   0.509   0.439   1.647
    8    HD3  ARG   1           3HD      ARG   1   0.642   0.376  -0.110
    9    HE   ARG   1           HE       ARG   1   2.372  -1.532   1.001
   10   HH11  ARG   1          1HH1      ARG   1  -1.031  -0.906   0.620
   11   HH12  ARG   1          2HH1      ARG   1  -1.472  -2.582   0.623
   12   HH21  ARG   1          1HH2      ARG   1   1.804  -3.741   1.007
   13   HH22  ARG   1          2HH2      ARG   1   0.141  -4.193   0.844
   14    H    CYS   2           H        CYS   2   0.783  -0.328  -2.061
   15    HA   CYS   2           HA       CYS   2  -0.224   1.550  -4.001
   16    HB2  CYS   2           2HB      CYS   2  -0.466  -0.161  -5.802
   17    HB3  CYS   2           3HB      CYS   2   1.207   0.278  -5.470
   18    H    GLN   3           H        GLN   3  -2.404   1.534  -4.058
   19    HA   GLN   3           HA       GLN   3  -3.881  -0.816  -3.195
   20    HB2  GLN   3           2HB      GLN   3  -3.269   1.147  -1.335
   21    HB3  GLN   3           3HB      GLN   3  -4.901   1.557  -1.846
   22    HG2  GLN   3           2HG      GLN   3  -4.587  -1.280  -1.333
   23    HG3  GLN   3           3HG      GLN   3  -4.194  -0.290   0.072
   24   HE21  GLN   3          1HE2      GLN   3  -6.648  -1.692  -1.738
   25   HE22  GLN   3          2HE2      GLN   3  -7.995  -0.902  -0.998
   26    H    TYR   4           H        TYR   4  -4.447   2.671  -3.709
   27    HA   TYR   4           HA       TYR   4  -6.917   2.182  -5.073
   28    HB2  TYR   4           2HB      TYR   4  -5.990   4.301  -3.713
   29    HB3  TYR   4           3HB      TYR   4  -5.569   4.815  -5.343
   30    HD1  TYR   4           HD2      TYR   4  -8.404   3.716  -3.217
   31    HD2  TYR   4           HD1      TYR   4  -7.206   5.687  -6.792
   32    HE1  TYR   4           HE2      TYR   4 -10.718   4.472  -3.569
   33    HE2  TYR   4           HE1      TYR   4  -9.517   6.449  -7.153
   34    HH   TYR   4           HH       TYR   4 -11.798   6.542  -4.883
   35    H    GLY   5           H        GLY   5  -7.344   2.143  -7.221
   36    HA2  GLY   5           2HA      GLY   5  -6.976   2.024  -9.484
   37    HA3  GLY   5           3HA      GLY   5  -5.665   3.168  -9.240
   38    H    TRP   6           H        TRP   6  -5.567   0.196  -7.495
   39    HA   TRP   6           HA       TRP   6  -3.867  -1.085  -9.488
   40    HB2  TRP   6           2HB      TRP   6  -2.924  -0.422  -6.691
   41    HB3  TRP   6           3HB      TRP   6  -2.074  -1.481  -7.813
   42    HD1  TRP   6           HD1      TRP   6  -2.037   1.968  -6.670
   43    HE1  TRP   6           HE1      TRP   6  -0.794   3.497  -8.327
   44    HE3  TRP   6           HE3      TRP   6  -1.874  -1.169 -10.703
   45    HZ2  TRP   6           HZ2      TRP   6   0.131   3.387 -10.992
   46    HZ3  TRP   6           HZ3      TRP   6  -0.792  -0.381 -12.768
   47    HH2  TRP   6           HH2      TRP   6   0.188   1.851 -12.907
   48    H    GLN   7           H        GLN   7  -5.513  -2.645  -9.620
   49    HA   GLN   7           HA       GLN   7  -5.626  -4.454  -7.300
   50    HB2  GLN   7           2HB      GLN   7  -7.932  -4.885  -7.659
   51    HB3  GLN   7           3HB      GLN   7  -7.750  -3.136  -7.684
   52    HG2  GLN   7           2HG      GLN   7  -7.820  -3.144 -10.111
   53    HG3  GLN   7           3HG      GLN   7  -7.949  -4.902 -10.113
   54   HE21  GLN   7          1HE2      GLN   7  -9.533  -2.462  -8.099
   55   HE22  GLN   7          2HE2      GLN   7 -11.147  -2.901  -8.530
   56    H    GLY   8           H        GLY   8  -6.955  -6.561  -8.343
   57    HA2  GLY   8           2HA      GLY   8  -6.965  -8.022 -10.279
   58    HA3  GLY   8           3HA      GLY   8  -5.431  -7.309 -10.756
   59    H    LEU   9           H        LEU   9  -3.927  -8.838 -10.653
   60    HA   LEU   9           HA       LEU   9  -4.067 -11.088  -8.936
   61    HB2  LEU   9           2HB      LEU   9  -2.694 -10.502 -11.188
   62    HB3  LEU   9           3HB      LEU   9  -1.425 -10.305  -9.981
   63    HG   LEU   9           HG       LEU   9  -2.174 -12.670  -9.193
   64   HD11  LEU   9          1HD1      LEU   9  -3.063 -14.075 -10.943
   65   HD12  LEU   9          2HD1      LEU   9  -3.128 -12.707 -12.053
   66   HD13  LEU   9          3HD1      LEU   9  -4.174 -12.741 -10.633
   67   HD21  LEU   9          3HD2      LEU   9  -0.833 -13.328 -11.569
   68   HD22  LEU   9          1HD2      LEU   9  -0.131 -13.037  -9.977
   69   HD23  LEU   9          2HD2      LEU   9  -0.286 -11.709 -11.128
   70    H    TYR  10           H        TYR  10  -1.974  -8.206  -8.904
   71    HA   TYR  10           HA       TYR  10  -1.856  -8.319  -6.010
   72    HB2  TYR  10           2HB      TYR  10   0.619  -8.610  -7.721
   73    HB3  TYR  10           3HB      TYR  10   0.649  -8.212  -6.007
   74    HD1  TYR  10           HD2      TYR  10  -0.060  -9.883  -4.334
   75    HD2  TYR  10           HD1      TYR  10   0.192 -10.847  -8.471
   76    HE1  TYR  10           HE2      TYR  10  -0.104 -12.277  -3.773
   77    HE2  TYR  10           HE1      TYR  10   0.147 -13.244  -7.921
   78    HH   TYR  10           HH       TYR  10   0.197 -14.760  -6.287
   79    H    CYS  11           H        CYS  11   0.055  -6.798  -8.610
   80    HA   CYS  11           HA       CYS  11  -1.160  -4.260  -8.368
   81    HB2  CYS  11           2HB      CYS  11   0.942  -4.865  -6.459
   82    HB3  CYS  11           3HB      CYS  11   1.372  -3.493  -7.475
   83    H    ASP  12           H        ASP  12  -1.077  -3.937 -10.510
   84    HA   ASP  12           HA       ASP  12   1.304  -3.103 -11.749
   85    HB2  ASP  12           2HB      ASP  12   0.965  -5.913 -11.752
   86    HB3  ASP  12           3HB      ASP  12   0.627  -5.359 -13.390
   87    H    LYS  13           H        LYS  13  -1.933  -4.420 -12.149
   88    HA   LYS  13           HA       LYS  13  -2.332  -2.982 -14.643
   89    HB2  LYS  13           2HB      LYS  13  -4.098  -4.809 -13.016
   90    HB3  LYS  13           3HB      LYS  13  -4.661  -3.972 -14.456
   91    HG2  LYS  13           2HG      LYS  13  -2.283  -5.219 -15.215
   92    HG3  LYS  13           3HG      LYS  13  -3.143  -6.401 -14.226
   93    HD2  LYS  13           2HD      LYS  13  -4.827  -6.628 -15.726
   94    HD3  LYS  13           3HD      LYS  13  -4.761  -4.934 -16.217
   95    HE2  LYS  13           2HE      LYS  13  -3.840  -5.736 -18.099
   96    HE3  LYS  13           3HE      LYS  13  -2.371  -5.862 -17.133
   97    HZ1  LYS  13           3HZ      LYS  13  -4.143  -7.957 -18.098
   98    HZ2  LYS  13           1HZ      LYS  13  -3.521  -8.171 -16.539
   99    HZ3  LYS  13           2HZ      LYS  13  -2.470  -7.982 -17.850
  100    H    CYS  14           H        CYS  14  -3.736  -1.268 -14.939
  101    HA   CYS  14           HA       CYS  14  -4.531   0.125 -12.471
  102    HB2  CYS  14           2HB      CYS  14  -4.319   2.193 -13.652
  103    HB3  CYS  14           3HB      CYS  14  -2.871   1.252 -13.997
  104    H    ILE  15           H        ILE  15  -6.036  -1.974 -13.957
  105    HA   ILE  15           HA       ILE  15  -8.148  -2.415 -14.694
  106    HB   ILE  15           HB       ILE  15  -9.154   0.085 -13.414
  107   HG12  ILE  15          2HG1      ILE  15  -7.998  -2.278 -11.921
  108   HG13  ILE  15          3HG1      ILE  15  -7.403  -0.622 -11.883
  109   HG21  ILE  15          1HG2      ILE  15 -11.065  -1.104 -13.077
  110   HG22  ILE  15          2HG2      ILE  15 -10.441  -1.977 -14.476
  111   HG23  ILE  15          3HG2      ILE  15 -10.208  -2.629 -12.854
  112   HD11  ILE  15          3HD1      ILE  15  -8.591  -0.908  -9.891
  113   HD12  ILE  15          1HD1      ILE  15  -9.673   0.006 -10.942
  114   HD13  ILE  15          2HD1      ILE  15  -9.926  -1.724 -10.704
  115    HA   PRO  16           HA       PRO  16  -7.851   0.643 -18.155
  116    HB2  PRO  16           2HB      PRO  16  -7.867  -1.238 -20.112
  117    HB3  PRO  16           3HB      PRO  16  -6.390  -0.717 -19.294
  118    HG2  PRO  16           2HG      PRO  16  -8.068  -3.148 -18.807
  119    HG3  PRO  16           3HG      PRO  16  -6.301  -3.002 -18.872
  120    HD2  PRO  16           2HD      PRO  16  -7.669  -3.118 -16.538
  121    HD3  PRO  16           3HD      PRO  16  -6.163  -2.195 -16.717
  122    H    HIS  17           H        HIS  17  -9.957  -2.023 -17.392
  123    HA   HIS  17           HA       HIS  17 -11.909  -1.882 -19.314
  124    HB2  HIS  17           2HB      HIS  17 -11.769  -2.756 -16.531
  125    HB3  HIS  17           3HB      HIS  17 -13.375  -2.196 -16.986
  126    HD1  HIS  17           HD1      HIS  17 -14.574  -4.388 -17.180
  127    HD2  HIS  17           HD2      HIS  17 -11.022  -4.318 -19.333
  128    HE1  HIS  17           HE1      HIS  17 -14.562  -6.512 -18.526
  129    HA   PRO  18           HA       PRO  18 -14.228   1.614 -16.948
  130    HB2  PRO  18           2HB      PRO  18 -12.998   2.724 -14.797
  131    HB3  PRO  18           3HB      PRO  18 -14.051   1.310 -14.677
  132    HG2  PRO  18           2HG      PRO  18 -11.062   1.444 -14.760
  133    HG3  PRO  18           3HG      PRO  18 -12.109   0.451 -13.730
  134    HD2  PRO  18           2HD      PRO  18 -10.884  -0.529 -15.937
  135    HD3  PRO  18           3HD      PRO  18 -12.468  -1.112 -15.386
  136    H    GLY  19           H        GLY  19 -13.397   2.485 -19.001
  137    HA2  GLY  19           2HA      GLY  19 -12.877   4.851 -19.544
  138    HA3  GLY  19           3HA      GLY  19 -11.449   4.661 -18.538
  139    H    CYS  20           H        CYS  20 -12.328   1.974 -20.485
  140    HA   CYS  20           HA       CYS  20 -11.059   2.638 -22.897
  141    HB2  CYS  20           2HB      CYS  20  -9.249   2.094 -20.757
  142    HB3  CYS  20           3HB      CYS  20  -9.154   0.766 -21.908
  143    H    VAL  21           H        VAL  21 -10.165   0.398 -23.925
  144    HA   VAL  21           HA       VAL  21 -12.196  -1.649 -23.307
  145    HB   VAL  21           HB       VAL  21 -11.123  -1.045 -26.063
  146   HG11  VAL  21          1HG1      VAL  21 -13.652  -2.517 -25.546
  147   HG12  VAL  21          2HG1      VAL  21 -12.490  -2.689 -26.863
  148   HG13  VAL  21          3HG1      VAL  21 -12.127  -3.360 -25.272
  149   HG21  VAL  21          3HG2      VAL  21 -13.357   0.136 -24.543
  150   HG22  VAL  21          1HG2      VAL  21 -12.417   0.796 -25.881
  151   HG23  VAL  21          2HG2      VAL  21 -13.722  -0.347 -26.200
  152    H    HIS  22           H        HIS  22  -9.097  -1.160 -25.004
  153    HA   HIS  22           HA       HIS  22  -8.061  -3.570 -23.727
  154    HB2  HIS  22           2HB      HIS  22  -7.867  -3.158 -26.715
  155    HB3  HIS  22           3HB      HIS  22  -7.274  -4.538 -25.796
  156    HD1  HIS  22           HD1      HIS  22  -9.401  -5.754 -24.382
  157    HD2  HIS  22           HD2      HIS  22 -10.226  -3.697 -27.896
  158    HE1  HIS  22           HE1      HIS  22 -11.626  -6.625 -25.164
  159    H    GLY  23           H        GLY  23  -5.643  -3.840 -24.469
  160    HA2  GLY  23           2HA      GLY  23  -3.647  -2.649 -25.174
  161    HA3  GLY  23           3HA      GLY  23  -4.411  -1.164 -24.629
  162    H    ILE  24           H        ILE  24  -2.381  -0.852 -23.464
  163    HA   ILE  24           HA       ILE  24  -2.426  -2.264 -20.880
  164    HB   ILE  24           HB       ILE  24   0.031  -2.031 -20.762
  165   HG12  ILE  24          2HG1      ILE  24   0.261  -1.601 -23.681
  166   HG13  ILE  24          3HG1      ILE  24  -0.215  -0.194 -22.737
  167   HG21  ILE  24          1HG2      ILE  24  -1.363  -3.698 -22.767
  168   HG22  ILE  24          2HG2      ILE  24   0.397  -3.658 -22.853
  169   HG23  ILE  24          3HG2      ILE  24  -0.401  -4.171 -21.367
  170   HD11  ILE  24          3HD1      ILE  24   2.257  -1.861 -22.329
  171   HD12  ILE  24          1HD1      ILE  24   2.180  -0.249 -23.040
  172   HD13  ILE  24          2HD1      ILE  24   1.777  -0.483 -21.339
  173    H    CYS  25           H        CYS  25  -0.758  -0.913 -19.373
  174    HA   CYS  25           HA       CYS  25  -0.834   1.917 -19.689
  175    HB2  CYS  25           2HB      CYS  25  -2.406   2.509 -17.986
  176    HB3  CYS  25           3HB      CYS  25  -3.222   1.397 -19.080
  177    H    ASN  26           H        ASN  26   0.317   3.021 -18.051
  178    HA   ASN  26           HA       ASN  26   1.825   1.241 -16.250
  179    HB2  ASN  26           2HB      ASN  26   3.352   2.074 -17.871
  180    HB3  ASN  26           3HB      ASN  26   2.699   3.705 -17.756
  181   HD21  ASN  26          1HD2      ASN  26   3.453   5.068 -16.227
  182   HD22  ASN  26          2HD2      ASN  26   4.717   4.673 -15.117
  183    H    GLU  27           H        GLU  27  -0.037   4.146 -16.563
  184    HA   GLU  27           HA       GLU  27   0.443   4.787 -13.731
  185    HB2  GLU  27           2HB      GLU  27  -0.128   6.425 -16.126
  186    HB3  GLU  27           3HB      GLU  27  -0.936   6.927 -14.648
  187    HG2  GLU  27           2HG      GLU  27   1.135   7.221 -13.519
  188    HG3  GLU  27           3HG      GLU  27   2.027   6.464 -14.837
  189    HA   PRO  28           HA       PRO  28  -3.651   3.732 -12.564
  190    HB2  PRO  28           2HB      PRO  28  -4.292   5.708 -10.816
  191    HB3  PRO  28           3HB      PRO  28  -3.126   4.433 -10.440
  192    HG2  PRO  28           2HG      PRO  28  -2.633   7.243 -11.348
  193    HG3  PRO  28           3HG      PRO  28  -1.800   6.311 -10.090
  194    HD2  PRO  28           2HD      PRO  28  -0.774   6.650 -12.573
  195    HD3  PRO  28           3HD      PRO  28  -0.493   5.181 -11.616
  196    H    TRP  29           H        TRP  29  -5.484   3.888 -13.679
  197    HA   TRP  29           HA       TRP  29  -7.244   4.718 -14.855
  198    HB2  TRP  29           2HB      TRP  29  -6.605   7.410 -13.647
  199    HB3  TRP  29           3HB      TRP  29  -8.164   6.827 -14.223
  200    HD1  TRP  29           HD1      TRP  29  -6.852   7.688 -11.113
  201    HE1  TRP  29           HE1      TRP  29  -7.713   6.226  -9.177
  202    HE3  TRP  29           HE3      TRP  29  -8.637   3.732 -13.814
  203    HZ2  TRP  29           HZ2      TRP  29  -8.981   3.727  -8.840
  204    HZ3  TRP  29           HZ3      TRP  29  -9.658   1.846 -12.609
  205    HH2  TRP  29           HH2      TRP  29  -9.825   1.845 -10.173
  206    H    GLN  30           H        GLN  30  -5.301   4.355 -16.489
  207    HA   GLN  30           HA       GLN  30  -5.373   6.666 -18.263
  208    HB2  GLN  30           2HB      GLN  30  -2.940   5.601 -16.959
  209    HB3  GLN  30           3HB      GLN  30  -2.806   5.934 -18.680
  210    HG2  GLN  30           2HG      GLN  30  -4.072   8.069 -17.129
  211    HG3  GLN  30           3HG      GLN  30  -2.393   7.744 -16.702
  212   HE21  GLN  30          1HE2      GLN  30  -0.948   7.459 -18.696
  213   HE22  GLN  30          2HE2      GLN  30  -1.148   8.641 -19.939
  214    H    CYS  31           H        CYS  31  -4.190   6.007 -20.412
  215    HA   CYS  31           HA       CYS  31  -4.697   3.184 -21.024
  216    HB2  CYS  31           2HB      CYS  31  -5.844   5.557 -22.496
  217    HB3  CYS  31           3HB      CYS  31  -5.767   3.943 -23.194
  218    H    LEU  32           H        LEU  32  -3.323   2.292 -22.493
  219    HA   LEU  32           HA       LEU  32  -1.521   4.043 -23.989
  220    HB2  LEU  32           2HB      LEU  32  -0.589   1.791 -22.214
  221    HB3  LEU  32           3HB      LEU  32   0.430   2.720 -23.312
  222    HG   LEU  32           HG       LEU  32  -0.976   3.784 -20.862
  223   HD11  LEU  32          1HD1      LEU  32   1.979   3.709 -21.227
  224   HD12  LEU  32          2HD1      LEU  32   1.138   2.241 -20.731
  225   HD13  LEU  32          3HD1      LEU  32   1.022   3.698 -19.745
  226   HD21  LEU  32          3HD2      LEU  32  -0.687   5.816 -21.700
  227   HD22  LEU  32          1HD2      LEU  32  -0.033   5.123 -23.184
  228   HD23  LEU  32          2HD2      LEU  32   1.045   5.514 -21.844
  229    H    CYS  33           H        CYS  33  -2.051   3.460 -26.005
  230    HA   CYS  33           HA       CYS  33  -1.753   0.630 -26.721
  231    HB2  CYS  33           2HB      CYS  33  -3.702   0.791 -28.231
  232    HB3  CYS  33           3HB      CYS  33  -4.151   1.015 -26.543
  233    H    GLU  34           H        GLU  34  -1.509   0.335 -29.108
  234    HA   GLU  34           HA       GLU  34   0.531   2.037 -30.084
  235    HB2  GLU  34           2HB      GLU  34  -0.544  -0.493 -30.748
  236    HB3  GLU  34           3HB      GLU  34  -0.644   0.494 -32.200
  237    HG2  GLU  34           2HG      GLU  34   1.860   1.069 -31.442
  238    HG3  GLU  34           3HG      GLU  34   1.712  -0.556 -30.776
  239    H    THR  35           H        THR  35   0.298   2.727 -32.551
  240    HA   THR  35           HA       THR  35  -1.620   4.854 -32.549
  241    HB   THR  35           HB       THR  35   0.181   3.965 -34.810
  242    HG1  THR  35           HG1      THR  35   1.651   5.444 -33.972
  243   HG21  THR  35          3HG2      THR  35  -1.590   6.312 -34.346
  244   HG22  THR  35          1HG2      THR  35  -1.239   5.441 -35.838
  245   HG23  THR  35          2HG2      THR  35  -0.061   6.577 -35.183
  246    H    ASN  36           H        ASN  36  -1.395   1.691 -34.005
  247    HA   ASN  36           HA       ASN  36  -3.204   1.899 -36.089
  248    HB2  ASN  36           2HB      ASN  36  -2.053  -0.244 -34.496
  249    HB3  ASN  36           3HB      ASN  36  -3.703  -0.611 -34.988
  250   HD21  ASN  36          1HD2      ASN  36  -0.848   0.925 -36.440
  251   HD22  ASN  36          2HD2      ASN  36  -0.914   0.034 -37.919
  252    H    TRP  37           H        TRP  37  -3.777   1.755 -32.653
  253    HA   TRP  37           HA       TRP  37  -6.613   1.288 -32.931
  254    HB2  TRP  37           2HB      TRP  37  -4.966   2.053 -30.511
  255    HB3  TRP  37           3HB      TRP  37  -6.665   1.590 -30.478
  256    HD1  TRP  37           HD1      TRP  37  -3.210   0.065 -31.309
  257    HE1  TRP  37           HE1      TRP  37  -3.341  -2.474 -30.908
  258    HE3  TRP  37           HE3      TRP  37  -8.189  -0.329 -30.218
  259    HZ2  TRP  37           HZ2      TRP  37  -5.296  -4.390 -30.220
  260    HZ3  TRP  37           HZ3      TRP  37  -9.111  -2.550 -29.701
  261    HH2  TRP  37           HH2      TRP  37  -7.693  -4.538 -29.703
  262    H    GLY  38           H        GLY  38  -8.135   2.789 -33.202
  263    HA2  GLY  38           2HA      GLY  38  -7.333   5.608 -33.049
  264    HA3  GLY  38           3HA      GLY  38  -8.727   4.980 -33.915
  265    H    GLY  39           H        GLY  39  -7.889   6.810 -31.365
  266    HA2  GLY  39           2HA      GLY  39  -9.661   7.759 -30.019
  267    HA3  GLY  39           3HA      GLY  39 -10.403   6.167 -29.964
  268    H    GLN  40           H        GLN  40  -9.661   7.965 -27.771
  269    HA   GLN  40           HA       GLN  40  -7.337   7.087 -26.460
  270    HB2  GLN  40           2HB      GLN  40  -8.560   9.140 -25.853
  271    HB3  GLN  40           3HB      GLN  40  -9.889   8.161 -25.245
  272    HG2  GLN  40           2HG      GLN  40  -8.639   7.378 -23.434
  273    HG3  GLN  40           3HG      GLN  40  -7.112   7.878 -24.160
  274   HE21  GLN  40          1HE2      GLN  40  -6.513  10.045 -24.091
  275   HE22  GLN  40          2HE2      GLN  40  -7.257  11.168 -23.010
  276    H    LEU  41           H        LEU  41 -10.566   5.770 -26.632
  277    HA   LEU  41           HA       LEU  41 -10.348   3.985 -24.439
  278    HB2  LEU  41           2HB      LEU  41 -12.054   3.470 -26.847
  279    HB3  LEU  41           3HB      LEU  41 -12.365   3.056 -25.162
  280    HG   LEU  41           HG       LEU  41 -12.520   5.796 -26.413
  281   HD11  LEU  41          1HD1      LEU  41 -14.852   5.657 -26.049
  282   HD12  LEU  41          2HD1      LEU  41 -14.689   4.185 -25.092
  283   HD13  LEU  41          3HD1      LEU  41 -14.382   4.146 -26.828
  284   HD21  LEU  41          3HD2      LEU  41 -12.166   4.963 -23.647
  285   HD22  LEU  41          1HD2      LEU  41 -13.613   5.942 -23.891
  286   HD23  LEU  41          2HD2      LEU  41 -12.036   6.565 -24.375
  287    H    CYS  42           H        CYS  42  -9.238   3.892 -27.715
  288    HA   CYS  42           HA       CYS  42  -8.022   2.379 -28.900
  289    HB2  CYS  42           2HB      CYS  42  -7.429   1.144 -26.204
  290    HB3  CYS  42           3HB      CYS  42  -6.484   0.959 -27.678
  291    H    ASP  43           H        ASP  43 -10.402   1.755 -29.402
  292    HA   ASP  43           HA       ASP  43 -10.872  -1.047 -28.639
  293    HB2  ASP  43           2HB      ASP  43 -13.183  -0.723 -29.102
  294    HB3  ASP  43           3HB      ASP  43 -12.667   0.681 -28.171
  295    H    LYS  44           H        LYS  44 -11.976  -2.359 -30.394
  296    HA   LYS  44           HA       LYS  44 -10.283  -2.413 -32.681
  297    HB2  LYS  44           2HB      LYS  44 -11.640  -4.314 -33.397
  298    HB3  LYS  44           3HB      LYS  44 -11.214  -4.459 -31.697
  299    HG2  LYS  44           2HG      LYS  44 -13.619  -3.156 -31.589
  300    HG3  LYS  44           3HG      LYS  44 -13.829  -4.242 -32.965
  301    HD2  LYS  44           2HD      LYS  44 -12.725  -5.972 -31.282
  302    HD3  LYS  44           3HD      LYS  44 -13.410  -4.866 -30.089
  303    HE2  LYS  44           2HE      LYS  44 -15.609  -5.101 -31.188
  304    HE3  LYS  44           3HE      LYS  44 -14.903  -6.269 -32.304
  305    HZ1  LYS  44           3HZ      LYS  44 -14.590  -7.811 -30.602
  306    HZ2  LYS  44           1HZ      LYS  44 -16.123  -7.169 -30.285
  307    HZ3  LYS  44           2HZ      LYS  44 -14.789  -6.662 -29.377
  Start of MODEL   14
    1    H1   ARG   1           H        ARG   1   4.164  -0.012  -4.057
    2    HA   ARG   1           HA       ARG   1   2.655   0.670  -1.855
    3    HB2  ARG   1           2HB      ARG   1   3.066   2.967  -3.275
    4    HB3  ARG   1           3HB      ARG   1   1.536   2.415  -3.942
    5    HG2  ARG   1           2HG      ARG   1   0.598   2.312  -1.678
    6    HG3  ARG   1           3HG      ARG   1   2.129   2.909  -1.032
    7    HD2  ARG   1           2HD      ARG   1   1.848   4.927  -2.493
    8    HD3  ARG   1           3HD      ARG   1   0.229   4.345  -2.877
    9    HE   ARG   1           HE       ARG   1   0.345   4.408  -0.136
   10   HH11  ARG   1          1HH1      ARG   1   0.767   6.708  -2.715
   11   HH12  ARG   1          2HH1      ARG   1   0.212   8.056  -1.778
   12   HH21  ARG   1          1HH2      ARG   1  -0.388   6.174   1.107
   13   HH22  ARG   1          2HH2      ARG   1  -0.444   7.751   0.396
   14    H    CYS   2           H        CYS   2   0.313   0.248  -2.150
   15    HA   CYS   2           HA       CYS   2  -0.619  -0.865  -4.613
   16    HB2  CYS   2           2HB      CYS   2   0.917  -2.654  -3.550
   17    HB3  CYS   2           3HB      CYS   2  -0.377  -2.859  -2.373
   18    H    GLN   3           H        GLN   3  -2.037   0.941  -3.826
   19    HA   GLN   3           HA       GLN   3  -4.392  -0.192  -2.625
   20    HB2  GLN   3           2HB      GLN   3  -2.794   0.674  -0.744
   21    HB3  GLN   3           3HB      GLN   3  -3.357   2.261  -1.251
   22    HG2  GLN   3           2HG      GLN   3  -5.520   0.357  -0.846
   23    HG3  GLN   3           3HG      GLN   3  -4.556   0.638   0.603
   24   HE21  GLN   3          1HE2      GLN   3  -7.330   1.419  -0.206
   25   HE22  GLN   3          2HE2      GLN   3  -7.400   3.124   0.061
   26    H    TYR   4           H        TYR   4  -6.110   0.628  -3.623
   27    HA   TYR   4           HA       TYR   4  -7.428   1.957  -4.914
   28    HB2  TYR   4           2HB      TYR   4  -6.750   3.530  -2.921
   29    HB3  TYR   4           3HB      TYR   4  -5.822   4.369  -4.159
   30    HD1  TYR   4           HD1      TYR   4  -7.393   4.509  -6.476
   31    HD2  TYR   4           HD2      TYR   4  -8.724   4.606  -2.436
   32    HE1  TYR   4           HE1      TYR   4  -9.415   5.720  -7.178
   33    HE2  TYR   4           HE2      TYR   4 -10.751   5.816  -3.127
   34    HH   TYR   4           HH       TYR   4 -11.161   7.463  -5.583
   35    H    GLY   5           H        GLY   5  -6.959   1.344  -6.969
   36    HA2  GLY   5           2HA      GLY   5  -6.397   2.359  -9.116
   37    HA3  GLY   5           3HA      GLY   5  -4.923   2.959  -8.371
   38    H    TRP   6           H        TRP   6  -4.757   0.223  -6.984
   39    HA   TRP   6           HA       TRP   6  -3.779  -1.300  -9.307
   40    HB2  TRP   6           2HB      TRP   6  -2.409  -1.054  -6.619
   41    HB3  TRP   6           3HB      TRP   6  -1.857  -2.039  -7.971
   42    HD1  TRP   6           HD1      TRP   6  -1.268   1.223  -6.449
   43    HE1  TRP   6           HE1      TRP   6  -0.037   2.801  -8.067
   44    HE3  TRP   6           HE3      TRP   6  -1.919  -1.398 -10.789
   45    HZ2  TRP   6           HZ2      TRP   6   0.577   2.918 -10.820
   46    HZ3  TRP   6           HZ3      TRP   6  -0.979  -0.484 -12.871
   47    HH2  TRP   6           HH2      TRP   6   0.242   1.630 -12.885
   48    H    GLN   7           H        GLN   7  -5.502  -2.707  -9.370
   49    HA   GLN   7           HA       GLN   7  -5.730  -4.520  -7.063
   50    HB2  GLN   7           2HB      GLN   7  -8.086  -4.648  -7.287
   51    HB3  GLN   7           3HB      GLN   7  -7.689  -2.935  -7.319
   52    HG2  GLN   7           2HG      GLN   7  -7.900  -2.910  -9.737
   53    HG3  GLN   7           3HG      GLN   7  -8.243  -4.639  -9.737
   54   HE21  GLN   7          1HE2      GLN   7  -9.390  -1.897  -7.797
   55   HE22  GLN   7          2HE2      GLN   7 -11.071  -2.187  -8.070
   56    H    GLY   8           H        GLY   8  -7.402  -6.404  -8.084
   57    HA2  GLY   8           2HA      GLY   8  -7.694  -7.849  -9.986
   58    HA3  GLY   8           3HA      GLY   8  -6.148  -7.281 -10.601
   59    H    LEU   9           H        LEU   9  -5.867  -9.674 -10.831
   60    HA   LEU   9           HA       LEU   9  -5.622 -11.382  -8.622
   61    HB2  LEU   9           2HB      LEU   9  -5.740 -12.072 -11.013
   62    HB3  LEU   9           3HB      LEU   9  -4.076 -11.524 -11.205
   63    HG   LEU   9           HG       LEU   9  -3.598 -13.225  -9.278
   64   HD11  LEU   9          1HD1      LEU   9  -6.144 -13.598  -9.070
   65   HD12  LEU   9          2HD1      LEU   9  -5.070 -14.995  -9.009
   66   HD13  LEU   9          3HD1      LEU   9  -5.949 -14.623 -10.492
   67   HD21  LEU   9          3HD2      LEU   9  -3.098 -14.911 -10.912
   68   HD22  LEU   9          1HD2      LEU   9  -2.789 -13.328 -11.626
   69   HD23  LEU   9          2HD2      LEU   9  -4.253 -14.215 -12.049
   70    H    TYR  10           H        TYR  10  -3.507  -8.951  -9.891
   71    HA   TYR  10           HA       TYR  10  -1.713  -9.328  -7.642
   72    HB2  TYR  10           2HB      TYR  10  -0.901  -9.766 -10.494
   73    HB3  TYR  10           3HB      TYR  10   0.260  -9.103  -9.349
   74    HD1  TYR  10           HD2      TYR  10   0.940 -10.448  -7.368
   75    HD2  TYR  10           HD1      TYR  10  -1.493 -12.072 -10.458
   76    HE1  TYR  10           HE2      TYR  10   1.465 -12.718  -6.581
   77    HE2  TYR  10           HE1      TYR  10  -0.975 -14.347  -9.679
   78    HH   TYR  10           HH       TYR  10  -0.175 -15.521  -7.827
   79    H    CYS  11           H        CYS  11   0.035  -7.568  -7.689
   80    HA   CYS  11           HA       CYS  11  -1.311  -5.048  -8.227
   81    HB2  CYS  11           2HB      CYS  11   0.074  -5.784  -6.087
   82    HB3  CYS  11           3HB      CYS  11   1.423  -5.171  -7.037
   83    H    ASP  12           H        ASP  12  -1.152  -4.456 -10.315
   84    HA   ASP  12           HA       ASP  12   1.229  -3.407 -11.333
   85    HB2  ASP  12           2HB      ASP  12   1.487  -5.064 -13.274
   86    HB3  ASP  12           3HB      ASP  12   2.104  -5.563 -11.702
   87    H    LYS  13           H        LYS  13  -1.913  -4.811 -12.018
   88    HA   LYS  13           HA       LYS  13  -2.275  -3.284 -14.441
   89    HB2  LYS  13           2HB      LYS  13  -3.920  -5.231 -12.879
   90    HB3  LYS  13           3HB      LYS  13  -4.724  -4.176 -14.034
   91    HG2  LYS  13           2HG      LYS  13  -3.724  -5.163 -15.844
   92    HG3  LYS  13           3HG      LYS  13  -2.329  -5.712 -14.912
   93    HD2  LYS  13           2HD      LYS  13  -3.380  -7.712 -15.112
   94    HD3  LYS  13           3HD      LYS  13  -4.244  -7.125 -13.688
   95    HE2  LYS  13           2HE      LYS  13  -5.802  -6.057 -15.557
   96    HE3  LYS  13           3HE      LYS  13  -5.163  -7.404 -16.498
   97    HZ1  LYS  13           3HZ      LYS  13  -5.841  -8.821 -14.513
   98    HZ2  LYS  13           1HZ      LYS  13  -7.080  -8.236 -15.506
   99    HZ3  LYS  13           2HZ      LYS  13  -6.766  -7.494 -14.019
  100    H    CYS  14           H        CYS  14  -3.257  -1.361 -14.660
  101    HA   CYS  14           HA       CYS  14  -4.130  -0.007 -12.218
  102    HB2  CYS  14           2HB      CYS  14  -3.832   2.049 -13.399
  103    HB3  CYS  14           3HB      CYS  14  -2.433   1.042 -13.760
  104    H    ILE  15           H        ILE  15  -5.756  -2.032 -13.644
  105    HA   ILE  15           HA       ILE  15  -7.906  -2.383 -14.309
  106    HB   ILE  15           HB       ILE  15  -8.737   0.256 -13.191
  107   HG12  ILE  15          2HG1      ILE  15  -7.740  -2.086 -11.556
  108   HG13  ILE  15          3HG1      ILE  15  -7.033  -0.475 -11.618
  109   HG21  ILE  15          1HG2      ILE  15 -10.724  -0.773 -12.791
  110   HG22  ILE  15          2HG2      ILE  15 -10.164  -1.781 -14.123
  111   HG23  ILE  15          3HG2      ILE  15  -9.977  -2.335 -12.459
  112   HD11  ILE  15          3HD1      ILE  15  -9.606  -1.343 -10.359
  113   HD12  ILE  15          1HD1      ILE  15  -8.227  -0.531  -9.619
  114   HD13  ILE  15          2HD1      ILE  15  -9.275   0.349 -10.731
  115    HA   PRO  16           HA       PRO  16  -7.432   0.424 -17.961
  116    HB2  PRO  16           2HB      PRO  16  -7.555  -1.574 -19.794
  117    HB3  PRO  16           3HB      PRO  16  -6.050  -1.085 -19.006
  118    HG2  PRO  16           2HG      PRO  16  -7.861  -3.382 -18.370
  119    HG3  PRO  16           3HG      PRO  16  -6.090  -3.340 -18.439
  120    HD2  PRO  16           2HD      PRO  16  -7.459  -3.230 -16.106
  121    HD3  PRO  16           3HD      PRO  16  -5.904  -2.406 -16.340
  122    H    HIS  17           H        HIS  17  -9.687  -2.056 -17.024
  123    HA   HIS  17           HA       HIS  17 -11.629  -1.938 -18.957
  124    HB2  HIS  17           2HB      HIS  17 -11.540  -2.615 -16.115
  125    HB3  HIS  17           3HB      HIS  17 -13.113  -2.008 -16.624
  126    HD1  HIS  17           HD1      HIS  17 -14.258  -4.288 -16.423
  127    HD2  HIS  17           HD2      HIS  17 -11.026  -4.271 -19.034
  128    HE1  HIS  17           HE1      HIS  17 -14.391  -6.467 -17.671
  129    HA   PRO  18           HA       PRO  18 -13.742   1.842 -16.847
  130    HB2  PRO  18           2HB      PRO  18 -12.450   3.024 -14.773
  131    HB3  PRO  18           3HB      PRO  18 -13.583   1.685 -14.561
  132    HG2  PRO  18           2HG      PRO  18 -10.591   1.640 -14.640
  133    HG3  PRO  18           3HG      PRO  18 -11.694   0.782 -13.548
  134    HD2  PRO  18           2HD      PRO  18 -10.527  -0.416 -15.678
  135    HD3  PRO  18           3HD      PRO  18 -12.142  -0.868 -15.094
  136    H    GLY  19           H        GLY  19 -12.867   2.525 -18.950
  137    HA2  GLY  19           2HA      GLY  19 -12.164   4.921 -19.468
  138    HA3  GLY  19           3HA      GLY  19 -10.653   4.459 -18.700
  139    H    CYS  20           H        CYS  20 -10.919   1.709 -19.887
  140    HA   CYS  20           HA       CYS  20 -10.552   2.253 -22.730
  141    HB2  CYS  20           2HB      CYS  20  -8.392   1.519 -20.835
  142    HB3  CYS  20           3HB      CYS  20  -8.407   0.660 -22.372
  143    H    VAL  21           H        VAL  21  -9.850   0.008 -23.789
  144    HA   VAL  21           HA       VAL  21 -11.624  -2.050 -22.642
  145    HB   VAL  21           HB       VAL  21 -11.065  -1.648 -25.581
  146   HG11  VAL  21          1HG1      VAL  21 -11.856  -3.907 -24.416
  147   HG12  VAL  21          2HG1      VAL  21 -13.428  -3.118 -24.561
  148   HG13  VAL  21          3HG1      VAL  21 -12.446  -3.403 -25.999
  149   HG21  VAL  21          3HG2      VAL  21 -12.294   0.269 -24.661
  150   HG22  VAL  21          1HG2      VAL  21 -13.295  -0.690 -25.751
  151   HG23  VAL  21          2HG2      VAL  21 -13.507  -0.831 -24.006
  152    H    HIS  22           H        HIS  22  -8.807  -1.550 -24.757
  153    HA   HIS  22           HA       HIS  22  -7.600  -3.960 -23.614
  154    HB2  HIS  22           2HB      HIS  22  -7.566  -3.426 -26.586
  155    HB3  HIS  22           3HB      HIS  22  -6.985  -4.860 -25.745
  156    HD1  HIS  22           HD1      HIS  22  -9.154  -5.973 -24.232
  157    HD2  HIS  22           HD2      HIS  22  -9.925  -3.939 -27.771
  158    HE1  HIS  22           HE1      HIS  22 -11.419  -6.767 -24.984
  159    H    GLY  23           H        GLY  23  -5.280  -4.063 -23.871
  160    HA2  GLY  23           2HA      GLY  23  -3.333  -2.805 -24.886
  161    HA3  GLY  23           3HA      GLY  23  -4.108  -1.375 -24.222
  162    H    ILE  24           H        ILE  24  -2.191  -0.940 -23.030
  163    HA   ILE  24           HA       ILE  24  -2.060  -2.480 -20.539
  164    HB   ILE  24           HB       ILE  24   0.387  -2.376 -20.517
  165   HG12  ILE  24          2HG1      ILE  24   0.716  -1.844 -23.368
  166   HG13  ILE  24          3HG1      ILE  24   0.069  -0.459 -22.494
  167   HG21  ILE  24          1HG2      ILE  24  -0.664  -3.691 -23.018
  168   HG22  ILE  24          2HG2      ILE  24   0.809  -4.116 -22.148
  169   HG23  ILE  24          3HG2      ILE  24  -0.764  -4.367 -21.392
  170   HD11  ILE  24          3HD1      ILE  24   2.525  -0.454 -22.668
  171   HD12  ILE  24          1HD1      ILE  24   1.949  -0.463 -21.001
  172   HD13  ILE  24          2HD1      ILE  24   2.568  -1.946 -21.729
  173    H    CYS  25           H        CYS  25  -0.258  -1.192 -19.109
  174    HA   CYS  25           HA       CYS  25  -0.170   1.614 -19.360
  175    HB2  CYS  25           2HB      CYS  25  -1.762   2.335 -17.728
  176    HB3  CYS  25           3HB      CYS  25  -2.619   1.294 -18.861
  177    H    ASN  26           H        ASN  26   0.994   2.616 -17.667
  178    HA   ASN  26           HA       ASN  26   2.269   0.713 -15.814
  179    HB2  ASN  26           2HB      ASN  26   4.322   1.813 -16.062
  180    HB3  ASN  26           3HB      ASN  26   3.669   1.799 -17.697
  181   HD21  ASN  26          1HD2      ASN  26   2.511   3.753 -18.385
  182   HD22  ASN  26          2HD2      ASN  26   3.076   5.283 -17.816
  183    H    GLU  27           H        GLU  27   0.644   3.746 -16.179
  184    HA   GLU  27           HA       GLU  27   1.073   4.359 -13.334
  185    HB2  GLU  27           2HB      GLU  27   0.738   6.006 -15.745
  186    HB3  GLU  27           3HB      GLU  27  -0.206   6.550 -14.365
  187    HG2  GLU  27           2HG      GLU  27   1.703   6.893 -13.051
  188    HG3  GLU  27           3HG      GLU  27   2.723   5.956 -14.141
  189    HA   PRO  28           HA       PRO  28  -3.100   3.535 -12.265
  190    HB2  PRO  28           2HB      PRO  28  -3.675   5.552 -10.541
  191    HB3  PRO  28           3HB      PRO  28  -2.590   4.218 -10.131
  192    HG2  PRO  28           2HG      PRO  28  -1.922   6.992 -11.038
  193    HG3  PRO  28           3HG      PRO  28  -1.172   6.023  -9.756
  194    HD2  PRO  28           2HD      PRO  28  -0.068   6.293 -12.214
  195    HD3  PRO  28           3HD      PRO  28   0.108   4.816 -11.245
  196    H    TRP  29           H        TRP  29  -4.919   3.794 -13.385
  197    HA   TRP  29           HA       TRP  29  -6.609   4.716 -14.595
  198    HB2  TRP  29           2HB      TRP  29  -5.794   7.387 -13.448
  199    HB3  TRP  29           3HB      TRP  29  -7.386   6.897 -14.023
  200    HD1  TRP  29           HD1      TRP  29  -6.042   7.748 -10.924
  201    HE1  TRP  29           HE1      TRP  29  -7.014   6.399  -8.959
  202    HE3  TRP  29           HE3      TRP  29  -8.068   3.851 -13.539
  203    HZ2  TRP  29           HZ2      TRP  29  -8.449   4.000  -8.570
  204    HZ3  TRP  29           HZ3      TRP  29  -9.223   2.069 -12.295
  205    HH2  TRP  29           HH2      TRP  29  -9.408   2.144  -9.862
  206    H    GLN  30           H        GLN  30  -4.536   4.205 -16.119
  207    HA   GLN  30           HA       GLN  30  -4.325   6.559 -17.872
  208    HB2  GLN  30           2HB      GLN  30  -2.199   5.194 -16.542
  209    HB3  GLN  30           3HB      GLN  30  -2.050   4.900 -18.269
  210    HG2  GLN  30           2HG      GLN  30  -2.550   7.573 -18.212
  211    HG3  GLN  30           3HG      GLN  30  -1.622   7.347 -16.730
  212   HE21  GLN  30          1HE2      GLN  30  -0.788   8.804 -19.016
  213   HE22  GLN  30          2HE2      GLN  30   0.614   8.021 -19.654
  214    H    CYS  31           H        CYS  31  -3.262   5.657 -20.078
  215    HA   CYS  31           HA       CYS  31  -4.372   3.086 -20.835
  216    HB2  CYS  31           2HB      CYS  31  -5.519   5.699 -21.716
  217    HB3  CYS  31           3HB      CYS  31  -5.452   4.380 -22.880
  218    H    LEU  32           H        LEU  32  -2.541   2.253 -21.639
  219    HA   LEU  32           HA       LEU  32  -1.001   3.865 -23.559
  220    HB2  LEU  32           2HB      LEU  32  -0.172   1.490 -21.900
  221    HB3  LEU  32           3HB      LEU  32   0.848   2.279 -23.101
  222    HG   LEU  32           HG       LEU  32  -0.141   3.448 -20.504
  223   HD11  LEU  32          1HD1      LEU  32   2.474   3.693 -20.353
  224   HD12  LEU  32          2HD1      LEU  32   2.440   2.337 -21.480
  225   HD13  LEU  32          3HD1      LEU  32   1.669   2.190 -19.900
  226   HD21  LEU  32          3HD2      LEU  32   1.178   5.431 -21.117
  227   HD22  LEU  32          1HD2      LEU  32  -0.176   5.164 -22.216
  228   HD23  LEU  32          2HD2      LEU  32   1.461   4.734 -22.713
  229    H    CYS  33           H        CYS  33  -1.758   3.430 -25.543
  230    HA   CYS  33           HA       CYS  33  -1.710   0.635 -26.423
  231    HB2  CYS  33           2HB      CYS  33  -3.940   2.519 -27.200
  232    HB3  CYS  33           3HB      CYS  33  -3.817   0.797 -27.549
  233    H    GLU  34           H        GLU  34  -1.573   0.405 -28.769
  234    HA   GLU  34           HA       GLU  34   0.319   2.201 -29.882
  235    HB2  GLU  34           2HB      GLU  34  -0.776  -0.370 -30.519
  236    HB3  GLU  34           3HB      GLU  34  -0.821   0.643 -31.955
  237    HG2  GLU  34           2HG      GLU  34   1.700   0.746 -30.467
  238    HG3  GLU  34           3HG      GLU  34   1.310  -0.828 -31.159
  239    H    THR  35           H        THR  35   0.120   3.538 -31.727
  240    HA   THR  35           HA       THR  35  -2.239   5.110 -31.778
  241    HB   THR  35           HB       THR  35   0.081   5.071 -33.718
  242    HG1  THR  35           HG1      THR  35  -0.461   6.498 -31.327
  243   HG21  THR  35          3HG2      THR  35  -0.720   7.449 -34.148
  244   HG22  THR  35          1HG2      THR  35  -2.225   6.973 -33.363
  245   HG23  THR  35          2HG2      THR  35  -1.699   6.153 -34.833
  246    H    ASN  36           H        ASN  36  -1.091   2.427 -33.690
  247    HA   ASN  36           HA       ASN  36  -2.680   2.719 -35.966
  248    HB2  ASN  36           2HB      ASN  36  -0.912   0.793 -34.950
  249    HB3  ASN  36           3HB      ASN  36  -2.431  -0.061 -35.202
  250   HD21  ASN  36          1HD2      ASN  36  -0.283   2.245 -36.822
  251   HD22  ASN  36          2HD2      ASN  36  -0.480   1.579 -38.404
  252    H    TRP  37           H        TRP  37  -3.425   1.414 -32.793
  253    HA   TRP  37           HA       TRP  37  -5.800   0.092 -33.305
  254    HB2  TRP  37           2HB      TRP  37  -4.710   1.545 -30.931
  255    HB3  TRP  37           3HB      TRP  37  -6.391   1.017 -30.901
  256    HD1  TRP  37           HD1      TRP  37  -2.827  -0.431 -31.164
  257    HE1  TRP  37           HE1      TRP  37  -2.893  -2.879 -30.371
  258    HE3  TRP  37           HE3      TRP  37  -7.875  -0.946 -30.539
  259    HZ2  TRP  37           HZ2      TRP  37  -4.828  -4.777 -29.586
  260    HZ3  TRP  37           HZ3      TRP  37  -8.752  -3.111 -29.764
  261    HH2  TRP  37           HH2      TRP  37  -7.259  -4.985 -29.299
  262    H    GLY  38           H        GLY  38  -5.669   3.393 -31.951
  263    HA2  GLY  38           2HA      GLY  38  -6.826   5.277 -32.778
  264    HA3  GLY  38           3HA      GLY  38  -7.776   4.214 -33.805
  265    H    GLY  39           H        GLY  39  -8.787   6.314 -32.139
  266    HA2  GLY  39           2HA      GLY  39 -10.926   6.322 -31.097
  267    HA3  GLY  39           3HA      GLY  39 -10.614   4.696 -30.509
  268    H    GLN  40           H        GLN  40 -11.500   5.837 -28.526
  269    HA   GLN  40           HA       GLN  40  -9.373   7.287 -27.107
  270    HB2  GLN  40           2HB      GLN  40 -11.947   8.033 -27.408
  271    HB3  GLN  40           3HB      GLN  40 -12.079   7.108 -25.918
  272    HG2  GLN  40           2HG      GLN  40 -10.024   8.557 -25.196
  273    HG3  GLN  40           3HG      GLN  40 -10.612   9.640 -26.456
  274   HE21  GLN  40          1HE2      GLN  40 -11.044   8.490 -23.279
  275   HE22  GLN  40          2HE2      GLN  40 -12.448   9.415 -22.884
  276    H    LEU  41           H        LEU  41 -11.433   4.467 -27.015
  277    HA   LEU  41           HA       LEU  41 -10.223   3.646 -24.467
  278    HB2  LEU  41           2HB      LEU  41 -12.479   2.206 -25.802
  279    HB3  LEU  41           3HB      LEU  41 -12.050   2.260 -24.093
  280    HG   LEU  41           HG       LEU  41 -13.229   4.569 -25.637
  281   HD11  LEU  41          1HD1      LEU  41 -14.832   2.754 -25.489
  282   HD12  LEU  41          2HD1      LEU  41 -15.293   4.070 -24.409
  283   HD13  LEU  41          3HD1      LEU  41 -14.544   2.614 -23.754
  284   HD21  LEU  41          3HD2      LEU  41 -13.012   4.209 -22.659
  285   HD22  LEU  41          1HD2      LEU  41 -13.436   5.666 -23.558
  286   HD23  LEU  41          2HD2      LEU  41 -11.786   5.045 -23.612
  287    H    CYS  42           H        CYS  42  -8.951   3.537 -27.155
  288    HA   CYS  42           HA       CYS  42  -7.712   2.123 -28.443
  289    HB2  CYS  42           2HB      CYS  42  -7.694   0.330 -26.013
  290    HB3  CYS  42           3HB      CYS  42  -6.466   0.452 -27.269
  291    H    ASP  43           H        ASP  43 -10.397   1.852 -28.928
  292    HA   ASP  43           HA       ASP  43 -10.912  -1.029 -29.060
  293    HB2  ASP  43           2HB      ASP  43 -13.181  -0.533 -29.358
  294    HB3  ASP  43           3HB      ASP  43 -12.638   0.704 -28.228
  295    H    LYS  44           H        LYS  44 -11.983  -1.791 -31.126
  296    HA   LYS  44           HA       LYS  44 -10.212  -1.377 -33.289
  297    HB2  LYS  44           2HB      LYS  44 -11.590  -2.913 -34.511
  298    HB3  LYS  44           3HB      LYS  44 -11.496  -3.479 -32.848
  299    HG2  LYS  44           2HG      LYS  44 -13.714  -2.186 -32.537
  300    HG3  LYS  44           3HG      LYS  44 -13.803  -2.253 -34.298
  301    HD2  LYS  44           2HD      LYS  44 -13.094  -4.832 -33.267
  302    HD3  LYS  44           3HD      LYS  44 -14.544  -4.244 -32.450
  303    HE2  LYS  44           2HE      LYS  44 -15.385  -5.352 -34.315
  304    HE3  LYS  44           3HE      LYS  44 -15.379  -3.661 -34.812
  305    HZ1  LYS  44           3HZ      LYS  44 -13.112  -4.185 -35.800
  306    HZ2  LYS  44           1HZ      LYS  44 -14.464  -4.812 -36.601
  307    HZ3  LYS  44           2HZ      LYS  44 -13.524  -5.815 -35.616
  Start of MODEL   15
    1    H1   ARG   1           H        ARG   1  -6.032  -1.632  -0.740
    2    HA   ARG   1           HA       ARG   1  -4.902  -3.335   0.601
    3    HB2  ARG   1           2HB      ARG   1  -5.965  -5.019  -1.204
    4    HB3  ARG   1           3HB      ARG   1  -4.326  -4.928  -1.833
    5    HG2  ARG   1           2HG      ARG   1  -4.735  -5.454   1.069
    6    HG3  ARG   1           3HG      ARG   1  -4.992  -6.757  -0.093
    7    HD2  ARG   1           2HD      ARG   1  -2.579  -5.484  -0.806
    8    HD3  ARG   1           3HD      ARG   1  -2.537  -5.716   0.941
    9    HE   ARG   1           HE       ARG   1  -3.387  -8.112  -0.122
   10   HH11  ARG   1          1HH1      ARG   1  -0.577  -6.074  -0.385
   11   HH12  ARG   1          2HH1      ARG   1   0.508  -7.388  -0.698
   12   HH21  ARG   1          1HH2      ARG   1  -1.969  -9.851  -0.533
   13   HH22  ARG   1          2HH2      ARG   1  -0.285  -9.536  -0.783
   14    H    CYS   2           H        CYS   2  -4.053  -2.784  -2.817
   15    HA   CYS   2           HA       CYS   2  -1.271  -2.372  -2.135
   16    HB2  CYS   2           2HB      CYS   2  -2.355  -3.404  -4.325
   17    HB3  CYS   2           3HB      CYS   2  -2.359  -1.720  -4.838
   18    H    GLN   3           H        GLN   3  -3.663  -0.389  -3.895
   19    HA   GLN   3           HA       GLN   3  -3.334   1.921  -2.355
   20    HB2  GLN   3           2HB      GLN   3  -1.150   1.450  -4.095
   21    HB3  GLN   3           3HB      GLN   3  -2.069   2.785  -4.776
   22    HG2  GLN   3           2HG      GLN   3  -1.751   4.123  -2.897
   23    HG3  GLN   3           3HG      GLN   3  -1.297   2.753  -1.885
   24   HE21  GLN   3          1HE2      GLN   3   0.791   2.248  -1.685
   25   HE22  GLN   3          2HE2      GLN   3   2.079   2.985  -2.568
   26    H    TYR   4           H        TYR   4  -3.888   3.964  -3.896
   27    HA   TYR   4           HA       TYR   4  -6.477   3.340  -4.953
   28    HB2  TYR   4           2HB      TYR   4  -6.071   5.427  -3.728
   29    HB3  TYR   4           3HB      TYR   4  -4.934   5.943  -4.968
   30    HD1  TYR   4           HD1      TYR   4  -8.298   4.369  -5.303
   31    HD2  TYR   4           HD2      TYR   4  -5.887   7.811  -5.969
   32    HE1  TYR   4           HE1      TYR   4 -10.142   5.412  -6.553
   33    HE2  TYR   4           HE2      TYR   4  -7.725   8.864  -7.219
   34    HH   TYR   4           HH       TYR   4 -10.811   7.953  -7.068
   35    H    GLY   5           H        GLY   5  -6.773   2.515  -6.911
   36    HA2  GLY   5           2HA      GLY   5  -6.783   2.595  -9.252
   37    HA3  GLY   5           3HA      GLY   5  -5.464   3.755  -9.196
   38    H    TRP   6           H        TRP   6  -5.208   0.858  -7.329
   39    HA   TRP   6           HA       TRP   6  -3.681  -0.512  -9.399
   40    HB2  TRP   6           2HB      TRP   6  -2.472   0.203  -6.718
   41    HB3  TRP   6           3HB      TRP   6  -1.714  -0.789  -7.961
   42    HD1  TRP   6           HD1      TRP   6  -1.862   2.690  -6.772
   43    HE1  TRP   6           HE1      TRP   6  -0.804   4.288  -8.490
   44    HE3  TRP   6           HE3      TRP   6  -1.603  -0.478 -10.776
   45    HZ2  TRP   6           HZ2      TRP   6   0.029   4.216 -11.186
   46    HZ3  TRP   6           HZ3      TRP   6  -0.663   0.365 -12.888
   47    HH2  TRP   6           HH2      TRP   6   0.136   2.664 -13.087
   48    H    GLN   7           H        GLN   7  -5.161  -2.178  -9.358
   49    HA   GLN   7           HA       GLN   7  -5.465  -3.617  -6.811
   50    HB2  GLN   7           2HB      GLN   7  -7.489  -4.561  -7.677
   51    HB3  GLN   7           3HB      GLN   7  -7.545  -2.826  -7.957
   52    HG2  GLN   7           2HG      GLN   7  -6.942  -3.149 -10.278
   53    HG3  GLN   7           3HG      GLN   7  -6.786  -4.886 -10.016
   54   HE21  GLN   7          1HE2      GLN   7  -8.356  -4.623 -11.915
   55   HE22  GLN   7          2HE2      GLN   7 -10.034  -4.631 -11.505
   56    H    GLY   8           H        GLY   8  -6.055  -6.093  -7.448
   57    HA2  GLY   8           2HA      GLY   8  -5.401  -7.993  -8.732
   58    HA3  GLY   8           3HA      GLY   8  -4.072  -7.051  -9.391
   59    H    LEU   9           H        LEU   9  -4.188  -9.710  -8.017
   60    HA   LEU   9           HA       LEU   9  -3.075  -9.550  -5.451
   61    HB2  LEU   9           2HB      LEU   9  -3.997 -11.607  -6.336
   62    HB3  LEU   9           3HB      LEU   9  -2.746 -11.661  -7.577
   63    HG   LEU   9           HG       LEU   9  -1.054 -12.100  -5.911
   64   HD11  LEU   9          1HD1      LEU   9  -3.123 -11.161  -4.100
   65   HD12  LEU   9          2HD1      LEU   9  -1.375 -11.241  -3.881
   66   HD13  LEU   9          3HD1      LEU   9  -2.369 -12.661  -3.559
   67   HD21  LEU   9          3HD2      LEU   9  -3.482 -13.807  -6.036
   68   HD22  LEU   9          1HD2      LEU   9  -2.234 -14.220  -4.860
   69   HD23  LEU   9          2HD2      LEU   9  -1.835 -14.137  -6.576
   70    H    TYR  10           H        TYR  10  -1.667  -9.157  -8.601
   71    HA   TYR  10           HA       TYR  10   1.047  -9.252  -7.530
   72    HB2  TYR  10           2HB      TYR  10  -0.145  -9.245 -10.268
   73    HB3  TYR  10           3HB      TYR  10   1.501  -8.653 -10.069
   74    HD1  TYR  10           HD1      TYR  10  -0.263 -11.462  -8.363
   75    HD2  TYR  10           HD2      TYR  10   2.882 -10.286 -10.976
   76    HE1  TYR  10           HE1      TYR  10   0.568 -13.776  -8.395
   77    HE2  TYR  10           HE2      TYR  10   3.721 -12.597 -11.016
   78    HH   TYR  10           HH       TYR  10   3.406 -14.683 -10.332
   79    H    CYS  11           H        CYS  11  -1.372  -6.987  -8.542
   80    HA   CYS  11           HA       CYS  11  -1.477  -4.716  -8.495
   81    HB2  CYS  11           2HB      CYS  11  -0.571  -5.105  -6.185
   82    HB3  CYS  11           3HB      CYS  11   1.045  -4.853  -6.835
   83    H    ASP  12           H        ASP  12  -1.033  -4.664 -10.759
   84    HA   ASP  12           HA       ASP  12   1.223  -3.028 -11.410
   85    HB2  ASP  12           2HB      ASP  12   1.721  -5.744 -11.519
   86    HB3  ASP  12           3HB      ASP  12   1.303  -5.351 -13.185
   87    H    LYS  13           H        LYS  13  -1.649  -2.892 -11.577
   88    HA   LYS  13           HA       LYS  13  -1.864  -2.195 -14.395
   89    HB2  LYS  13           2HB      LYS  13  -3.374  -4.377 -13.087
   90    HB3  LYS  13           3HB      LYS  13  -4.323  -3.280 -14.083
   91    HG2  LYS  13           2HG      LYS  13  -2.597  -3.703 -15.906
   92    HG3  LYS  13           3HG      LYS  13  -2.041  -5.046 -14.904
   93    HD2  LYS  13           2HD      LYS  13  -3.934  -6.274 -15.259
   94    HD3  LYS  13           3HD      LYS  13  -4.953  -4.847 -15.460
   95    HE2  LYS  13           2HE      LYS  13  -4.861  -5.726 -17.606
   96    HE3  LYS  13           3HE      LYS  13  -3.612  -4.482 -17.637
   97    HZ1  LYS  13           3HZ      LYS  13  -2.057  -6.398 -16.990
   98    HZ2  LYS  13           1HZ      LYS  13  -2.587  -6.303 -18.594
   99    HZ3  LYS  13           2HZ      LYS  13  -3.298  -7.412 -17.534
  100    H    CYS  14           H        CYS  14  -3.352  -0.563 -14.820
  101    HA   CYS  14           HA       CYS  14  -4.320   0.840 -12.431
  102    HB2  CYS  14           2HB      CYS  14  -4.301   2.847 -13.727
  103    HB3  CYS  14           3HB      CYS  14  -2.784   2.014 -14.052
  104    H    ILE  15           H        ILE  15  -5.650  -1.463 -13.793
  105    HA   ILE  15           HA       ILE  15  -7.725  -2.124 -14.468
  106    HB   ILE  15           HB       ILE  15  -8.937   0.332 -13.286
  107   HG12  ILE  15          2HG1      ILE  15  -7.538  -1.835 -11.705
  108   HG13  ILE  15          3HG1      ILE  15  -7.102  -0.131 -11.759
  109   HG21  ILE  15          1HG2      ILE  15  -9.718  -2.441 -12.577
  110   HG22  ILE  15          2HG2      ILE  15 -10.719  -1.015 -12.845
  111   HG23  ILE  15          3HG2      ILE  15 -10.045  -1.889 -14.220
  112   HD11  ILE  15          3HD1      ILE  15  -8.294   0.021  -9.885
  113   HD12  ILE  15          1HD1      ILE  15  -9.700  -0.022 -10.948
  114   HD13  ILE  15          2HD1      ILE  15  -9.130  -1.504 -10.179
  115    HA   PRO  16           HA       PRO  16  -7.756   0.783 -18.069
  116    HB2  PRO  16           2HB      PRO  16  -7.635  -1.182 -19.938
  117    HB3  PRO  16           3HB      PRO  16  -6.198  -0.494 -19.173
  118    HG2  PRO  16           2HG      PRO  16  -7.645  -3.038 -18.544
  119    HG3  PRO  16           3HG      PRO  16  -5.901  -2.741 -18.651
  120    HD2  PRO  16           2HD      PRO  16  -7.215  -2.868 -16.287
  121    HD3  PRO  16           3HD      PRO  16  -5.801  -1.825 -16.538
  122    H    HIS  17           H        HIS  17  -9.604  -2.023 -17.148
  123    HA   HIS  17           HA       HIS  17 -11.591  -2.140 -19.036
  124    HB2  HIS  17           2HB      HIS  17 -11.337  -2.864 -16.214
  125    HB3  HIS  17           3HB      HIS  17 -12.993  -2.489 -16.680
  126    HD1  HIS  17           HD1      HIS  17 -14.034  -4.744 -16.864
  127    HD2  HIS  17           HD2      HIS  17 -10.383  -4.533 -18.837
  128    HE1  HIS  17           HE1      HIS  17 -13.799  -6.933 -18.079
  129    HA   PRO  18           HA       PRO  18 -14.175   1.237 -16.771
  130    HB2  PRO  18           2HB      PRO  18 -13.012   2.545 -14.696
  131    HB3  PRO  18           3HB      PRO  18 -13.932   1.049 -14.494
  132    HG2  PRO  18           2HG      PRO  18 -10.969   1.445 -14.645
  133    HG3  PRO  18           3HG      PRO  18 -11.905   0.409 -13.552
  134    HD2  PRO  18           2HD      PRO  18 -10.635  -0.555 -15.741
  135    HD3  PRO  18           3HD      PRO  18 -12.150  -1.251 -15.133
  136    H    GLY  19           H        GLY  19 -13.458   2.086 -18.877
  137    HA2  GLY  19           2HA      GLY  19 -13.163   4.463 -19.531
  138    HA3  GLY  19           3HA      GLY  19 -11.707   4.445 -18.547
  139    H    CYS  20           H        CYS  20 -12.345   1.595 -20.336
  140    HA   CYS  20           HA       CYS  20 -11.201   2.257 -22.812
  141    HB2  CYS  20           2HB      CYS  20  -9.304   2.006 -20.692
  142    HB3  CYS  20           3HB      CYS  20  -9.096   0.641 -21.783
  143    H    VAL  21           H        VAL  21 -10.030   0.027 -23.672
  144    HA   VAL  21           HA       VAL  21 -11.790  -2.194 -22.878
  145    HB   VAL  21           HB       VAL  21 -11.076  -1.565 -25.742
  146   HG11  VAL  21          1HG1      VAL  21 -11.573  -3.956 -24.994
  147   HG12  VAL  21          2HG1      VAL  21 -13.231  -3.403 -24.746
  148   HG13  VAL  21          3HG1      VAL  21 -12.503  -3.321 -26.351
  149   HG21  VAL  21          3HG2      VAL  21 -12.524   0.184 -25.020
  150   HG22  VAL  21          1HG2      VAL  21 -13.502  -0.956 -25.945
  151   HG23  VAL  21          2HG2      VAL  21 -13.580  -0.954 -24.183
  152    H    HIS  22           H        HIS  22  -8.909  -1.314 -24.776
  153    HA   HIS  22           HA       HIS  22  -7.537  -3.647 -23.660
  154    HB2  HIS  22           2HB      HIS  22  -7.436  -2.972 -26.604
  155    HB3  HIS  22           3HB      HIS  22  -6.684  -4.348 -25.803
  156    HD1  HIS  22           HD1      HIS  22  -8.656  -5.896 -24.483
  157    HD2  HIS  22           HD2      HIS  22  -9.723  -3.683 -27.833
  158    HE1  HIS  22           HE1      HIS  22 -10.776  -6.946 -25.335
  159    H    GLY  23           H        GLY  23  -5.117  -3.536 -24.580
  160    HA2  GLY  23           2HA      GLY  23  -3.273  -2.108 -25.109
  161    HA3  GLY  23           3HA      GLY  23  -4.221  -0.735 -24.555
  162    H    ILE  24           H        ILE  24  -2.155  -0.288 -23.405
  163    HA   ILE  24           HA       ILE  24  -2.156  -1.659 -20.799
  164    HB   ILE  24           HB       ILE  24   0.244  -1.436 -20.639
  165   HG12  ILE  24          2HG1      ILE  24   0.111  -0.243 -23.417
  166   HG13  ILE  24          3HG1      ILE  24   0.493   0.635 -21.940
  167   HG21  ILE  24          1HG2      ILE  24   0.928  -3.023 -22.367
  168   HG22  ILE  24          2HG2      ILE  24  -0.634  -3.459 -21.678
  169   HG23  ILE  24          3HG2      ILE  24  -0.554  -2.689 -23.263
  170   HD11  ILE  24          3HD1      ILE  24   2.481  -0.821 -21.661
  171   HD12  ILE  24          1HD1      ILE  24   2.122  -1.536 -23.233
  172   HD13  ILE  24          2HD1      ILE  24   2.520   0.179 -23.114
  173    H    CYS  25           H        CYS  25  -0.493  -0.165 -19.354
  174    HA   CYS  25           HA       CYS  25  -0.750   2.639 -19.704
  175    HB2  CYS  25           2HB      CYS  25  -2.354   3.176 -18.006
  176    HB3  CYS  25           3HB      CYS  25  -3.109   2.020 -19.098
  177    H    ASN  26           H        ASN  26   0.324   3.836 -18.074
  178    HA   ASN  26           HA       ASN  26   1.922   2.171 -16.241
  179    HB2  ASN  26           2HB      ASN  26   3.455   3.042 -17.798
  180    HB3  ASN  26           3HB      ASN  26   2.651   4.608 -17.848
  181   HD21  ASN  26          1HD2      ASN  26   3.773   6.142 -16.918
  182   HD22  ASN  26          2HD2      ASN  26   4.803   5.969 -15.542
  183    H    GLU  27           H        GLU  27  -0.104   4.957 -16.602
  184    HA   GLU  27           HA       GLU  27   0.328   5.671 -13.780
  185    HB2  GLU  27           2HB      GLU  27  -0.288   7.228 -16.203
  186    HB3  GLU  27           3HB      GLU  27  -1.214   7.686 -14.781
  187    HG2  GLU  27           2HG      GLU  27   0.731   8.218 -13.561
  188    HG3  GLU  27           3HG      GLU  27   1.776   7.440 -14.748
  189    HA   PRO  28           HA       PRO  28  -3.690   4.375 -12.592
  190    HB2  PRO  28           2HB      PRO  28  -4.456   6.334 -10.877
  191    HB3  PRO  28           3HB      PRO  28  -3.211   5.144 -10.481
  192    HG2  PRO  28           2HG      PRO  28  -2.900   7.964 -11.437
  193    HG3  PRO  28           3HG      PRO  28  -2.009   7.109 -10.164
  194    HD2  PRO  28           2HD      PRO  28  -1.006   7.472 -12.653
  195    HD3  PRO  28           3HD      PRO  28  -0.632   6.040 -11.672
  196    H    TRP  29           H        TRP  29  -5.527   4.393 -13.711
  197    HA   TRP  29           HA       TRP  29  -7.337   5.088 -14.898
  198    HB2  TRP  29           2HB      TRP  29  -6.874   7.836 -13.737
  199    HB3  TRP  29           3HB      TRP  29  -8.392   7.142 -14.300
  200    HD1  TRP  29           HD1      TRP  29  -7.136   8.143 -11.208
  201    HE1  TRP  29           HE1      TRP  29  -7.898   6.663  -9.245
  202    HE3  TRP  29           HE3      TRP  29  -8.659   4.030 -13.836
  203    HZ2  TRP  29           HZ2      TRP  29  -8.998   4.092  -8.861
  204    HZ3  TRP  29           HZ3      TRP  29  -9.554   2.103 -12.595
  205    HH2  TRP  29           HH2      TRP  29  -9.718   2.135 -10.159
  206    H    GLN  30           H        GLN  30  -5.862   4.757 -16.750
  207    HA   GLN  30           HA       GLN  30  -5.955   7.019 -18.497
  208    HB2  GLN  30           2HB      GLN  30  -3.438   6.317 -17.143
  209    HB3  GLN  30           3HB      GLN  30  -3.308   6.480 -18.890
  210    HG2  GLN  30           2HG      GLN  30  -4.830   8.663 -17.888
  211    HG3  GLN  30           3HG      GLN  30  -3.357   8.512 -16.932
  212   HE21  GLN  30          1HE2      GLN  30  -1.505   9.240 -17.757
  213   HE22  GLN  30          2HE2      GLN  30  -1.289   9.800 -19.377
  214    H    CYS  31           H        CYS  31  -4.668   6.393 -20.622
  215    HA   CYS  31           HA       CYS  31  -4.899   3.517 -21.130
  216    HB2  CYS  31           2HB      CYS  31  -6.296   5.693 -22.691
  217    HB3  CYS  31           3HB      CYS  31  -6.068   4.059 -23.305
  218    H    LEU  32           H        LEU  32  -3.428   2.724 -22.553
  219    HA   LEU  32           HA       LEU  32  -1.846   4.598 -24.148
  220    HB2  LEU  32           2HB      LEU  32  -0.655   2.538 -22.296
  221    HB3  LEU  32           3HB      LEU  32   0.244   3.539 -23.435
  222    HG   LEU  32           HG       LEU  32  -1.264   4.519 -21.011
  223   HD11  LEU  32          1HD1      LEU  32   0.683   4.561 -19.872
  224   HD12  LEU  32          2HD1      LEU  32   1.645   4.906 -21.308
  225   HD13  LEU  32          3HD1      LEU  32   1.106   3.259 -20.984
  226   HD21  LEU  32          3HD2      LEU  32   0.530   6.440 -22.066
  227   HD22  LEU  32          1HD2      LEU  32  -1.225   6.537 -21.928
  228   HD23  LEU  32          2HD2      LEU  32  -0.491   5.874 -23.389
  229    H    CYS  33           H        CYS  33  -2.342   3.870 -26.128
  230    HA   CYS  33           HA       CYS  33  -1.794   1.038 -26.703
  231    HB2  CYS  33           2HB      CYS  33  -3.684   1.107 -28.356
  232    HB3  CYS  33           3HB      CYS  33  -4.187   1.201 -26.671
  233    H    GLU  34           H        GLU  34  -1.507   0.664 -29.099
  234    HA   GLU  34           HA       GLU  34   0.485   2.447 -30.074
  235    HB2  GLU  34           2HB      GLU  34  -0.222  -0.194 -30.546
  236    HB3  GLU  34           3HB      GLU  34  -0.593   0.612 -32.064
  237    HG2  GLU  34           2HG      GLU  34   1.676   1.464 -32.192
  238    HG3  GLU  34           3HG      GLU  34   2.057   0.719 -30.641
  239    H    THR  35           H        THR  35   0.339   3.038 -32.541
  240    HA   THR  35           HA       THR  35  -1.716   4.996 -32.763
  241    HB   THR  35           HB       THR  35   0.200   4.050 -34.904
  242    HG1  THR  35           HG1      THR  35   0.427   6.011 -32.859
  243   HG21  THR  35          3HG2      THR  35  -0.873   5.480 -36.233
  244   HG22  THR  35          1HG2      THR  35  -0.410   6.790 -35.147
  245   HG23  THR  35          2HG2      THR  35  -1.946   5.954 -34.916
  246    H    ASN  36           H        ASN  36  -1.346   1.731 -33.874
  247    HA   ASN  36           HA       ASN  36  -3.028   1.629 -36.058
  248    HB2  ASN  36           2HB      ASN  36  -2.548  -0.388 -33.863
  249    HB3  ASN  36           3HB      ASN  36  -3.518  -0.745 -35.288
  250   HD21  ASN  36          1HD2      ASN  36  -2.177   0.388 -37.304
  251   HD22  ASN  36          2HD2      ASN  36  -0.601  -0.303 -37.462
  252    H    TRP  37           H        TRP  37  -3.826   1.925 -32.674
  253    HA   TRP  37           HA       TRP  37  -6.643   1.425 -33.097
  254    HB2  TRP  37           2HB      TRP  37  -5.305   2.549 -30.631
  255    HB3  TRP  37           3HB      TRP  37  -6.895   1.799 -30.734
  256    HD1  TRP  37           HD1      TRP  37  -3.161   0.843 -31.023
  257    HE1  TRP  37           HE1      TRP  37  -2.920  -1.639 -30.386
  258    HE3  TRP  37           HE3      TRP  37  -8.104  -0.332 -30.456
  259    HZ2  TRP  37           HZ2      TRP  37  -4.603  -3.808 -29.730
  260    HZ3  TRP  37           HZ3      TRP  37  -8.704  -2.633 -29.823
  261    HH2  TRP  37           HH2      TRP  37  -6.988  -4.333 -29.468
  262    H    GLY  38           H        GLY  38  -4.972   4.209 -31.613
  263    HA2  GLY  38           2HA      GLY  38  -5.176   6.469 -32.197
  264    HA3  GLY  38           3HA      GLY  38  -6.438   6.036 -33.342
  265    H    GLY  39           H        GLY  39  -8.247   4.713 -31.778
  266    HA2  GLY  39           2HA      GLY  39  -9.651   6.827 -30.567
  267    HA3  GLY  39           3HA      GLY  39 -10.040   5.121 -30.405
  268    H    GLN  40           H        GLN  40 -10.264   7.140 -28.374
  269    HA   GLN  40           HA       GLN  40  -8.101   7.037 -26.560
  270    HB2  GLN  40           2HB      GLN  40 -10.156   8.638 -26.654
  271    HB3  GLN  40           3HB      GLN  40 -10.940   7.410 -25.668
  272    HG2  GLN  40           2HG      GLN  40  -9.089   7.622 -24.031
  273    HG3  GLN  40           3HG      GLN  40  -8.447   8.953 -24.993
  274   HE21  GLN  40          1HE2      GLN  40  -9.021   9.432 -22.421
  275   HE22  GLN  40          2HE2      GLN  40 -10.439  10.407 -22.276
  276    H    LEU  41           H        LEU  41 -11.063   5.124 -26.862
  277    HA   LEU  41           HA       LEU  41 -10.598   3.562 -24.528
  278    HB2  LEU  41           2HB      LEU  41 -12.241   2.652 -26.862
  279    HB3  LEU  41           3HB      LEU  41 -12.475   2.317 -25.147
  280    HG   LEU  41           HG       LEU  41 -12.999   4.933 -26.556
  281   HD11  LEU  41          1HD1      LEU  41 -15.292   4.063 -25.287
  282   HD12  LEU  41          2HD1      LEU  41 -14.612   2.592 -25.982
  283   HD13  LEU  41          3HD1      LEU  41 -14.955   3.979 -27.016
  284   HD21  LEU  41          3HD2      LEU  41 -14.096   5.346 -24.208
  285   HD22  LEU  41          1HD2      LEU  41 -12.382   5.667 -24.473
  286   HD23  LEU  41          2HD2      LEU  41 -12.887   4.177 -23.675
  287    H    CYS  42           H        CYS  42  -9.502   3.403 -27.803
  288    HA   CYS  42           HA       CYS  42  -8.121   1.979 -28.916
  289    HB2  CYS  42           2HB      CYS  42  -7.288   1.033 -26.168
  290    HB3  CYS  42           3HB      CYS  42  -6.352   0.935 -27.656
  291    H    ASP  43           H        ASP  43 -10.444   0.995 -29.220
  292    HA   ASP  43           HA       ASP  43 -10.319  -1.836 -28.409
  293    HB2  ASP  43           2HB      ASP  43 -12.675  -1.934 -28.318
  294    HB3  ASP  43           3HB      ASP  43 -12.258  -0.418 -27.524
  295    H    LYS  44           H        LYS  44 -11.752  -3.196 -30.003
  296    HA   LYS  44           HA       LYS  44 -10.442  -3.242 -32.472
  297    HB2  LYS  44           2HB      LYS  44 -12.191  -4.867 -33.148
  298    HB3  LYS  44           3HB      LYS  44 -11.484  -5.232 -31.579
  299    HG2  LYS  44           2HG      LYS  44 -13.495  -3.943 -30.617
  300    HG3  LYS  44           3HG      LYS  44 -14.206  -4.170 -32.216
  301    HD2  LYS  44           2HD      LYS  44 -13.040  -6.611 -31.134
  302    HD3  LYS  44           3HD      LYS  44 -14.327  -5.955 -30.119
  303    HE2  LYS  44           2HE      LYS  44 -14.609  -6.369 -33.088
  304    HE3  LYS  44           3HE      LYS  44 -15.054  -7.589 -31.897
  305    HZ1  LYS  44           3HZ      LYS  44 -16.749  -6.248 -31.055
  306    HZ2  LYS  44           1HZ      LYS  44 -16.876  -6.057 -32.732
  307    HZ3  LYS  44           2HZ      LYS  44 -16.155  -4.847 -31.795
  Start of MODEL   16
    1    H1   ARG   1           H        ARG   1   2.520  -2.741  -1.378
    2    HA   ARG   1           HA       ARG   1   2.306  -0.472  -1.208
    3    HB2  ARG   1           2HB      ARG   1   4.712  -0.609  -2.264
    4    HB3  ARG   1           3HB      ARG   1   3.892  -0.020  -3.704
    5    HG2  ARG   1           2HG      ARG   1   3.041   1.892  -2.355
    6    HG3  ARG   1           3HG      ARG   1   4.048   1.329  -1.020
    7    HD2  ARG   1           2HD      ARG   1   6.026   1.815  -2.142
    8    HD3  ARG   1           3HD      ARG   1   5.240   1.824  -3.720
    9    HE   ARG   1           HE       ARG   1   4.182   3.894  -2.138
   10   HH11  ARG   1          1HH1      ARG   1   7.099   3.003  -3.814
   11   HH12  ARG   1          2HH1      ARG   1   7.590   4.640  -4.100
   12   HH21  ARG   1          1HH2      ARG   1   4.817   6.054  -2.508
   13   HH22  ARG   1          2HH2      ARG   1   6.292   6.374  -3.356
   14    H    CYS   2           H        CYS   2   0.152  -1.488  -2.039
   15    HA   CYS   2           HA       CYS   2  -0.847   0.309  -4.068
   16    HB2  CYS   2           2HB      CYS   2  -1.915  -1.611  -5.345
   17    HB3  CYS   2           3HB      CYS   2  -0.180  -1.408  -5.563
   18    H    GLN   3           H        GLN   3  -3.200   0.268  -4.219
   19    HA   GLN   3           HA       GLN   3  -4.792  -1.290  -2.471
   20    HB2  GLN   3           2HB      GLN   3  -3.503   0.931  -1.265
   21    HB3  GLN   3           3HB      GLN   3  -5.207   1.339  -1.420
   22    HG2  GLN   3           2HG      GLN   3  -5.828  -0.119   0.155
   23    HG3  GLN   3           3HG      GLN   3  -4.709  -1.359  -0.410
   24   HE21  GLN   3          1HE2      GLN   3  -3.072  -1.820   0.868
   25   HE22  GLN   3          2HE2      GLN   3  -2.442  -0.811   2.121
   26    H    TYR   4           H        TYR   4  -4.714   2.062  -3.698
   27    HA   TYR   4           HA       TYR   4  -7.380   1.606  -4.855
   28    HB2  TYR   4           2HB      TYR   4  -7.056   3.489  -3.192
   29    HB3  TYR   4           3HB      TYR   4  -6.038   4.273  -4.395
   30    HD1  TYR   4           HD2      TYR   4  -9.224   2.399  -4.864
   31    HD2  TYR   4           HD1      TYR   4  -7.241   6.160  -5.048
   32    HE1  TYR   4           HE2      TYR   4 -11.221   3.395  -5.898
   33    HE2  TYR   4           HE1      TYR   4  -9.233   7.166  -6.081
   34    HH   TYR   4           HH       TYR   4 -11.630   6.761  -6.236
   35    H    GLY   5           H        GLY   5  -7.760   1.918  -7.004
   36    HA2  GLY   5           2HA      GLY   5  -7.325   2.243  -9.239
   37    HA3  GLY   5           3HA      GLY   5  -5.974   3.260  -8.760
   38    H    TRP   6           H        TRP   6  -6.110   0.014  -7.581
   39    HA   TRP   6           HA       TRP   6  -4.466  -1.047  -9.717
   40    HB2  TRP   6           2HB      TRP   6  -3.391  -0.598  -6.931
   41    HB3  TRP   6           3HB      TRP   6  -2.666  -1.731  -8.069
   42    HD1  TRP   6           HD1      TRP   6  -2.177   1.640  -6.901
   43    HE1  TRP   6           HE1      TRP   6  -0.883   3.072  -8.605
   44    HE3  TRP   6           HE3      TRP   6  -2.661  -1.356 -11.015
   45    HZ2  TRP   6           HZ2      TRP   6  -0.164   2.948 -11.331
   46    HZ3  TRP   6           HZ3      TRP   6  -1.641  -0.627 -13.132
   47    HH2  TRP   6           HH2      TRP   6  -0.419   1.481 -13.285
   48    H    GLN   7           H        GLN   7  -5.914  -2.682 -10.039
   49    HA   GLN   7           HA       GLN   7  -6.555  -4.410  -7.753
   50    HB2  GLN   7           2HB      GLN   7  -8.404  -5.245  -9.035
   51    HB3  GLN   7           3HB      GLN   7  -8.437  -3.488  -9.113
   52    HG2  GLN   7           2HG      GLN   7  -7.547  -3.503 -11.331
   53    HG3  GLN   7           3HG      GLN   7  -7.270  -5.242 -11.258
   54   HE21  GLN   7          1HE2      GLN   7  -9.542  -6.243 -10.287
   55   HE22  GLN   7          2HE2      GLN   7 -10.876  -5.888 -11.325
   56    H    GLY   8           H        GLY   8  -7.121  -6.773  -8.949
   57    HA2  GLY   8           2HA      GLY   8  -6.210  -8.491 -10.320
   58    HA3  GLY   8           3HA      GLY   8  -4.748  -7.533 -10.499
   59    H    LEU   9           H        LEU   9  -3.557  -9.451  -9.970
   60    HA   LEU   9           HA       LEU   9  -3.787 -10.390  -7.212
   61    HB2  LEU   9           2HB      LEU   9  -3.501 -11.846  -9.374
   62    HB3  LEU   9           3HB      LEU   9  -1.796 -11.458  -9.160
   63    HG   LEU   9           HG       LEU   9  -2.244 -12.359  -6.723
   64   HD11  LEU   9          1HD1      LEU   9  -4.339 -13.783  -8.357
   65   HD12  LEU   9          2HD1      LEU   9  -4.643 -12.669  -7.025
   66   HD13  LEU   9          3HD1      LEU   9  -3.837 -14.208  -6.721
   67   HD21  LEU   9          3HD2      LEU   9  -0.707 -13.723  -7.573
   68   HD22  LEU   9          1HD2      LEU   9  -1.343 -13.527  -9.206
   69   HD23  LEU   9          2HD2      LEU   9  -2.029 -14.748  -8.133
   70    H    TYR  10           H        TYR  10  -1.157  -9.408  -9.418
   71    HA   TYR  10           HA       TYR  10   0.456  -8.664  -7.093
   72    HB2  TYR  10           2HB      TYR  10   1.062  -9.294  -9.952
   73    HB3  TYR  10           3HB      TYR  10   2.184  -8.283  -9.049
   74    HD1  TYR  10           HD2      TYR  10   0.287 -11.468  -8.527
   75    HD2  TYR  10           HD1      TYR  10   3.961  -9.371  -8.076
   76    HE1  TYR  10           HE2      TYR  10   1.311 -13.483  -7.557
   77    HE2  TYR  10           HE1      TYR  10   4.996 -11.381  -7.105
   78    HH   TYR  10           HH       TYR  10   4.245 -13.446  -5.917
   79    H    CYS  11           H        CYS  11  -1.859  -7.096  -8.120
   80    HA   CYS  11           HA       CYS  11  -2.445  -4.940  -8.567
   81    HB2  CYS  11           2HB      CYS  11   0.191  -4.535  -7.149
   82    HB3  CYS  11           3HB      CYS  11  -0.886  -3.208  -7.573
   83    H    ASP  12           H        ASP  12  -1.809  -5.906 -10.858
   84    HA   ASP  12           HA       ASP  12   0.024  -3.956 -12.092
   85    HB2  ASP  12           2HB      ASP  12   0.502  -6.622 -12.032
   86    HB3  ASP  12           3HB      ASP  12  -0.429  -6.504 -13.522
   87    H    LYS  13           H        LYS  13  -2.865  -3.791 -11.636
   88    HA   LYS  13           HA       LYS  13  -3.650  -3.294 -14.407
   89    HB2  LYS  13           2HB      LYS  13  -4.896  -5.247 -12.581
   90    HB3  LYS  13           3HB      LYS  13  -6.020  -4.170 -13.398
   91    HG2  LYS  13           2HG      LYS  13  -5.418  -4.947 -15.511
   92    HG3  LYS  13           3HG      LYS  13  -3.915  -5.659 -14.922
   93    HD2  LYS  13           2HD      LYS  13  -5.127  -7.383 -13.760
   94    HD3  LYS  13           3HD      LYS  13  -6.669  -6.617 -14.147
   95    HE2  LYS  13           2HE      LYS  13  -6.419  -8.413 -15.666
   96    HE3  LYS  13           3HE      LYS  13  -6.081  -6.944 -16.580
   97    HZ1  LYS  13           3HZ      LYS  13  -4.514  -8.973 -16.789
   98    HZ2  LYS  13           1HZ      LYS  13  -3.867  -8.420 -15.326
   99    HZ3  LYS  13           2HZ      LYS  13  -3.849  -7.420 -16.690
  100    H    CYS  14           H        CYS  14  -4.398  -1.293 -14.595
  101    HA   CYS  14           HA       CYS  14  -5.240   0.133 -12.181
  102    HB2  CYS  14           2HB      CYS  14  -4.813   2.160 -13.375
  103    HB3  CYS  14           3HB      CYS  14  -3.457   1.082 -13.686
  104    H    ILE  15           H        ILE  15  -6.918  -1.822 -13.685
  105    HA   ILE  15           HA       ILE  15  -9.051  -2.060 -14.453
  106    HB   ILE  15           HB       ILE  15  -9.834   0.526 -13.190
  107   HG12  ILE  15          2HG1      ILE  15  -8.927  -1.932 -11.678
  108   HG13  ILE  15          3HG1      ILE  15  -8.178  -0.340 -11.633
  109   HG21  ILE  15          1HG2      ILE  15 -11.146  -2.076 -12.642
  110   HG22  ILE  15          2HG2      ILE  15 -11.851  -0.478 -12.876
  111   HG23  ILE  15          3HG2      ILE  15 -11.296  -1.408 -14.267
  112   HD11  ILE  15          3HD1      ILE  15  -9.410   0.039  -9.832
  113   HD12  ILE  15          1HD1      ILE  15 -10.796   0.147 -10.916
  114   HD13  ILE  15          2HD1      ILE  15 -10.412  -1.382 -10.126
  115    HA   PRO  16           HA       PRO  16  -8.412   0.951 -17.910
  116    HB2  PRO  16           2HB      PRO  16  -8.575  -0.923 -19.867
  117    HB3  PRO  16           3HB      PRO  16  -7.069  -0.541 -19.026
  118    HG2  PRO  16           2HG      PRO  16  -8.975  -2.803 -18.566
  119    HG3  PRO  16           3HG      PRO  16  -7.202  -2.824 -18.603
  120    HD2  PRO  16           2HD      PRO  16  -8.611  -2.808 -16.290
  121    HD3  PRO  16           3HD      PRO  16  -7.022  -2.031 -16.446
  122    H    HIS  17           H        HIS  17 -10.773  -1.502 -17.178
  123    HA   HIS  17           HA       HIS  17 -12.672  -1.180 -19.130
  124    HB2  HIS  17           2HB      HIS  17 -12.655  -2.066 -16.350
  125    HB3  HIS  17           3HB      HIS  17 -14.194  -1.350 -16.820
  126    HD1  HIS  17           HD1      HIS  17 -15.432  -3.595 -16.786
  127    HD2  HIS  17           HD2      HIS  17 -12.203  -3.505 -19.399
  128    HE1  HIS  17           HE1      HIS  17 -15.656  -5.660 -18.203
  129    HA   PRO  18           HA       PRO  18 -14.688   2.521 -16.797
  130    HB2  PRO  18           2HB      PRO  18 -13.391   3.512 -14.628
  131    HB3  PRO  18           3HB      PRO  18 -14.575   2.203 -14.525
  132    HG2  PRO  18           2HG      PRO  18 -11.585   2.055 -14.563
  133    HG3  PRO  18           3HG      PRO  18 -12.736   1.166 -13.549
  134    HD2  PRO  18           2HD      PRO  18 -11.576   0.073 -15.738
  135    HD3  PRO  18           3HD      PRO  18 -13.216  -0.358 -15.211
  136    H    GLY  19           H        GLY  19 -13.747   3.307 -18.837
  137    HA2  GLY  19           2HA      GLY  19 -12.998   5.616 -19.368
  138    HA3  GLY  19           3HA      GLY  19 -11.607   5.287 -18.345
  139    H    CYS  20           H        CYS  20 -12.656   2.657 -20.252
  140    HA   CYS  20           HA       CYS  20 -11.399   3.170 -22.692
  141    HB2  CYS  20           2HB      CYS  20  -9.519   2.859 -20.658
  142    HB3  CYS  20           3HB      CYS  20  -9.554   1.291 -21.460
  143    H    VAL  21           H        VAL  21 -10.489   0.802 -23.539
  144    HA   VAL  21           HA       VAL  21 -12.605  -1.130 -22.846
  145    HB   VAL  21           HB       VAL  21 -11.488  -0.729 -25.621
  146   HG11  VAL  21          1HG1      VAL  21 -14.085  -2.049 -25.134
  147   HG12  VAL  21          2HG1      VAL  21 -12.823  -2.421 -26.310
  148   HG13  VAL  21          3HG1      VAL  21 -12.647  -2.937 -24.632
  149   HG21  VAL  21          3HG2      VAL  21 -12.757   1.249 -24.903
  150   HG22  VAL  21          1HG2      VAL  21 -13.587   0.364 -26.183
  151   HG23  VAL  21          2HG2      VAL  21 -14.132   0.216 -24.512
  152    H    HIS  22           H        HIS  22  -9.569  -0.945 -24.717
  153    HA   HIS  22           HA       HIS  22  -8.647  -3.347 -23.292
  154    HB2  HIS  22           2HB      HIS  22  -8.133  -2.862 -26.227
  155    HB3  HIS  22           3HB      HIS  22  -7.798  -4.323 -25.301
  156    HD1  HIS  22           HD1      HIS  22 -10.327  -5.111 -24.064
  157    HD2  HIS  22           HD2      HIS  22 -10.239  -3.355 -27.829
  158    HE1  HIS  22           HE1      HIS  22 -12.484  -5.782 -25.170
  159    H    GLY  23           H        GLY  23  -6.159  -3.625 -24.330
  160    HA2  GLY  23           2HA      GLY  23  -4.088  -2.539 -24.661
  161    HA3  GLY  23           3HA      GLY  23  -4.833  -1.022 -24.181
  162    H    ILE  24           H        ILE  24  -2.588  -1.173 -23.034
  163    HA   ILE  24           HA       ILE  24  -3.012  -2.379 -20.378
  164    HB   ILE  24           HB       ILE  24  -0.578  -2.458 -20.117
  165   HG12  ILE  24          2HG1      ILE  24  -0.471  -1.566 -23.007
  166   HG13  ILE  24          3HG1      ILE  24  -0.063  -0.553 -21.626
  167   HG21  ILE  24          1HG2      ILE  24  -1.434  -3.796 -22.679
  168   HG22  ILE  24          2HG2      ILE  24  -0.151  -4.313 -21.586
  169   HG23  ILE  24          3HG2      ILE  24  -1.834  -4.378 -21.063
  170   HD11  ILE  24          3HD1      ILE  24   1.936  -1.411 -22.664
  171   HD12  ILE  24          1HD1      ILE  24   1.750  -2.101 -21.053
  172   HD13  ILE  24          2HD1      ILE  24   1.356  -3.065 -22.476
  173    H    CYS  25           H        CYS  25  -1.267  -1.171 -18.820
  174    HA   CYS  25           HA       CYS  25  -1.058   1.648 -19.198
  175    HB2  CYS  25           2HB      CYS  25  -2.584   2.377 -17.452
  176    HB3  CYS  25           3HB      CYS  25  -3.472   1.474 -18.676
  177    H    ASN  26           H        ASN  26   0.276   2.620 -17.680
  178    HA   ASN  26           HA       ASN  26   1.399   0.813 -15.640
  179    HB2  ASN  26           2HB      ASN  26   3.578   1.730 -16.023
  180    HB3  ASN  26           3HB      ASN  26   2.917   1.291 -17.596
  181   HD21  ASN  26          1HD2      ASN  26   4.672   3.537 -16.112
  182   HD22  ASN  26          2HD2      ASN  26   4.274   4.931 -17.053
  183    H    GLU  27           H        GLU  27  -0.764   2.855 -15.481
  184    HA   GLU  27           HA       GLU  27   0.210   4.178 -13.101
  185    HB2  GLU  27           2HB      GLU  27  -0.204   5.602 -15.640
  186    HB3  GLU  27           3HB      GLU  27  -1.029   6.322 -14.264
  187    HG2  GLU  27           2HG      GLU  27   0.977   6.688 -13.110
  188    HG3  GLU  27           3HG      GLU  27   1.879   5.603 -14.166
  189    HA   PRO  28           HA       PRO  28  -3.923   3.665 -11.726
  190    HB2  PRO  28           2HB      PRO  28  -4.304   5.861 -10.177
  191    HB3  PRO  28           3HB      PRO  28  -3.257   4.520  -9.701
  192    HG2  PRO  28           2HG      PRO  28  -2.524   7.160 -10.908
  193    HG3  PRO  28           3HG      PRO  28  -1.741   6.280  -9.582
  194    HD2  PRO  28           2HD      PRO  28  -0.776   6.262 -12.111
  195    HD3  PRO  28           3HD      PRO  28  -0.607   4.876 -11.015
  196    H    TRP  29           H        TRP  29  -5.683   3.850 -12.950
  197    HA   TRP  29           HA       TRP  29  -7.375   4.719 -14.196
  198    HB2  TRP  29           2HB      TRP  29  -6.596   7.386 -13.005
  199    HB3  TRP  29           3HB      TRP  29  -8.153   6.949 -13.702
  200    HD1  TRP  29           HD1      TRP  29  -6.951   7.657 -10.488
  201    HE1  TRP  29           HE1      TRP  29  -8.115   6.305  -8.633
  202    HE3  TRP  29           HE3      TRP  29  -9.027   3.967 -13.354
  203    HZ2  TRP  29           HZ2      TRP  29  -9.704   3.982  -8.414
  204    HZ3  TRP  29           HZ3      TRP  29 -10.354   2.218 -12.244
  205    HH2  TRP  29           HH2      TRP  29 -10.684   2.227  -9.825
  206    H    GLN  30           H        GLN  30  -5.705   4.173 -15.918
  207    HA   GLN  30           HA       GLN  30  -5.527   6.437 -17.713
  208    HB2  GLN  30           2HB      GLN  30  -3.211   5.412 -16.275
  209    HB3  GLN  30           3HB      GLN  30  -2.995   5.341 -18.018
  210    HG2  GLN  30           2HG      GLN  30  -4.084   7.860 -17.505
  211    HG3  GLN  30           3HG      GLN  30  -2.876   7.598 -16.248
  212   HE21  GLN  30          1HE2      GLN  30  -0.853   8.062 -16.734
  213   HE22  GLN  30          2HE2      GLN  30  -0.207   8.242 -18.326
  214    H    CYS  31           H        CYS  31  -4.325   5.599 -19.824
  215    HA   CYS  31           HA       CYS  31  -4.838   2.797 -20.365
  216    HB2  CYS  31           2HB      CYS  31  -6.985   4.265 -20.730
  217    HB3  CYS  31           3HB      CYS  31  -6.164   4.747 -22.211
  218    H    LEU  32           H        LEU  32  -3.733   2.017 -22.151
  219    HA   LEU  32           HA       LEU  32  -2.265   3.895 -23.828
  220    HB2  LEU  32           2HB      LEU  32  -0.858   1.691 -22.333
  221    HB3  LEU  32           3HB      LEU  32  -0.128   2.870 -23.421
  222    HG   LEU  32           HG       LEU  32  -1.448   3.616 -20.818
  223   HD11  LEU  32          1HD1      LEU  32   0.589   3.512 -19.716
  224   HD12  LEU  32          2HD1      LEU  32   1.513   3.444 -21.216
  225   HD13  LEU  32          3HD1      LEU  32   0.590   2.039 -20.685
  226   HD21  LEU  32          3HD2      LEU  32   0.640   5.347 -21.751
  227   HD22  LEU  32          1HD2      LEU  32  -1.056   5.713 -21.430
  228   HD23  LEU  32          2HD2      LEU  32  -0.567   5.120 -23.018
  229    H    CYS  33           H        CYS  33  -1.454   2.968 -25.767
  230    HA   CYS  33           HA       CYS  33  -1.780   0.213 -26.394
  231    HB2  CYS  33           2HB      CYS  33  -3.545   0.622 -28.183
  232    HB3  CYS  33           3HB      CYS  33  -4.111   0.616 -26.516
  233    H    GLU  34           H        GLU  34  -0.979  -0.321 -28.465
  234    HA   GLU  34           HA       GLU  34   1.089   1.309 -29.410
  235    HB2  GLU  34           2HB      GLU  34   0.008  -1.277 -30.007
  236    HB3  GLU  34           3HB      GLU  34   0.301  -0.419 -31.513
  237    HG2  GLU  34           2HG      GLU  34   2.325  -1.407 -31.229
  238    HG3  GLU  34           3HG      GLU  34   2.612   0.109 -30.376
  239    H    THR  35           H        THR  35   1.307   2.094 -31.688
  240    HA   THR  35           HA       THR  35  -0.683   4.025 -32.236
  241    HB   THR  35           HB       THR  35   1.550   3.075 -34.043
  242    HG1  THR  35           HG1      THR  35   2.600   3.920 -32.354
  243   HG21  THR  35          3HG2      THR  35  -0.522   5.128 -34.306
  244   HG22  THR  35          1HG2      THR  35   0.500   4.386 -35.537
  245   HG23  THR  35          2HG2      THR  35   1.115   5.727 -34.571
  246    H    ASN  36           H        ASN  36  -0.262   0.753 -33.241
  247    HA   ASN  36           HA       ASN  36  -2.017   1.006 -35.537
  248    HB2  ASN  36           2HB      ASN  36  -0.587  -1.331 -34.271
  249    HB3  ASN  36           3HB      ASN  36  -1.720  -1.526 -35.605
  250   HD21  ASN  36          1HD2      ASN  36  -1.210  -0.599 -37.628
  251   HD22  ASN  36          2HD2      ASN  36   0.426  -0.243 -38.054
  252    H    TRP  37           H        TRP  37  -3.442   1.906 -33.496
  253    HA   TRP  37           HA       TRP  37  -5.417  -0.217 -33.079
  254    HB2  TRP  37           2HB      TRP  37  -3.950   1.278 -30.981
  255    HB3  TRP  37           3HB      TRP  37  -5.683   1.083 -30.731
  256    HD1  TRP  37           HD1      TRP  37  -2.455  -0.973 -31.018
  257    HE1  TRP  37           HE1      TRP  37  -2.878  -3.300 -30.003
  258    HE3  TRP  37           HE3      TRP  37  -7.489  -0.602 -30.207
  259    HZ2  TRP  37           HZ2      TRP  37  -5.057  -4.782 -28.992
  260    HZ3  TRP  37           HZ3      TRP  37  -8.668  -2.520 -29.213
  261    HH2  TRP  37           HH2      TRP  37  -7.475  -4.566 -28.619
  262    H    GLY  38           H        GLY  38  -4.899   3.226 -32.266
  263    HA2  GLY  38           2HA      GLY  38  -6.090   5.076 -33.028
  264    HA3  GLY  38           3HA      GLY  38  -7.130   3.995 -33.945
  265    H    GLY  39           H        GLY  39  -8.460   5.933 -32.824
  266    HA2  GLY  39           2HA      GLY  39 -10.391   6.167 -31.561
  267    HA3  GLY  39           3HA      GLY  39 -10.074   4.593 -30.846
  268    H    GLN  40           H        GLN  40 -11.021   6.599 -29.269
  269    HA   GLN  40           HA       GLN  40  -8.742   7.786 -27.889
  270    HB2  GLN  40           2HB      GLN  40 -10.917   9.031 -28.410
  271    HB3  GLN  40           3HB      GLN  40 -11.642   8.073 -27.126
  272    HG2  GLN  40           2HG      GLN  40 -10.234   9.033 -25.487
  273    HG3  GLN  40           3HG      GLN  40  -9.204   9.775 -26.710
  274   HE21  GLN  40          1HE2      GLN  40 -10.054  11.398 -24.820
  275   HE22  GLN  40          2HE2      GLN  40 -11.312  12.441 -25.381
  276    H    LEU  41           H        LEU  41 -10.997   5.183 -27.576
  277    HA   LEU  41           HA       LEU  41 -10.191   4.714 -24.796
  278    HB2  LEU  41           2HB      LEU  41 -12.266   3.187 -26.341
  279    HB3  LEU  41           3HB      LEU  41 -12.053   3.273 -24.594
  280    HG   LEU  41           HG       LEU  41 -13.008   5.526 -26.360
  281   HD11  LEU  41          1HD1      LEU  41 -14.685   3.807 -26.208
  282   HD12  LEU  41          2HD1      LEU  41 -15.157   5.168 -25.190
  283   HD13  LEU  41          3HD1      LEU  41 -14.483   3.712 -24.458
  284   HD21  LEU  41          3HD2      LEU  41 -13.419   6.729 -24.319
  285   HD22  LEU  41          1HD2      LEU  41 -11.727   6.235 -24.358
  286   HD23  LEU  41          2HD2      LEU  41 -12.879   5.356 -23.352
  287    H    CYS  42           H        CYS  42  -8.540   4.213 -27.251
  288    HA   CYS  42           HA       CYS  42  -7.145   2.630 -28.109
  289    HB2  CYS  42           2HB      CYS  42  -7.483   1.759 -25.252
  290    HB3  CYS  42           3HB      CYS  42  -6.465   0.842 -26.358
  291    H    ASP  43           H        ASP  43  -9.925   2.247 -28.645
  292    HA   ASP  43           HA       ASP  43 -10.300  -0.649 -28.519
  293    HB2  ASP  43           2HB      ASP  43 -12.245   0.612 -27.906
  294    HB3  ASP  43           3HB      ASP  43 -12.128   1.605 -29.356
  295    H    LYS  44           H        LYS  44 -10.567  -1.939 -30.345
  296    HA   LYS  44           HA       LYS  44 -10.026  -2.695 -32.423
  297    HB2  LYS  44           2HB      LYS  44 -10.933   0.082 -33.205
  298    HB3  LYS  44           3HB      LYS  44 -10.721  -1.265 -34.316
  299    HG2  LYS  44           2HG      LYS  44 -12.641  -1.277 -31.999
  300    HG3  LYS  44           3HG      LYS  44 -13.076  -0.841 -33.653
  301    HD2  LYS  44           2HD      LYS  44 -11.645  -3.381 -33.451
  302    HD3  LYS  44           3HD      LYS  44 -13.184  -3.366 -32.586
  303    HE2  LYS  44           2HE      LYS  44 -14.403  -3.194 -34.487
  304    HE3  LYS  44           3HE      LYS  44 -13.195  -2.198 -35.299
  305    HZ1  LYS  44           3HZ      LYS  44 -13.677  -4.800 -35.831
  306    HZ2  LYS  44           1HZ      LYS  44 -12.332  -4.899 -34.810
  307    HZ3  LYS  44           2HZ      LYS  44 -12.252  -3.979 -36.226
  Start of MODEL   17
    1    H1   ARG   1           H        ARG   1  -1.057  -3.333   1.000
    2    HA   ARG   1           HA       ARG   1   0.914  -1.231   1.429
    3    HB2  ARG   1           2HB      ARG   1   1.437  -3.659   0.726
    4    HB3  ARG   1           3HB      ARG   1   0.893  -3.167  -0.872
    5    HG2  ARG   1           2HG      ARG   1   3.001  -2.564  -1.235
    6    HG3  ARG   1           3HG      ARG   1   2.663  -1.181  -0.192
    7    HD2  ARG   1           2HD      ARG   1   3.459  -3.757   1.069
    8    HD3  ARG   1           3HD      ARG   1   4.701  -2.793   0.270
    9    HE   ARG   1           HE       ARG   1   3.418  -1.012   1.875
   10   HH11  ARG   1          1HH1      ARG   1   4.956  -4.092   2.395
   11   HH12  ARG   1          2HH1      ARG   1   5.435  -3.726   4.019
   12   HH21  ARG   1          1HH2      ARG   1   4.043  -0.518   4.013
   13   HH22  ARG   1          2HH2      ARG   1   4.914  -1.693   4.939
   14    H    CYS   2           H        CYS   2  -1.005  -2.378  -1.356
   15    HA   CYS   2           HA       CYS   2  -1.343   0.430  -2.165
   16    HB2  CYS   2           2HB      CYS   2  -1.165  -0.364  -4.552
   17    HB3  CYS   2           3HB      CYS   2   0.339  -0.415  -3.638
   18    H    GLN   3           H        GLN   3  -3.415   0.952  -2.301
   19    HA   GLN   3           HA       GLN   3  -5.334  -0.927  -3.410
   20    HB2  GLN   3           2HB      GLN   3  -5.177  -1.182  -0.840
   21    HB3  GLN   3           3HB      GLN   3  -5.996   0.373  -0.783
   22    HG2  GLN   3           2HG      GLN   3  -7.849  -0.568  -2.083
   23    HG3  GLN   3           3HG      GLN   3  -7.032  -2.131  -2.093
   24   HE21  GLN   3          1HE2      GLN   3  -9.451  -2.231  -1.140
   25   HE22  GLN   3          2HE2      GLN   3  -9.483  -2.325   0.585
   26    H    TYR   4           H        TYR   4  -4.494   1.234  -4.718
   27    HA   TYR   4           HA       TYR   4  -6.886   2.818  -4.931
   28    HB2  TYR   4           2HB      TYR   4  -5.147   3.821  -3.141
   29    HB3  TYR   4           3HB      TYR   4  -4.478   4.523  -4.609
   30    HD1  TYR   4           HD1      TYR   4  -6.594   5.364  -6.229
   31    HD2  TYR   4           HD2      TYR   4  -6.471   5.296  -1.977
   32    HE1  TYR   4           HE1      TYR   4  -8.293   7.141  -6.158
   33    HE2  TYR   4           HE2      TYR   4  -8.171   7.071  -1.894
   34    HH   TYR   4           HH       TYR   4  -9.535   8.450  -4.872
   35    H    GLY   5           H        GLY   5  -7.139   2.406  -7.052
   36    HA2  GLY   5           2HA      GLY   5  -6.817   2.738  -9.313
   37    HA3  GLY   5           3HA      GLY   5  -5.400   3.702  -8.922
   38    H    TRP   6           H        TRP   6  -5.591   0.511  -7.629
   39    HA   TRP   6           HA       TRP   6  -4.050  -0.639  -9.816
   40    HB2  TRP   6           2HB      TRP   6  -2.977  -0.371  -7.001
   41    HB3  TRP   6           3HB      TRP   6  -2.280  -1.429  -8.225
   42    HD1  TRP   6           HD1      TRP   6  -1.788   1.876  -6.817
   43    HE1  TRP   6           HE1      TRP   6  -0.418   3.383  -8.391
   44    HE3  TRP   6           HE3      TRP   6  -2.140  -0.893 -11.100
   45    HZ2  TRP   6           HZ2      TRP   6   0.404   3.396 -11.091
   46    HZ3  TRP   6           HZ3      TRP   6  -1.033  -0.063 -13.135
   47    HH2  TRP   6           HH2      TRP   6   0.211   2.037 -13.129
   48    H    GLN   7           H        GLN   7  -5.218  -2.400 -10.234
   49    HA   GLN   7           HA       GLN   7  -6.070  -4.073  -7.963
   50    HB2  GLN   7           2HB      GLN   7  -8.009  -4.727  -9.162
   51    HB3  GLN   7           3HB      GLN   7  -7.909  -2.977  -9.311
   52    HG2  GLN   7           2HG      GLN   7  -6.906  -3.255 -11.544
   53    HG3  GLN   7           3HG      GLN   7  -7.110  -4.999 -11.392
   54   HE21  GLN   7          1HE2      GLN   7  -8.262  -4.186 -13.501
   55   HE22  GLN   7          2HE2      GLN   7  -9.967  -3.959 -13.334
   56    H    GLY   8           H        GLY   8  -6.777  -6.360  -9.236
   57    HA2  GLY   8           2HA      GLY   8  -5.919  -7.958 -10.852
   58    HA3  GLY   8           3HA      GLY   8  -4.351  -7.178 -10.704
   59    H    LEU   9           H        LEU   9  -3.665  -9.449 -10.375
   60    HA   LEU   9           HA       LEU   9  -4.409 -10.965  -8.141
   61    HB2  LEU   9           2HB      LEU   9  -2.924 -11.502 -10.248
   62    HB3  LEU   9           3HB      LEU   9  -1.611 -11.059  -9.159
   63    HG   LEU   9           HG       LEU   9  -2.928 -12.832  -7.613
   64   HD11  LEU   9          1HD1      LEU   9  -4.400 -13.143  -9.788
   65   HD12  LEU   9          2HD1      LEU   9  -3.985 -14.501  -8.744
   66   HD13  LEU   9          3HD1      LEU   9  -3.079 -14.223 -10.231
   67   HD21  LEU   9          3HD2      LEU   9  -1.064 -13.955  -9.641
   68   HD22  LEU   9          1HD2      LEU   9  -1.088 -14.157  -7.889
   69   HD23  LEU   9          2HD2      LEU   9  -0.484 -12.658  -8.594
   70    H    TYR  10           H        TYR  10  -2.011  -8.423  -8.535
   71    HA   TYR  10           HA       TYR  10  -1.773  -8.269  -5.623
   72    HB2  TYR  10           2HB      TYR  10   0.415  -8.860  -7.538
   73    HB3  TYR  10           3HB      TYR  10   0.778  -7.703  -6.261
   74    HD1  TYR  10           HD1      TYR  10  -0.632 -11.117  -6.779
   75    HD2  TYR  10           HD2      TYR  10   1.451  -8.474  -4.175
   76    HE1  TYR  10           HE1      TYR  10  -0.237 -12.976  -5.217
   77    HE2  TYR  10           HE2      TYR  10   1.852 -10.326  -2.607
   78    HH   TYR  10           HH       TYR  10   1.662 -12.516  -2.256
   79    H    CYS  11           H        CYS  11  -0.076  -6.694  -8.323
   80    HA   CYS  11           HA       CYS  11  -1.573  -4.308  -8.274
   81    HB2  CYS  11           2HB      CYS  11   0.471  -4.554  -6.233
   82    HB3  CYS  11           3HB      CYS  11   0.816  -3.209  -7.316
   83    H    ASP  12           H        ASP  12  -1.387  -3.802 -10.348
   84    HA   ASP  12           HA       ASP  12   1.007  -2.936 -11.518
   85    HB2  ASP  12           2HB      ASP  12   0.655  -5.772 -11.592
   86    HB3  ASP  12           3HB      ASP  12   0.496  -5.146 -13.231
   87    H    LYS  13           H        LYS  13  -2.198  -4.292 -11.996
   88    HA   LYS  13           HA       LYS  13  -2.563  -2.954 -14.535
   89    HB2  LYS  13           2HB      LYS  13  -4.166  -4.809 -12.841
   90    HB3  LYS  13           3HB      LYS  13  -5.030  -3.786 -13.982
   91    HG2  LYS  13           2HG      LYS  13  -2.912  -4.856 -15.440
   92    HG3  LYS  13           3HG      LYS  13  -3.514  -6.188 -14.450
   93    HD2  LYS  13           2HD      LYS  13  -5.851  -5.216 -15.286
   94    HD3  LYS  13           3HD      LYS  13  -4.843  -4.684 -16.634
   95    HE2  LYS  13           2HE      LYS  13  -4.750  -6.745 -17.466
   96    HE3  LYS  13           3HE      LYS  13  -4.241  -7.409 -15.914
   97    HZ1  LYS  13           3HZ      LYS  13  -6.769  -7.083 -15.372
   98    HZ2  LYS  13           1HZ      LYS  13  -6.224  -8.464 -16.185
   99    HZ3  LYS  13           2HZ      LYS  13  -6.930  -7.195 -17.053
  100    H    CYS  14           H        CYS  14  -3.437  -1.006 -14.852
  101    HA   CYS  14           HA       CYS  14  -4.338   0.493 -12.508
  102    HB2  CYS  14           2HB      CYS  14  -3.953   2.477 -13.783
  103    HB3  CYS  14           3HB      CYS  14  -2.574   1.417 -14.054
  104    H    ILE  15           H        ILE  15  -5.983  -1.559 -13.870
  105    HA   ILE  15           HA       ILE  15  -8.122  -1.887 -14.584
  106    HB   ILE  15           HB       ILE  15  -8.916   0.815 -13.597
  107   HG12  ILE  15          2HG1      ILE  15  -8.016  -1.478 -11.840
  108   HG13  ILE  15          3HG1      ILE  15  -7.266   0.111 -11.954
  109   HG21  ILE  15          1HG2      ILE  15 -10.936  -0.151 -13.201
  110   HG22  ILE  15          2HG2      ILE  15 -10.369  -1.224 -14.480
  111   HG23  ILE  15          3HG2      ILE  15 -10.232  -1.716 -12.792
  112   HD11  ILE  15          3HD1      ILE  15  -9.818   0.760 -11.288
  113   HD12  ILE  15          1HD1      ILE  15  -9.600  -0.767 -10.434
  114   HD13  ILE  15          2HD1      ILE  15  -8.488   0.571 -10.146
  115    HA   PRO  16           HA       PRO  16  -7.492   0.747 -18.338
  116    HB2  PRO  16           2HB      PRO  16  -7.642  -1.324 -20.087
  117    HB3  PRO  16           3HB      PRO  16  -6.139  -0.848 -19.289
  118    HG2  PRO  16           2HG      PRO  16  -8.035  -3.058 -18.595
  119    HG3  PRO  16           3HG      PRO  16  -6.262  -3.074 -18.628
  120    HD2  PRO  16           2HD      PRO  16  -7.675  -2.822 -16.331
  121    HD3  PRO  16           3HD      PRO  16  -6.090  -2.058 -16.566
  122    H    HIS  17           H        HIS  17  -9.841  -1.632 -17.359
  123    HA   HIS  17           HA       HIS  17 -11.739  -1.529 -19.334
  124    HB2  HIS  17           2HB      HIS  17 -11.725  -2.103 -16.471
  125    HB3  HIS  17           3HB      HIS  17 -13.266  -1.455 -17.024
  126    HD1  HIS  17           HD1      HIS  17 -14.694  -3.500 -17.092
  127    HD2  HIS  17           HD2      HIS  17 -11.042  -4.062 -18.992
  128    HE1  HIS  17           HE1      HIS  17 -14.844  -5.761 -18.184
  129    HA   PRO  18           HA       PRO  18 -13.776   2.395 -17.422
  130    HB2  PRO  18           2HB      PRO  18 -12.488   3.622 -15.370
  131    HB3  PRO  18           3HB      PRO  18 -13.667   2.327 -15.128
  132    HG2  PRO  18           2HG      PRO  18 -10.676   2.189 -15.143
  133    HG3  PRO  18           3HG      PRO  18 -11.827   1.410 -14.041
  134    HD2  PRO  18           2HD      PRO  18 -10.656   0.091 -16.096
  135    HD3  PRO  18           3HD      PRO  18 -12.295  -0.288 -15.528
  136    H    GLY  19           H        GLY  19 -12.836   2.962 -19.532
  137    HA2  GLY  19           2HA      GLY  19 -12.100   5.163 -20.362
  138    HA3  GLY  19           3HA      GLY  19 -10.751   5.038 -19.243
  139    H    CYS  20           H        CYS  20 -11.514   2.080 -20.694
  140    HA   CYS  20           HA       CYS  20 -10.233   2.276 -23.174
  141    HB2  CYS  20           2HB      CYS  20  -8.364   2.629 -21.258
  142    HB3  CYS  20           3HB      CYS  20  -8.338   0.872 -21.381
  143    H    VAL  21           H        VAL  21  -9.431   0.015 -23.912
  144    HA   VAL  21           HA       VAL  21 -11.095  -2.068 -22.659
  145    HB   VAL  21           HB       VAL  21 -10.711  -1.751 -25.637
  146   HG11  VAL  21          1HG1      VAL  21 -12.411  -3.459 -25.826
  147   HG12  VAL  21          2HG1      VAL  21 -11.090  -4.050 -24.816
  148   HG13  VAL  21          3HG1      VAL  21 -12.597  -3.510 -24.073
  149   HG21  VAL  21          3HG2      VAL  21 -12.272  -0.166 -25.568
  150   HG22  VAL  21          1HG2      VAL  21 -13.405  -1.397 -25.009
  151   HG23  VAL  21          2HG2      VAL  21 -12.527  -0.410 -23.840
  152    H    HIS  22           H        HIS  22  -8.743  -1.845 -25.333
  153    HA   HIS  22           HA       HIS  22  -7.256  -4.056 -24.073
  154    HB2  HIS  22           2HB      HIS  22  -7.263  -3.402 -27.019
  155    HB3  HIS  22           3HB      HIS  22  -6.646  -4.855 -26.239
  156    HD1  HIS  22           HD1      HIS  22  -8.453  -6.552 -25.331
  157    HD2  HIS  22           HD2      HIS  22  -9.946  -3.446 -27.651
  158    HE1  HIS  22           HE1      HIS  22 -10.785  -7.247 -25.965
  159    H    GLY  23           H        GLY  23  -4.957  -4.032 -24.248
  160    HA2  GLY  23           2HA      GLY  23  -3.044  -2.699 -25.241
  161    HA3  GLY  23           3HA      GLY  23  -3.883  -1.303 -24.582
  162    H    ILE  24           H        ILE  24  -2.237  -0.676 -23.214
  163    HA   ILE  24           HA       ILE  24  -2.012  -2.255 -20.777
  164    HB   ILE  24           HB       ILE  24   0.406  -2.138 -20.686
  165   HG12  ILE  24          2HG1      ILE  24   1.030  -1.495 -23.407
  166   HG13  ILE  24          3HG1      ILE  24   0.065  -0.190 -22.724
  167   HG21  ILE  24          1HG2      ILE  24   0.912  -3.853 -22.221
  168   HG22  ILE  24          2HG2      ILE  24  -0.802  -4.037 -21.852
  169   HG23  ILE  24          3HG2      ILE  24  -0.303  -3.291 -23.369
  170   HD11  ILE  24          3HD1      ILE  24   2.560   0.036 -22.512
  171   HD12  ILE  24          1HD1      ILE  24   1.640   0.206 -21.018
  172   HD13  ILE  24          2HD1      ILE  24   2.498  -1.297 -21.359
  173    H    CYS  25           H        CYS  25  -0.252  -0.888 -19.336
  174    HA   CYS  25           HA       CYS  25  -0.281   1.917 -19.598
  175    HB2  CYS  25           2HB      CYS  25  -1.918   2.581 -17.987
  176    HB3  CYS  25           3HB      CYS  25  -2.720   1.498 -19.120
  177    H    ASN  26           H        ASN  26   0.946   2.934 -18.014
  178    HA   ASN  26           HA       ASN  26   2.218   1.111 -16.081
  179    HB2  ASN  26           2HB      ASN  26   4.250   2.255 -16.345
  180    HB3  ASN  26           3HB      ASN  26   3.609   2.160 -17.982
  181   HD21  ASN  26          1HD2      ASN  26   2.445   4.053 -18.778
  182   HD22  ASN  26          2HD2      ASN  26   2.957   5.620 -18.258
  183    H    GLU  27           H        GLU  27   0.535   4.101 -16.522
  184    HA   GLU  27           HA       GLU  27   0.946   4.789 -13.691
  185    HB2  GLU  27           2HB      GLU  27   0.594   6.377 -16.141
  186    HB3  GLU  27           3HB      GLU  27  -0.352   6.941 -14.770
  187    HG2  GLU  27           2HG      GLU  27   1.607   7.219 -13.440
  188    HG3  GLU  27           3HG      GLU  27   2.609   6.432 -14.659
  189    HA   PRO  28           HA       PRO  28  -3.222   3.936 -12.626
  190    HB2  PRO  28           2HB      PRO  28  -3.834   5.985 -10.954
  191    HB3  PRO  28           3HB      PRO  28  -2.734   4.676 -10.506
  192    HG2  PRO  28           2HG      PRO  28  -2.098   7.436 -11.475
  193    HG3  PRO  28           3HG      PRO  28  -1.343   6.509 -10.166
  194    HD2  PRO  28           2HD      PRO  28  -0.228   6.735 -12.623
  195    HD3  PRO  28           3HD      PRO  28  -0.038   5.284 -11.618
  196    H    TRP  29           H        TRP  29  -5.074   4.158 -13.705
  197    HA   TRP  29           HA       TRP  29  -6.775   5.032 -14.935
  198    HB2  TRP  29           2HB      TRP  29  -5.921   7.739 -13.900
  199    HB3  TRP  29           3HB      TRP  29  -7.518   7.260 -14.470
  200    HD1  TRP  29           HD1      TRP  29  -6.149   8.176 -11.390
  201    HE1  TRP  29           HE1      TRP  29  -7.173   6.924  -9.387
  202    HE3  TRP  29           HE3      TRP  29  -8.305   4.272 -13.890
  203    HZ2  TRP  29           HZ2      TRP  29  -8.692   4.590  -8.928
  204    HZ3  TRP  29           HZ3      TRP  29  -9.525   2.572 -12.595
  205    HH2  TRP  29           HH2      TRP  29  -9.713   2.729 -10.166
  206    H    GLN  30           H        GLN  30  -5.560   4.433 -16.831
  207    HA   GLN  30           HA       GLN  30  -5.049   6.721 -18.533
  208    HB2  GLN  30           2HB      GLN  30  -2.910   5.027 -17.452
  209    HB3  GLN  30           3HB      GLN  30  -2.873   5.192 -19.203
  210    HG2  GLN  30           2HG      GLN  30  -3.293   7.721 -17.826
  211    HG3  GLN  30           3HG      GLN  30  -1.776   6.933 -17.394
  212   HE21  GLN  30          1HE2      GLN  30  -3.698   8.158 -20.060
  213   HE22  GLN  30          2HE2      GLN  30  -2.379   8.395 -21.150
  214    H    CYS  31           H        CYS  31  -4.223   5.742 -20.788
  215    HA   CYS  31           HA       CYS  31  -5.395   3.177 -21.411
  216    HB2  CYS  31           2HB      CYS  31  -7.399   4.516 -21.489
  217    HB3  CYS  31           3HB      CYS  31  -6.599   5.740 -22.470
  218    H    LEU  32           H        LEU  32  -3.572   2.445 -22.360
  219    HA   LEU  32           HA       LEU  32  -2.397   4.062 -24.519
  220    HB2  LEU  32           2HB      LEU  32  -1.150   1.746 -23.053
  221    HB3  LEU  32           3HB      LEU  32  -0.361   2.816 -24.209
  222    HG   LEU  32           HG       LEU  32  -1.378   3.629 -21.486
  223   HD11  LEU  32          1HD1      LEU  32   1.457   3.270 -22.439
  224   HD12  LEU  32          2HD1      LEU  32   0.581   2.112 -21.438
  225   HD13  LEU  32          3HD1      LEU  32   0.926   3.728 -20.821
  226   HD21  LEU  32          3HD2      LEU  32  -0.916   5.191 -23.740
  227   HD22  LEU  32          1HD2      LEU  32   0.539   5.374 -22.760
  228   HD23  LEU  32          2HD2      LEU  32  -1.041   5.748 -22.070
  229    H    CYS  33           H        CYS  33  -1.849   3.064 -26.496
  230    HA   CYS  33           HA       CYS  33  -2.315   0.363 -27.113
  231    HB2  CYS  33           2HB      CYS  33  -4.360   0.741 -28.581
  232    HB3  CYS  33           3HB      CYS  33  -4.644   0.712 -26.844
  233    H    GLU  34           H        GLU  34  -2.104  -0.089 -29.417
  234    HA   GLU  34           HA       GLU  34  -0.098   1.405 -30.641
  235    HB2  GLU  34           2HB      GLU  34  -1.467  -0.990 -31.163
  236    HB3  GLU  34           3HB      GLU  34  -1.679  -0.005 -32.603
  237    HG2  GLU  34           2HG      GLU  34   0.959   0.344 -32.151
  238    HG3  GLU  34           3HG      GLU  34   0.731  -1.288 -31.526
  239    H    THR  35           H        THR  35  -0.097   2.744 -32.496
  240    HA   THR  35           HA       THR  35  -1.985   4.793 -32.504
  241    HB   THR  35           HB       THR  35  -0.114   3.994 -34.742
  242    HG1  THR  35           HG1      THR  35   0.173   5.830 -32.578
  243   HG21  THR  35          3HG2      THR  35  -1.426   5.501 -35.839
  244   HG22  THR  35          1HG2      THR  35  -0.360   6.639 -35.016
  245   HG23  THR  35          2HG2      THR  35  -1.955   6.288 -34.352
  246    H    ASN  36           H        ASN  36  -1.812   1.840 -34.401
  247    HA   ASN  36           HA       ASN  36  -3.652   2.394 -36.395
  248    HB2  ASN  36           2HB      ASN  36  -2.473   0.018 -35.208
  249    HB3  ASN  36           3HB      ASN  36  -4.135  -0.268 -35.715
  250   HD21  ASN  36          1HD2      ASN  36  -0.964   0.775 -36.779
  251   HD22  ASN  36          2HD2      ASN  36  -1.202   0.421 -38.453
  252    H    TRP  37           H        TRP  37  -4.211   1.288 -33.084
  253    HA   TRP  37           HA       TRP  37  -6.943   0.790 -33.235
  254    HB2  TRP  37           2HB      TRP  37  -5.186   1.728 -30.974
  255    HB3  TRP  37           3HB      TRP  37  -6.909   1.436 -30.748
  256    HD1  TRP  37           HD1      TRP  37  -3.700  -0.471 -31.750
  257    HE1  TRP  37           HE1      TRP  37  -4.019  -2.950 -31.136
  258    HE3  TRP  37           HE3      TRP  37  -8.572  -0.305 -30.212
  259    HZ2  TRP  37           HZ2      TRP  37  -6.066  -4.615 -30.133
  260    HZ3  TRP  37           HZ3      TRP  37  -9.637  -2.384 -29.440
  261    HH2  TRP  37           HH2      TRP  37  -8.409  -4.494 -29.403
  262    H    GLY  38           H        GLY  38  -8.759   2.023 -33.147
  263    HA2  GLY  38           2HA      GLY  38  -8.345   4.943 -33.260
  264    HA3  GLY  38           3HA      GLY  38  -9.655   4.088 -34.061
  265    H    GLY  39           H        GLY  39 -10.262   6.249 -32.538
  266    HA2  GLY  39           2HA      GLY  39 -12.084   6.596 -31.079
  267    HA3  GLY  39           3HA      GLY  39 -11.810   5.001 -30.395
  268    H    GLN  40           H        GLN  40 -12.127   6.239 -28.363
  269    HA   GLN  40           HA       GLN  40  -9.683   7.658 -27.546
  270    HB2  GLN  40           2HB      GLN  40 -12.420   8.285 -27.207
  271    HB3  GLN  40           3HB      GLN  40 -11.794   7.878 -25.615
  272    HG2  GLN  40           2HG      GLN  40  -9.926   9.572 -26.950
  273    HG3  GLN  40           3HG      GLN  40 -11.532  10.296 -27.027
  274   HE21  GLN  40          1HE2      GLN  40 -10.934  11.953 -25.630
  275   HE22  GLN  40          2HE2      GLN  40 -10.723  11.694 -23.935
  276    H    LEU  41           H        LEU  41 -11.908   5.073 -26.696
  277    HA   LEU  41           HA       LEU  41 -10.267   4.343 -24.391
  278    HB2  LEU  41           2HB      LEU  41 -12.703   2.857 -25.292
  279    HB3  LEU  41           3HB      LEU  41 -12.028   3.004 -23.671
  280    HG   LEU  41           HG       LEU  41 -13.498   5.158 -25.190
  281   HD11  LEU  41          1HD1      LEU  41 -14.275   3.214 -23.064
  282   HD12  LEU  41          2HD1      LEU  41 -15.166   3.735 -24.494
  283   HD13  LEU  41          3HD1      LEU  41 -15.023   4.811 -23.104
  284   HD21  LEU  41          3HD2      LEU  41 -12.264   5.147 -22.440
  285   HD22  LEU  41          1HD2      LEU  41 -13.383   6.376 -23.029
  286   HD23  LEU  41          2HD2      LEU  41 -11.814   6.167 -23.807
  287    H    CYS  42           H        CYS  42  -9.451   4.024 -27.260
  288    HA   CYS  42           HA       CYS  42  -8.419   2.506 -28.609
  289    HB2  CYS  42           2HB      CYS  42  -7.997   1.013 -26.012
  290    HB3  CYS  42           3HB      CYS  42  -7.054   0.831 -27.487
  291    H    ASP  43           H        ASP  43 -10.687   2.079 -29.383
  292    HA   ASP  43           HA       ASP  43 -11.330  -0.767 -28.981
  293    HB2  ASP  43           2HB      ASP  43 -13.646  -0.336 -29.004
  294    HB3  ASP  43           3HB      ASP  43 -12.977   0.911 -27.955
  295    H    LYS  44           H        LYS  44 -12.382  -1.803 -30.811
  296    HA   LYS  44           HA       LYS  44 -11.070  -1.275 -33.244
  297    HB2  LYS  44           2HB      LYS  44 -13.564  -2.927 -32.802
  298    HB3  LYS  44           3HB      LYS  44 -12.482  -3.026 -34.185
  299    HG2  LYS  44           2HG      LYS  44 -11.759  -3.692 -31.338
  300    HG3  LYS  44           3HG      LYS  44 -12.113  -4.855 -32.618
  301    HD2  LYS  44           2HD      LYS  44 -10.174  -3.245 -33.738
  302    HD3  LYS  44           3HD      LYS  44  -9.664  -3.383 -32.054
  303    HE2  LYS  44           2HE      LYS  44 -10.242  -5.937 -32.494
  304    HE3  LYS  44           3HE      LYS  44  -9.892  -5.469 -34.157
  305    HZ1  LYS  44           3HZ      LYS  44  -7.746  -4.572 -33.334
  306    HZ2  LYS  44           1HZ      LYS  44  -7.893  -6.249 -33.161
  307    HZ3  LYS  44           2HZ      LYS  44  -8.082  -5.240 -31.817
  Start of MODEL   18
    1    H1   ARG   1           H        ARG   1   3.345   0.904  -2.008
    2    HA   ARG   1           HA       ARG   1   0.952   0.600  -0.314
    3    HB2  ARG   1           2HB      ARG   1   2.011   2.976  -1.015
    4    HB3  ARG   1           3HB      ARG   1   0.971   2.699  -2.406
    5    HG2  ARG   1           2HG      ARG   1  -0.598   3.681  -1.156
    6    HG3  ARG   1           3HG      ARG   1  -0.713   2.111  -0.359
    7    HD2  ARG   1           2HD      ARG   1   0.462   2.811   1.489
    8    HD3  ARG   1           3HD      ARG   1   1.320   4.067   0.597
    9    HE   ARG   1           HE       ARG   1  -1.256   4.912   0.564
   10   HH11  ARG   1          1HH1      ARG   1   0.926   3.924   3.090
   11   HH12  ARG   1          2HH1      ARG   1   0.213   4.953   4.288
   12   HH21  ARG   1          1HH2      ARG   1  -2.204   6.271   2.131
   13   HH22  ARG   1          2HH2      ARG   1  -1.568   6.287   3.741
   14    H    CYS   2           H        CYS   2  -0.591  -0.649  -1.124
   15    HA   CYS   2           HA       CYS   2  -1.049  -0.762  -3.993
   16    HB2  CYS   2           2HB      CYS   2   0.582  -2.539  -3.678
   17    HB3  CYS   2           3HB      CYS   2  -0.372  -3.218  -2.363
   18    H    GLN   3           H        GLN   3  -2.995   0.305  -3.349
   19    HA   GLN   3           HA       GLN   3  -5.187  -1.425  -3.017
   20    HB2  GLN   3           2HB      GLN   3  -5.979  -0.642  -0.800
   21    HB3  GLN   3           3HB      GLN   3  -4.502  -1.591  -0.708
   22    HG2  GLN   3           2HG      GLN   3  -3.345   0.091   0.177
   23    HG3  GLN   3           3HG      GLN   3  -4.003   1.262  -0.965
   24   HE21  GLN   3          1HE2      GLN   3  -4.433  -0.298   2.115
   25   HE22  GLN   3          2HE2      GLN   3  -5.605   0.807   2.738
   26    H    TYR   4           H        TYR   4  -4.498   0.594  -4.801
   27    HA   TYR   4           HA       TYR   4  -6.875   2.123  -4.849
   28    HB2  TYR   4           2HB      TYR   4  -5.128   3.258  -3.138
   29    HB3  TYR   4           3HB      TYR   4  -4.590   4.000  -4.641
   30    HD1  TYR   4           HD1      TYR   4  -6.774   4.742  -6.156
   31    HD2  TYR   4           HD2      TYR   4  -6.569   4.559  -1.910
   32    HE1  TYR   4           HE1      TYR   4  -8.599   6.384  -6.002
   33    HE2  TYR   4           HE2      TYR   4  -8.395   6.199  -1.745
   34    HH   TYR   4           HH       TYR   4 -10.426   6.872  -3.468
   35    H    GLY   5           H        GLY   5  -7.209   1.764  -6.957
   36    HA2  GLY   5           2HA      GLY   5  -6.982   2.067  -9.230
   37    HA3  GLY   5           3HA      GLY   5  -5.616   3.122  -8.896
   38    H    TRP   6           H        TRP   6  -5.728  -0.160  -7.722
   39    HA   TRP   6           HA       TRP   6  -4.101  -1.155  -9.910
   40    HB2  TRP   6           2HB      TRP   6  -3.043  -0.909  -7.090
   41    HB3  TRP   6           3HB      TRP   6  -2.309  -1.930  -8.323
   42    HD1  TRP   6           HD1      TRP   6  -1.997   1.411  -6.898
   43    HE1  TRP   6           HE1      TRP   6  -0.643   2.963  -8.442
   44    HE3  TRP   6           HE3      TRP   6  -2.079  -1.411 -11.160
   45    HZ2  TRP   6           HZ2      TRP   6   0.269   2.988 -11.113
   46    HZ3  TRP   6           HZ3      TRP   6  -0.942  -0.551 -13.166
   47    HH2  TRP   6           HH2      TRP   6   0.206   1.603 -13.141
   48    H    GLN   7           H        GLN   7  -5.035  -3.025 -10.387
   49    HA   GLN   7           HA       GLN   7  -5.847  -4.789  -8.173
   50    HB2  GLN   7           2HB      GLN   7  -7.758  -5.518  -9.419
   51    HB3  GLN   7           3HB      GLN   7  -7.784  -3.760  -9.377
   52    HG2  GLN   7           2HG      GLN   7  -6.809  -3.728 -11.644
   53    HG3  GLN   7           3HG      GLN   7  -6.905  -5.488 -11.679
   54   HE21  GLN   7          1HE2      GLN   7  -8.153  -4.535 -13.668
   55   HE22  GLN   7          2HE2      GLN   7  -9.863  -4.429 -13.449
   56    H    GLY   8           H        GLY   8  -6.429  -7.072  -9.438
   57    HA2  GLY   8           2HA      GLY   8  -5.558  -8.571 -11.148
   58    HA3  GLY   8           3HA      GLY   8  -4.033  -7.704 -11.042
   59    H    LEU   9           H        LEU   9  -3.170  -9.910 -10.793
   60    HA   LEU   9           HA       LEU   9  -3.718 -11.627  -8.696
   61    HB2  LEU   9           2HB      LEU   9  -1.818 -11.448 -10.716
   62    HB3  LEU   9           3HB      LEU   9  -0.875 -11.467  -9.227
   63    HG   LEU   9           HG       LEU   9  -1.050 -13.707 -10.045
   64   HD11  LEU   9          1HD1      LEU   9  -3.099 -13.891  -7.936
   65   HD12  LEU   9          2HD1      LEU   9  -1.641 -12.991  -7.521
   66   HD13  LEU   9          3HD1      LEU   9  -1.519 -14.665  -8.061
   67   HD21  LEU   9          3HD2      LEU   9  -3.747 -12.884 -10.703
   68   HD22  LEU   9          1HD2      LEU   9  -3.720 -14.429  -9.853
   69   HD23  LEU   9          2HD2      LEU   9  -2.788 -14.222 -11.336
   70    H    TYR  10           H        TYR  10  -1.620  -8.789  -8.759
   71    HA   TYR  10           HA       TYR  10  -1.723  -8.687  -5.851
   72    HB2  TYR  10           2HB      TYR  10   0.829  -8.909  -7.439
   73    HB3  TYR  10           3HB      TYR  10   0.791  -8.205  -5.826
   74    HD1  TYR  10           HD1      TYR  10   0.377  -9.591  -3.871
   75    HD2  TYR  10           HD2      TYR  10   0.489 -11.290  -7.770
   76    HE1  TYR  10           HE1      TYR  10   0.561 -11.836  -2.881
   77    HE2  TYR  10           HE2      TYR  10   0.671 -13.539  -6.792
   78    HH   TYR  10           HH       TYR  10   1.203 -14.026  -3.393
   79    H    CYS  11           H        CYS  11   0.230  -7.088  -8.365
   80    HA   CYS  11           HA       CYS  11  -1.308  -4.691  -8.325
   81    HB2  CYS  11           2HB      CYS  11   0.661  -4.970  -6.283
   82    HB3  CYS  11           3HB      CYS  11   1.232  -3.758  -7.425
   83    H    ASP  12           H        ASP  12  -1.200  -4.230 -10.418
   84    HA   ASP  12           HA       ASP  12   1.137  -3.349 -11.677
   85    HB2  ASP  12           2HB      ASP  12   1.220  -6.058 -11.550
   86    HB3  ASP  12           3HB      ASP  12   0.382  -5.835 -13.083
   87    H    LYS  13           H        LYS  13  -2.053  -4.772 -12.028
   88    HA   LYS  13           HA       LYS  13  -2.519  -3.490 -14.581
   89    HB2  LYS  13           2HB      LYS  13  -3.818  -5.531 -12.959
   90    HB3  LYS  13           3HB      LYS  13  -4.971  -4.386 -13.631
   91    HG2  LYS  13           2HG      LYS  13  -3.884  -4.804 -15.873
   92    HG3  LYS  13           3HG      LYS  13  -3.039  -6.150 -15.105
   93    HD2  LYS  13           2HD      LYS  13  -6.009  -5.930 -14.854
   94    HD3  LYS  13           3HD      LYS  13  -5.303  -6.553 -16.347
   95    HE2  LYS  13           2HE      LYS  13  -3.930  -7.900 -14.365
   96    HE3  LYS  13           3HE      LYS  13  -5.576  -7.814 -13.740
   97    HZ1  LYS  13           3HZ      LYS  13  -5.128  -9.803 -15.114
   98    HZ2  LYS  13           1HZ      LYS  13  -4.879  -8.797 -16.452
   99    HZ3  LYS  13           2HZ      LYS  13  -6.397  -8.855 -15.709
  100    H    CYS  14           H        CYS  14  -3.392  -1.545 -14.886
  101    HA   CYS  14           HA       CYS  14  -4.305  -0.052 -12.542
  102    HB2  CYS  14           2HB      CYS  14  -3.949   1.934 -13.824
  103    HB3  CYS  14           3HB      CYS  14  -2.558   0.890 -14.098
  104    H    ILE  15           H        ILE  15  -5.921  -2.130 -13.918
  105    HA   ILE  15           HA       ILE  15  -8.058  -2.486 -14.624
  106    HB   ILE  15           HB       ILE  15  -8.889   0.199 -13.620
  107   HG12  ILE  15          2HG1      ILE  15  -7.950  -2.090 -11.879
  108   HG13  ILE  15          3HG1      ILE  15  -7.225  -0.490 -11.985
  109   HG21  ILE  15          1HG2      ILE  15 -10.165  -2.355 -12.823
  110   HG22  ILE  15          2HG2      ILE  15 -10.893  -0.800 -13.223
  111   HG23  ILE  15          3HG2      ILE  15 -10.314  -1.859 -14.509
  112   HD11  ILE  15          3HD1      ILE  15  -9.899  -0.050 -11.329
  113   HD12  ILE  15          1HD1      ILE  15  -9.381  -1.413 -10.337
  114   HD13  ILE  15          2HD1      ILE  15  -8.492   0.110 -10.278
  115    HA   PRO  16           HA       PRO  16  -7.478   0.180 -18.364
  116    HB2  PRO  16           2HB      PRO  16  -7.596  -1.883 -20.125
  117    HB3  PRO  16           3HB      PRO  16  -6.099  -1.386 -19.326
  118    HG2  PRO  16           2HG      PRO  16  -7.956  -3.633 -18.642
  119    HG3  PRO  16           3HG      PRO  16  -6.183  -3.618 -18.678
  120    HD2  PRO  16           2HD      PRO  16  -7.595  -3.403 -16.378
  121    HD3  PRO  16           3HD      PRO  16  -6.024  -2.610 -16.611
  122    H    HIS  17           H        HIS  17  -9.785  -2.241 -17.391
  123    HA   HIS  17           HA       HIS  17 -11.688  -2.161 -19.363
  124    HB2  HIS  17           2HB      HIS  17 -11.664  -2.739 -16.498
  125    HB3  HIS  17           3HB      HIS  17 -13.219  -2.132 -17.061
  126    HD1  HIS  17           HD1      HIS  17 -14.434  -4.360 -16.856
  127    HD2  HIS  17           HD2      HIS  17 -11.073  -4.534 -19.292
  128    HE1  HIS  17           HE1      HIS  17 -14.559  -6.588 -18.016
  129    HA   PRO  18           HA       PRO  18 -13.787   1.717 -17.426
  130    HB2  PRO  18           2HB      PRO  18 -12.517   2.955 -15.370
  131    HB3  PRO  18           3HB      PRO  18 -13.673   1.638 -15.132
  132    HG2  PRO  18           2HG      PRO  18 -10.680   1.551 -15.154
  133    HG3  PRO  18           3HG      PRO  18 -11.815   0.747 -14.054
  134    HD2  PRO  18           2HD      PRO  18 -10.627  -0.541 -16.118
  135    HD3  PRO  18           3HD      PRO  18 -12.258  -0.950 -15.550
  136    H    GLY  19           H        GLY  19 -12.863   2.314 -19.534
  137    HA2  GLY  19           2HA      GLY  19 -12.166   4.527 -20.357
  138    HA3  GLY  19           3HA      GLY  19 -10.817   4.426 -19.236
  139    H    CYS  20           H        CYS  20 -11.503   1.453 -20.682
  140    HA   CYS  20           HA       CYS  20 -10.238   1.674 -23.168
  141    HB2  CYS  20           2HB      CYS  20  -8.373   2.085 -21.252
  142    HB3  CYS  20           3HB      CYS  20  -8.290   0.332 -21.389
  143    H    VAL  21           H        VAL  21  -9.345  -0.576 -23.876
  144    HA   VAL  21           HA       VAL  21 -10.937  -2.701 -22.606
  145    HB   VAL  21           HB       VAL  21 -10.606  -2.391 -25.590
  146   HG11  VAL  21          1HG1      VAL  21 -12.049  -4.218 -25.819
  147   HG12  VAL  21          2HG1      VAL  21 -10.958  -4.689 -24.515
  148   HG13  VAL  21          3HG1      VAL  21 -12.586  -4.120 -24.142
  149   HG21  VAL  21          3HG2      VAL  21 -12.029  -0.635 -25.120
  150   HG22  VAL  21          1HG2      VAL  21 -13.168  -1.958 -25.365
  151   HG23  VAL  21          2HG2      VAL  21 -12.747  -1.449 -23.730
  152    H    HIS  22           H        HIS  22  -8.444  -2.169 -25.103
  153    HA   HIS  22           HA       HIS  22  -6.952  -4.434 -23.952
  154    HB2  HIS  22           2HB      HIS  22  -6.927  -3.685 -26.876
  155    HB3  HIS  22           3HB      HIS  22  -6.267  -5.137 -26.129
  156    HD1  HIS  22           HD1      HIS  22  -7.988  -6.967 -25.385
  157    HD2  HIS  22           HD2      HIS  22  -9.625  -3.783 -27.493
  158    HE1  HIS  22           HE1      HIS  22 -10.285  -7.725 -26.072
  159    H    GLY  23           H        GLY  23  -4.579  -4.367 -24.645
  160    HA2  GLY  23           2HA      GLY  23  -2.741  -2.925 -25.362
  161    HA3  GLY  23           3HA      GLY  23  -3.634  -1.570 -24.689
  162    H    ILE  24           H        ILE  24  -1.974  -0.919 -23.331
  163    HA   ILE  24           HA       ILE  24  -1.709  -2.528 -20.910
  164    HB   ILE  24           HB       ILE  24   0.730  -2.175 -20.817
  165   HG12  ILE  24          2HG1      ILE  24   0.942  -1.639 -23.710
  166   HG13  ILE  24          3HG1      ILE  24   0.340  -0.293 -22.748
  167   HG21  ILE  24          1HG2      ILE  24   1.269  -4.034 -22.088
  168   HG22  ILE  24          2HG2      ILE  24  -0.470  -4.215 -21.866
  169   HG23  ILE  24          3HG2      ILE  24   0.164  -3.592 -23.389
  170   HD11  ILE  24          3HD1      ILE  24   2.336   0.089 -21.815
  171   HD12  ILE  24          1HD1      ILE  24   2.705  -1.627 -21.648
  172   HD13  ILE  24          2HD1      ILE  24   2.950  -0.819 -23.196
  173    H    CYS  25           H        CYS  25  -0.108  -1.138 -19.376
  174    HA   CYS  25           HA       CYS  25  -0.253   1.681 -19.592
  175    HB2  CYS  25           2HB      CYS  25  -1.928   2.212 -17.969
  176    HB3  CYS  25           3HB      CYS  25  -2.666   1.119 -19.135
  177    H    ASN  26           H        ASN  26   0.873   2.734 -17.941
  178    HA   ASN  26           HA       ASN  26   2.245   0.932 -16.056
  179    HB2  ASN  26           2HB      ASN  26   3.884   1.741 -17.559
  180    HB3  ASN  26           3HB      ASN  26   3.222   3.372 -17.531
  181   HD21  ASN  26          1HD2      ASN  26   4.687   4.644 -16.656
  182   HD22  ASN  26          2HD2      ASN  26   5.558   4.334 -15.197
  183    H    GLU  27           H        GLU  27   0.413   3.839 -16.446
  184    HA   GLU  27           HA       GLU  27   0.763   4.477 -13.595
  185    HB2  GLU  27           2HB      GLU  27   0.411   6.113 -16.005
  186    HB3  GLU  27           3HB      GLU  27  -0.615   6.597 -14.662
  187    HG2  GLU  27           2HG      GLU  27   1.362   6.777 -13.227
  188    HG3  GLU  27           3HG      GLU  27   2.381   6.325 -14.592
  189    HA   PRO  28           HA       PRO  28  -3.383   3.427 -12.621
  190    HB2  PRO  28           2HB      PRO  28  -4.101   5.402 -10.902
  191    HB3  PRO  28           3HB      PRO  28  -2.956   4.125 -10.474
  192    HG2  PRO  28           2HG      PRO  28  -2.418   6.935 -11.355
  193    HG3  PRO  28           3HG      PRO  28  -1.645   6.001 -10.060
  194    HD2  PRO  28           2HD      PRO  28  -0.504   6.341 -12.492
  195    HD3  PRO  28           3HD      PRO  28  -0.270   4.871 -11.525
  196    H    TRP  29           H        TRP  29  -5.248   3.614 -13.687
  197    HA   TRP  29           HA       TRP  29  -6.967   4.457 -14.914
  198    HB2  TRP  29           2HB      TRP  29  -6.202   7.175 -13.843
  199    HB3  TRP  29           3HB      TRP  29  -7.782   6.648 -14.414
  200    HD1  TRP  29           HD1      TRP  29  -6.444   7.579 -11.327
  201    HE1  TRP  29           HE1      TRP  29  -7.417   6.269  -9.336
  202    HE3  TRP  29           HE3      TRP  29  -8.457   3.624 -13.865
  203    HZ2  TRP  29           HZ2      TRP  29  -8.847   3.876  -8.900
  204    HZ3  TRP  29           HZ3      TRP  29  -9.611   1.867 -12.586
  205    HH2  TRP  29           HH2      TRP  29  -9.801   1.992 -10.155
  206    H    GLN  30           H        GLN  30  -5.615   3.903 -16.772
  207    HA   GLN  30           HA       GLN  30  -5.193   6.241 -18.449
  208    HB2  GLN  30           2HB      GLN  30  -3.025   4.717 -17.289
  209    HB3  GLN  30           3HB      GLN  30  -2.982   4.627 -19.044
  210    HG2  GLN  30           2HG      GLN  30  -3.479   7.325 -18.205
  211    HG3  GLN  30           3HG      GLN  30  -2.040   6.689 -17.410
  212   HE21  GLN  30          1HE2      GLN  30  -0.316   5.920 -18.713
  213   HE22  GLN  30          2HE2      GLN  30  -0.111   6.489 -20.332
  214    H    CYS  31           H        CYS  31  -4.272   5.276 -20.701
  215    HA   CYS  31           HA       CYS  31  -5.363   2.708 -21.390
  216    HB2  CYS  31           2HB      CYS  31  -7.436   3.930 -21.426
  217    HB3  CYS  31           3HB      CYS  31  -6.709   5.233 -22.359
  218    H    LEU  32           H        LEU  32  -3.554   2.065 -22.408
  219    HA   LEU  32           HA       LEU  32  -2.504   3.785 -24.557
  220    HB2  LEU  32           2HB      LEU  32  -1.000   1.567 -23.198
  221    HB3  LEU  32           3HB      LEU  32  -0.359   2.847 -24.227
  222    HG   LEU  32           HG       LEU  32  -1.437   3.172 -21.428
  223   HD11  LEU  32          1HD1      LEU  32   0.719   3.301 -20.682
  224   HD12  LEU  32          2HD1      LEU  32   1.350   3.808 -22.247
  225   HD13  LEU  32          3HD1      LEU  32   0.911   2.122 -21.979
  226   HD21  LEU  32          3HD2      LEU  32  -0.100   5.471 -22.086
  227   HD22  LEU  32          1HD2      LEU  32  -1.852   5.270 -22.078
  228   HD23  LEU  32          2HD2      LEU  32  -0.950   5.081 -23.582
  229    H    CYS  33           H        CYS  33  -1.687   2.700 -26.468
  230    HA   CYS  33           HA       CYS  33  -2.071  -0.017 -27.028
  231    HB2  CYS  33           2HB      CYS  33  -4.047   0.238 -28.598
  232    HB3  CYS  33           3HB      CYS  33  -4.423   0.292 -26.879
  233    H    GLU  34           H        GLU  34  -1.908  -0.483 -29.396
  234    HA   GLU  34           HA       GLU  34   0.154   1.077 -30.542
  235    HB2  GLU  34           2HB      GLU  34  -1.402  -1.322 -31.315
  236    HB3  GLU  34           3HB      GLU  34  -0.671  -0.416 -32.633
  237    HG2  GLU  34           2HG      GLU  34   1.514  -0.676 -31.670
  238    HG3  GLU  34           3HG      GLU  34   0.831  -1.440 -30.235
  239    H    THR  35           H        THR  35  -0.038   1.768 -32.939
  240    HA   THR  35           HA       THR  35  -1.962   3.874 -33.047
  241    HB   THR  35           HB       THR  35  -0.145   2.909 -35.262
  242    HG1  THR  35           HG1      THR  35   0.421   5.116 -33.603
  243   HG21  THR  35          3HG2      THR  35  -1.957   4.399 -35.996
  244   HG22  THR  35          1HG2      THR  35  -0.381   5.177 -36.130
  245   HG23  THR  35          2HG2      THR  35  -1.457   5.590 -34.795
  246    H    ASN  36           H        ASN  36  -1.776   0.649 -34.327
  247    HA   ASN  36           HA       ASN  36  -3.542   0.796 -36.466
  248    HB2  ASN  36           2HB      ASN  36  -2.267  -1.248 -34.981
  249    HB3  ASN  36           3HB      ASN  36  -3.981  -1.651 -35.026
  250   HD21  ASN  36          1HD2      ASN  36  -1.466  -0.413 -37.204
  251   HD22  ASN  36          2HD2      ASN  36  -1.912  -1.397 -38.552
  252    H    TRP  37           H        TRP  37  -4.158   0.808 -33.037
  253    HA   TRP  37           HA       TRP  37  -6.948   0.231 -33.213
  254    HB2  TRP  37           2HB      TRP  37  -5.347   1.539 -31.003
  255    HB3  TRP  37           3HB      TRP  37  -7.016   0.996 -30.856
  256    HD1  TRP  37           HD1      TRP  37  -3.455  -0.403 -31.274
  257    HE1  TRP  37           HE1      TRP  37  -3.446  -2.847 -30.467
  258    HE3  TRP  37           HE3      TRP  37  -8.464  -1.003 -30.450
  259    HZ2  TRP  37           HZ2      TRP  37  -5.315  -4.774 -29.597
  260    HZ3  TRP  37           HZ3      TRP  37  -9.272  -3.178 -29.631
  261    HH2  TRP  37           HH2      TRP  37  -7.729  -5.024 -29.214
  262    H    GLY  38           H        GLY  38  -5.408   3.243 -32.078
  263    HA2  GLY  38           2HA      GLY  38  -6.002   5.442 -32.362
  264    HA3  GLY  38           3HA      GLY  38  -6.660   4.954 -33.917
  265    H    GLY  39           H        GLY  39  -7.363   5.769 -30.639
  266    HA2  GLY  39           2HA      GLY  39 -10.032   6.451 -31.180
  267    HA3  GLY  39           3HA      GLY  39 -10.013   4.850 -30.455
  268    H    GLN  40           H        GLN  40 -11.274   5.930 -28.759
  269    HA   GLN  40           HA       GLN  40  -9.707   7.658 -26.994
  270    HB2  GLN  40           2HB      GLN  40 -12.514   7.370 -27.608
  271    HB3  GLN  40           3HB      GLN  40 -12.247   7.240 -25.874
  272    HG2  GLN  40           2HG      GLN  40 -10.934   9.463 -27.343
  273    HG3  GLN  40           3HG      GLN  40 -12.668   9.559 -27.037
  274   HE21  GLN  40          1HE2      GLN  40 -13.396   9.937 -24.997
  275   HE22  GLN  40          2HE2      GLN  40 -12.361  10.295 -23.661
  276    H    LEU  41           H        LEU  41 -11.389   4.555 -27.027
  277    HA   LEU  41           HA       LEU  41 -10.082   3.899 -24.468
  278    HB2  LEU  41           2HB      LEU  41 -12.483   2.439 -25.483
  279    HB3  LEU  41           3HB      LEU  41 -11.895   2.606 -23.830
  280    HG   LEU  41           HG       LEU  41 -13.187   4.816 -25.427
  281   HD11  LEU  41          1HD1      LEU  41 -14.542   2.693 -24.624
  282   HD12  LEU  41          2HD1      LEU  41 -15.206   4.321 -24.496
  283   HD13  LEU  41          3HD1      LEU  41 -14.492   3.547 -23.081
  284   HD21  LEU  41          3HD2      LEU  41 -13.412   5.724 -23.018
  285   HD22  LEU  41          1HD2      LEU  41 -11.859   5.868 -23.842
  286   HD23  LEU  41          2HD2      LEU  41 -12.106   4.598 -22.643
  287    H    CYS  42           H        CYS  42  -9.216   3.596 -27.357
  288    HA   CYS  42           HA       CYS  42  -8.173   2.073 -28.692
  289    HB2  CYS  42           2HB      CYS  42  -7.740   0.646 -26.058
  290    HB3  CYS  42           3HB      CYS  42  -6.816   0.397 -27.536
  291    H    ASP  43           H        ASP  43 -10.869   1.750 -28.781
  292    HA   ASP  43           HA       ASP  43 -11.332  -1.144 -28.584
  293    HB2  ASP  43           2HB      ASP  43 -13.718  -0.606 -28.793
  294    HB3  ASP  43           3HB      ASP  43 -12.986   0.271 -27.452
  295    H    LYS  44           H        LYS  44 -11.136   1.524 -30.816
  296    HA   LYS  44           HA       LYS  44 -11.819  -0.272 -33.044
  297    HB2  LYS  44           2HB      LYS  44 -12.190   1.738 -34.372
  298    HB3  LYS  44           3HB      LYS  44 -13.154   1.789 -32.902
  299    HG2  LYS  44           2HG      LYS  44 -10.723   3.042 -32.281
  300    HG3  LYS  44           3HG      LYS  44 -11.210   3.656 -33.862
  301    HD2  LYS  44           2HD      LYS  44 -13.180   3.498 -31.609
  302    HD3  LYS  44           3HD      LYS  44 -12.059   4.857 -31.732
  303    HE2  LYS  44           2HE      LYS  44 -13.388   5.817 -33.228
  304    HE3  LYS  44           3HE      LYS  44 -13.193   4.428 -34.296
  305    HZ1  LYS  44           3HZ      LYS  44 -15.026   3.345 -33.081
  306    HZ2  LYS  44           1HZ      LYS  44 -15.507   4.769 -33.858
  307    HZ3  LYS  44           2HZ      LYS  44 -15.254   4.762 -32.186
  Start of MODEL   19
    1    H1   ARG   1           H        ARG   1   1.105  -2.049   1.085
    2    HA   ARG   1           HA       ARG   1  -1.503  -0.866   1.758
    3    HB2  ARG   1           2HB      ARG   1   0.616   0.007   2.868
    4    HB3  ARG   1           3HB      ARG   1   1.069   0.635   1.289
    5    HG2  ARG   1           2HG      ARG   1  -0.855   2.068   1.243
    6    HG3  ARG   1           3HG      ARG   1  -1.473   1.350   2.732
    7    HD2  ARG   1           2HD      ARG   1   0.479   2.191   3.945
    8    HD3  ARG   1           3HD      ARG   1   1.098   2.903   2.455
    9    HE   ARG   1           HE       ARG   1  -0.908   3.987   4.168
   10   HH11  ARG   1          1HH1      ARG   1   0.148   3.797   0.856
   11   HH12  ARG   1          2HH1      ARG   1  -0.588   5.297   0.399
   12   HH21  ARG   1          1HH2      ARG   1  -1.882   5.963   3.578
   13   HH22  ARG   1          2HH2      ARG   1  -1.742   6.528   1.948
   14    H    CYS   2           H        CYS   2  -1.499  -2.240  -0.572
   15    HA   CYS   2           HA       CYS   2  -1.465  -0.103  -2.601
   16    HB2  CYS   2           2HB      CYS   2   0.329  -1.774  -2.988
   17    HB3  CYS   2           3HB      CYS   2  -0.895  -3.037  -3.074
   18    H    GLN   3           H        GLN   3  -3.656   0.358  -2.205
   19    HA   GLN   3           HA       GLN   3  -5.484  -1.537  -3.469
   20    HB2  GLN   3           2HB      GLN   3  -5.567  -1.880  -0.981
   21    HB3  GLN   3           3HB      GLN   3  -6.136  -0.223  -0.830
   22    HG2  GLN   3           2HG      GLN   3  -8.117  -1.343  -0.802
   23    HG3  GLN   3           3HG      GLN   3  -7.961  -1.022  -2.529
   24   HE21  GLN   3          1HE2      GLN   3  -8.963  -3.269  -0.514
   25   HE22  GLN   3          2HE2      GLN   3  -8.538  -4.708  -1.369
   26    H    TYR   4           H        TYR   4  -4.714   0.474  -4.898
   27    HA   TYR   4           HA       TYR   4  -7.046   2.040  -5.299
   28    HB2  TYR   4           2HB      TYR   4  -5.669   3.142  -3.327
   29    HB3  TYR   4           3HB      TYR   4  -4.708   3.784  -4.655
   30    HD1  TYR   4           HD2      TYR   4  -6.528   4.517  -6.698
   31    HD2  TYR   4           HD1      TYR   4  -7.086   4.750  -2.487
   32    HE1  TYR   4           HE2      TYR   4  -8.172   6.317  -7.022
   33    HE2  TYR   4           HE1      TYR   4  -8.733   6.550  -2.799
   34    HH   TYR   4           HH       TYR   4 -10.132   7.270  -5.747
   35    H    GLY   5           H        GLY   5  -7.120   1.851  -7.441
   36    HA2  GLY   5           2HA      GLY   5  -6.540   2.091  -9.651
   37    HA3  GLY   5           3HA      GLY   5  -5.234   3.137  -9.114
   38    H    TRP   6           H        TRP   6  -5.439  -0.102  -7.900
   39    HA   TRP   6           HA       TRP   6  -3.645  -1.187  -9.891
   40    HB2  TRP   6           2HB      TRP   6  -2.741  -0.554  -7.089
   41    HB3  TRP   6           3HB      TRP   6  -1.984  -1.835  -8.032
   42    HD1  TRP   6           HD1      TRP   6  -1.270   1.527  -7.158
   43    HE1  TRP   6           HE1      TRP   6   0.131   2.748  -8.938
   44    HE3  TRP   6           HE3      TRP   6  -1.994  -1.662 -11.088
   45    HZ2  TRP   6           HZ2      TRP   6   0.835   2.406 -11.650
   46    HZ3  TRP   6           HZ3      TRP   6  -0.922  -1.142 -13.240
   47    HH2  TRP   6           HH2      TRP   6   0.462   0.850 -13.514
   48    H    GLN   7           H        GLN   7  -5.443  -2.620 -10.120
   49    HA   GLN   7           HA       GLN   7  -6.002  -4.397  -7.872
   50    HB2  GLN   7           2HB      GLN   7  -7.862  -5.212  -9.180
   51    HB3  GLN   7           3HB      GLN   7  -7.884  -3.454  -9.183
   52    HG2  GLN   7           2HG      GLN   7  -6.926  -3.418 -11.408
   53    HG3  GLN   7           3HG      GLN   7  -6.817  -5.178 -11.407
   54   HE21  GLN   7          1HE2      GLN   7  -9.378  -2.937 -10.414
   55   HE22  GLN   7          2HE2      GLN   7 -10.595  -3.599 -11.446
   56    H    GLY   8           H        GLY   8  -6.638  -6.744  -9.074
   57    HA2  GLY   8           2HA      GLY   8  -5.748  -8.431 -10.537
   58    HA3  GLY   8           3HA      GLY   8  -4.222  -7.560 -10.546
   59    H    LEU   9           H        LEU   9  -2.672  -8.574  -9.481
   60    HA   LEU   9           HA       LEU   9  -3.370 -10.002  -7.004
   61    HB2  LEU   9           2HB      LEU   9  -3.019 -11.605  -8.820
   62    HB3  LEU   9           3HB      LEU   9  -1.426 -10.916  -9.121
   63    HG   LEU   9           HG       LEU   9  -0.680 -11.688  -6.918
   64   HD11  LEU   9          1HD1      LEU   9  -2.671 -13.559  -6.250
   65   HD12  LEU   9          2HD1      LEU   9  -3.487 -12.015  -6.492
   66   HD13  LEU   9          3HD1      LEU   9  -2.162 -12.139  -5.335
   67   HD21  LEU   9          3HD2      LEU   9  -0.737 -14.116  -7.403
   68   HD22  LEU   9          1HD2      LEU   9  -0.298 -13.137  -8.803
   69   HD23  LEU   9          2HD2      LEU   9  -1.925 -13.804  -8.669
   70    H    TYR  10           H        TYR  10  -0.612  -8.779  -8.906
   71    HA   TYR  10           HA       TYR  10   0.662  -7.985  -6.371
   72    HB2  TYR  10           2HB      TYR  10   1.912  -8.647  -9.044
   73    HB3  TYR  10           3HB      TYR  10   2.802  -8.031  -7.656
   74    HD1  TYR  10           HD2      TYR  10   2.158  -9.465  -5.399
   75    HD2  TYR  10           HD1      TYR  10   2.140 -10.904  -9.403
   76    HE1  TYR  10           HE2      TYR  10   2.459 -11.761  -4.569
   77    HE2  TYR  10           HE1      TYR  10   2.440 -13.204  -8.584
   78    HH   TYR  10           HH       TYR  10   2.008 -14.488  -6.503
   79    H    CYS  11           H        CYS  11  -1.348  -6.451  -7.810
   80    HA   CYS  11           HA       CYS  11  -1.761  -4.341  -8.561
   81    HB2  CYS  11           2HB      CYS  11   0.749  -3.933  -6.941
   82    HB3  CYS  11           3HB      CYS  11  -0.115  -2.590  -7.683
   83    H    ASP  12           H        ASP  12  -1.203  -5.407 -10.714
   84    HA   ASP  12           HA       ASP  12   1.062  -3.979 -11.947
   85    HB2  ASP  12           2HB      ASP  12   1.433  -5.789 -13.417
   86    HB3  ASP  12           3HB      ASP  12   1.185  -6.531 -11.839
   87    H    LYS  13           H        LYS  13  -2.302  -4.885 -12.174
   88    HA   LYS  13           HA       LYS  13  -2.615  -3.537 -14.738
   89    HB2  LYS  13           2HB      LYS  13  -4.063  -5.556 -13.262
   90    HB3  LYS  13           3HB      LYS  13  -5.142  -4.254 -13.746
   91    HG2  LYS  13           2HG      LYS  13  -3.810  -4.645 -16.052
   92    HG3  LYS  13           3HG      LYS  13  -3.757  -6.274 -15.375
   93    HD2  LYS  13           2HD      LYS  13  -6.379  -5.178 -15.026
   94    HD3  LYS  13           3HD      LYS  13  -5.896  -5.017 -16.716
   95    HE2  LYS  13           2HE      LYS  13  -5.257  -7.437 -16.672
   96    HE3  LYS  13           3HE      LYS  13  -5.970  -7.537 -15.063
   97    HZ1  LYS  13           3HZ      LYS  13  -7.686  -6.368 -17.073
   98    HZ2  LYS  13           1HZ      LYS  13  -8.035  -7.526 -15.890
   99    HZ3  LYS  13           2HZ      LYS  13  -7.303  -7.994 -17.342
  100    H    CYS  14           H        CYS  14  -3.390  -1.533 -14.989
  101    HA   CYS  14           HA       CYS  14  -4.128  -0.046 -12.576
  102    HB2  CYS  14           2HB      CYS  14  -3.606   1.948 -13.788
  103    HB3  CYS  14           3HB      CYS  14  -2.309   0.799 -14.101
  104    H    ILE  15           H        ILE  15  -5.936  -1.917 -13.983
  105    HA   ILE  15           HA       ILE  15  -8.098  -2.057 -14.688
  106    HB   ILE  15           HB       ILE  15  -8.673   0.666 -13.611
  107   HG12  ILE  15          2HG1      ILE  15  -7.942  -1.743 -11.934
  108   HG13  ILE  15          3HG1      ILE  15  -7.072  -0.214 -12.005
  109   HG21  ILE  15          1HG2      ILE  15 -10.286  -1.227 -14.542
  110   HG22  ILE  15          2HG2      ILE  15 -10.176  -1.780 -12.872
  111   HG23  ILE  15          3HG2      ILE  15 -10.760  -0.154 -13.226
  112   HD11  ILE  15          3HD1      ILE  15  -9.620   0.546 -11.309
  113   HD12  ILE  15          1HD1      ILE  15  -9.391  -0.970 -10.438
  114   HD13  ILE  15          2HD1      ILE  15  -8.251   0.357 -10.214
  115    HA   PRO  16           HA       PRO  16  -7.293   0.638 -18.364
  116    HB2  PRO  16           2HB      PRO  16  -7.609  -1.359 -20.175
  117    HB3  PRO  16           3HB      PRO  16  -6.069  -1.023 -19.375
  118    HG2  PRO  16           2HG      PRO  16  -8.122  -3.105 -18.734
  119    HG3  PRO  16           3HG      PRO  16  -6.356  -3.253 -18.782
  120    HD2  PRO  16           2HD      PRO  16  -7.731  -2.968 -16.467
  121    HD3  PRO  16           3HD      PRO  16  -6.095  -2.318 -16.692
  122    H    HIS  17           H        HIS  17  -9.808  -1.585 -17.437
  123    HA   HIS  17           HA       HIS  17 -11.705  -1.280 -19.392
  124    HB2  HIS  17           2HB      HIS  17 -11.726  -1.917 -16.536
  125    HB3  HIS  17           3HB      HIS  17 -13.223  -1.173 -17.090
  126    HD1  HIS  17           HD1      HIS  17 -14.478  -3.423 -16.741
  127    HD2  HIS  17           HD2      HIS  17 -11.421  -3.577 -19.549
  128    HE1  HIS  17           HE1      HIS  17 -14.820  -5.579 -17.989
  129    HA   PRO  18           HA       PRO  18 -13.428   2.726 -17.345
  130    HB2  PRO  18           2HB      PRO  18 -12.039   3.788 -15.268
  131    HB3  PRO  18           3HB      PRO  18 -13.310   2.579 -15.055
  132    HG2  PRO  18           2HG      PRO  18 -10.339   2.217 -15.099
  133    HG3  PRO  18           3HG      PRO  18 -11.538   1.493 -14.012
  134    HD2  PRO  18           2HD      PRO  18 -10.483   0.154 -16.116
  135    HD3  PRO  18           3HD      PRO  18 -12.143  -0.118 -15.546
  136    H    GLY  19           H        GLY  19 -12.463   3.288 -19.444
  137    HA2  GLY  19           2HA      GLY  19 -11.568   5.449 -20.215
  138    HA3  GLY  19           3HA      GLY  19 -10.227   5.193 -19.109
  139    H    CYS  20           H        CYS  20 -11.245   2.360 -20.674
  140    HA   CYS  20           HA       CYS  20  -9.948   2.533 -23.143
  141    HB2  CYS  20           2HB      CYS  20  -8.065   2.636 -21.179
  142    HB3  CYS  20           3HB      CYS  20  -8.157   0.900 -21.460
  143    H    VAL  21           H        VAL  21  -9.203   0.173 -23.845
  144    HA   VAL  21           HA       VAL  21 -11.056  -1.793 -22.686
  145    HB   VAL  21           HB       VAL  21 -10.683  -1.425 -25.659
  146   HG11  VAL  21          1HG1      VAL  21 -12.240  -3.111 -25.959
  147   HG12  VAL  21          2HG1      VAL  21 -11.318  -3.695 -24.573
  148   HG13  VAL  21          3HG1      VAL  21 -12.893  -2.940 -24.330
  149   HG21  VAL  21          3HG2      VAL  21 -12.808  -0.397 -23.803
  150   HG22  VAL  21          1HG2      VAL  21 -11.876   0.486 -25.011
  151   HG23  VAL  21          2HG2      VAL  21 -13.118  -0.658 -25.519
  152    H    HIS  22           H        HIS  22  -8.483  -1.412 -25.128
  153    HA   HIS  22           HA       HIS  22  -7.246  -3.864 -24.064
  154    HB2  HIS  22           2HB      HIS  22  -7.150  -3.033 -26.965
  155    HB3  HIS  22           3HB      HIS  22  -6.624  -4.562 -26.265
  156    HD1  HIS  22           HD1      HIS  22  -8.491  -6.261 -25.601
  157    HD2  HIS  22           HD2      HIS  22  -9.861  -2.849 -27.536
  158    HE1  HIS  22           HE1      HIS  22 -10.854  -6.780 -26.288
  159    H    GLY  23           H        GLY  23  -4.876  -4.017 -24.803
  160    HA2  GLY  23           2HA      GLY  23  -2.903  -2.745 -25.468
  161    HA3  GLY  23           3HA      GLY  23  -3.652  -1.330 -24.742
  162    H    ILE  24           H        ILE  24  -2.013  -0.863 -23.320
  163    HA   ILE  24           HA       ILE  24  -1.886  -2.578 -20.973
  164    HB   ILE  24           HB       ILE  24   0.556  -2.558 -20.871
  165   HG12  ILE  24          2HG1      ILE  24   1.112  -1.933 -23.632
  166   HG13  ILE  24          3HG1      ILE  24   0.312  -0.572 -22.853
  167   HG21  ILE  24          1HG2      ILE  24   0.917  -4.339 -22.327
  168   HG22  ILE  24          2HG2      ILE  24  -0.827  -4.363 -22.071
  169   HG23  ILE  24          3HG2      ILE  24  -0.163  -3.679 -23.555
  170   HD11  ILE  24          3HD1      ILE  24   2.024  -0.279 -21.325
  171   HD12  ILE  24          1HD1      ILE  24   2.643  -1.914 -21.554
  172   HD13  ILE  24          2HD1      ILE  24   2.875  -0.699 -22.811
  173    H    CYS  25           H        CYS  25  -0.090  -1.405 -19.437
  174    HA   CYS  25           HA       CYS  25   0.075   1.407 -19.561
  175    HB2  CYS  25           2HB      CYS  25  -1.541   2.095 -17.937
  176    HB3  CYS  25           3HB      CYS  25  -2.393   1.129 -19.137
  177    H    ASN  26           H        ASN  26   1.363   2.250 -17.935
  178    HA   ASN  26           HA       ASN  26   2.473   0.257 -16.071
  179    HB2  ASN  26           2HB      ASN  26   4.223   0.894 -17.513
  180    HB3  ASN  26           3HB      ASN  26   3.733   2.586 -17.503
  181   HD21  ASN  26          1HD2      ASN  26   4.575   3.928 -16.026
  182   HD22  ASN  26          2HD2      ASN  26   5.668   3.451 -14.776
  183    H    GLU  27           H        GLU  27   1.016   3.383 -16.384
  184    HA   GLU  27           HA       GLU  27   1.433   3.906 -13.521
  185    HB2  GLU  27           2HB      GLU  27   1.191   5.622 -15.897
  186    HB3  GLU  27           3HB      GLU  27   0.271   6.178 -14.506
  187    HG2  GLU  27           2HG      GLU  27   2.400   5.936 -13.167
  188    HG3  GLU  27           3HG      GLU  27   3.231   5.723 -14.707
  189    HA   PRO  28           HA       PRO  28  -2.784   3.252 -12.512
  190    HB2  PRO  28           2HB      PRO  28  -3.284   5.253 -10.747
  191    HB3  PRO  28           3HB      PRO  28  -2.266   3.861 -10.358
  192    HG2  PRO  28           2HG      PRO  28  -1.463   6.621 -11.193
  193    HG3  PRO  28           3HG      PRO  28  -0.772   5.590  -9.927
  194    HD2  PRO  28           2HD      PRO  28   0.370   5.865 -12.367
  195    HD3  PRO  28           3HD      PRO  28   0.468   4.359 -11.431
  196    H    TRP  29           H        TRP  29  -4.622   3.637 -13.571
  197    HA   TRP  29           HA       TRP  29  -6.261   4.668 -14.762
  198    HB2  TRP  29           2HB      TRP  29  -5.238   7.268 -13.612
  199    HB3  TRP  29           3HB      TRP  29  -6.860   6.920 -14.205
  200    HD1  TRP  29           HD1      TRP  29  -5.404   7.576 -11.081
  201    HE1  TRP  29           HE1      TRP  29  -6.534   6.321  -9.139
  202    HE3  TRP  29           HE3      TRP  29  -7.907   4.015 -13.763
  203    HZ2  TRP  29           HZ2      TRP  29  -8.259   4.113  -8.790
  204    HZ3  TRP  29           HZ3      TRP  29  -9.274   2.369 -12.549
  205    HH2  TRP  29           HH2      TRP  29  -9.445   2.418 -10.114
  206    H    GLN  30           H        GLN  30  -5.072   4.069 -16.679
  207    HA   GLN  30           HA       GLN  30  -4.385   6.401 -18.268
  208    HB2  GLN  30           2HB      GLN  30  -2.398   4.563 -17.226
  209    HB3  GLN  30           3HB      GLN  30  -2.389   4.586 -18.984
  210    HG2  GLN  30           2HG      GLN  30  -2.552   7.265 -18.157
  211    HG3  GLN  30           3HG      GLN  30  -1.331   6.496 -17.143
  212   HE21  GLN  30          1HE2      GLN  30   0.524   5.653 -18.094
  213   HE22  GLN  30          2HE2      GLN  30   1.009   6.079 -19.697
  214    H    CYS  31           H        CYS  31  -3.622   5.426 -20.574
  215    HA   CYS  31           HA       CYS  31  -5.014   3.033 -21.339
  216    HB2  CYS  31           2HB      CYS  31  -6.936   4.478 -21.274
  217    HB3  CYS  31           3HB      CYS  31  -6.087   5.732 -22.171
  218    H    LEU  32           H        LEU  32  -3.233   2.275 -22.360
  219    HA   LEU  32           HA       LEU  32  -2.070   3.945 -24.489
  220    HB2  LEU  32           2HB      LEU  32  -0.818   1.553 -23.155
  221    HB3  LEU  32           3HB      LEU  32  -0.045   2.679 -24.268
  222    HG   LEU  32           HG       LEU  32  -0.993   3.347 -21.482
  223   HD11  LEU  32          1HD1      LEU  32   0.907   1.888 -21.363
  224   HD12  LEU  32          2HD1      LEU  32   1.437   3.531 -21.007
  225   HD13  LEU  32          3HD1      LEU  32   1.760   2.825 -22.590
  226   HD21  LEU  32          3HD2      LEU  32   0.443   5.399 -21.934
  227   HD22  LEU  32          1HD2      LEU  32  -1.122   5.323 -22.745
  228   HD23  LEU  32          2HD2      LEU  32   0.353   4.950 -23.638
  229    H    CYS  33           H        CYS  33  -1.539   2.955 -26.495
  230    HA   CYS  33           HA       CYS  33  -2.077   0.301 -27.187
  231    HB2  CYS  33           2HB      CYS  33  -4.177   0.727 -28.559
  232    HB3  CYS  33           3HB      CYS  33  -4.392   0.647 -26.813
  233    H    GLU  34           H        GLU  34  -1.870  -0.100 -29.473
  234    HA   GLU  34           HA       GLU  34   0.035   1.505 -30.731
  235    HB2  GLU  34           2HB      GLU  34  -1.526  -0.872 -31.402
  236    HB3  GLU  34           3HB      GLU  34  -1.167   0.126 -32.804
  237    HG2  GLU  34           2HG      GLU  34   0.876  -0.702 -32.886
  238    HG3  GLU  34           3HG      GLU  34   1.201  -0.094 -31.263
  239    H    THR  35           H        THR  35  -0.060   2.934 -32.469
  240    HA   THR  35           HA       THR  35  -2.131   4.795 -32.474
  241    HB   THR  35           HB       THR  35  -0.183   4.269 -34.727
  242    HG1  THR  35           HG1      THR  35   0.014   5.864 -32.374
  243   HG21  THR  35          3HG2      THR  35  -1.359   5.874 -35.755
  244   HG22  THR  35          1HG2      THR  35  -0.676   6.982 -34.566
  245   HG23  THR  35          2HG2      THR  35  -2.262   6.261 -34.292
  246    H    ASN  36           H        ASN  36  -1.747   1.841 -34.273
  247    HA   ASN  36           HA       ASN  36  -3.427   2.229 -36.427
  248    HB2  ASN  36           2HB      ASN  36  -2.941  -0.234 -34.749
  249    HB3  ASN  36           3HB      ASN  36  -3.897  -0.259 -36.228
  250   HD21  ASN  36          1HD2      ASN  36  -2.604   1.201 -37.981
  251   HD22  ASN  36          2HD2      ASN  36  -1.000   0.619 -38.254
  252    H    TRP  37           H        TRP  37  -4.258   1.408 -33.094
  253    HA   TRP  37           HA       TRP  37  -6.964   0.863 -33.416
  254    HB2  TRP  37           2HB      TRP  37  -5.457   2.100 -31.111
  255    HB3  TRP  37           3HB      TRP  37  -7.165   1.676 -31.019
  256    HD1  TRP  37           HD1      TRP  37  -3.738  -0.030 -31.584
  257    HE1  TRP  37           HE1      TRP  37  -3.914  -2.462 -30.759
  258    HE3  TRP  37           HE3      TRP  37  -8.715  -0.135 -30.419
  259    HZ2  TRP  37           HZ2      TRP  37  -5.899  -4.195 -29.749
  260    HZ3  TRP  37           HZ3      TRP  37  -9.674  -2.219 -29.529
  261    HH2  TRP  37           HH2      TRP  37  -8.294  -4.206 -29.202
  262    H    GLY  38           H        GLY  38  -8.838   2.187 -32.920
  263    HA2  GLY  38           2HA      GLY  38  -8.422   5.055 -33.479
  264    HA3  GLY  38           3HA      GLY  38  -9.640   4.134 -34.349
  265    H    GLY  39           H        GLY  39  -8.848   5.790 -31.431
  266    HA2  GLY  39           2HA      GLY  39 -11.278   6.530 -30.601
  267    HA3  GLY  39           3HA      GLY  39 -11.227   4.867 -30.035
  268    H    GLN  40           H        GLN  40 -11.423   7.291 -28.457
  269    HA   GLN  40           HA       GLN  40  -8.942   7.937 -27.272
  270    HB2  GLN  40           2HB      GLN  40 -10.373   8.829 -25.399
  271    HB3  GLN  40           3HB      GLN  40 -10.744   9.467 -26.995
  272    HG2  GLN  40           2HG      GLN  40 -12.355   7.184 -26.628
  273    HG3  GLN  40           3HG      GLN  40 -12.455   8.137 -25.148
  274   HE21  GLN  40          1HE2      GLN  40 -12.109   9.059 -28.551
  275   HE22  GLN  40          2HE2      GLN  40 -13.516  10.060 -28.603
  276    H    LEU  41           H        LEU  41 -11.360   5.483 -26.581
  277    HA   LEU  41           HA       LEU  41  -9.834   4.565 -24.261
  278    HB2  LEU  41           2HB      LEU  41 -12.366   3.308 -25.242
  279    HB3  LEU  41           3HB      LEU  41 -11.710   3.356 -23.606
  280    HG   LEU  41           HG       LEU  41 -12.914   5.705 -25.070
  281   HD11  LEU  41          1HD1      LEU  41 -14.858   4.755 -24.532
  282   HD12  LEU  41          2HD1      LEU  41 -14.459   5.160 -22.863
  283   HD13  LEU  41          3HD1      LEU  41 -14.085   3.556 -23.494
  284   HD21  LEU  41          3HD2      LEU  41 -12.928   6.428 -22.510
  285   HD22  LEU  41          1HD2      LEU  41 -11.564   6.758 -23.578
  286   HD23  LEU  41          2HD2      LEU  41 -11.510   5.379 -22.480
  287    H    CYS  42           H        CYS  42  -8.938   4.268 -27.082
  288    HA   CYS  42           HA       CYS  42  -8.003   2.713 -28.460
  289    HB2  CYS  42           2HB      CYS  42  -7.828   1.094 -25.910
  290    HB3  CYS  42           3HB      CYS  42  -6.855   0.866 -27.360
  291    H    ASP  43           H        ASP  43 -10.530   2.643 -28.991
  292    HA   ASP  43           HA       ASP  43 -11.320  -0.196 -28.917
  293    HB2  ASP  43           2HB      ASP  43 -13.598   0.417 -28.833
  294    HB3  ASP  43           3HB      ASP  43 -12.801   1.488 -27.684
  295    H    LYS  44           H        LYS  44 -12.965  -0.634 -30.789
  296    HA   LYS  44           HA       LYS  44 -11.546  -0.038 -33.236
  297    HB2  LYS  44           2HB      LYS  44 -14.009  -1.717 -32.728
  298    HB3  LYS  44           3HB      LYS  44 -13.163  -1.607 -34.267
  299    HG2  LYS  44           2HG      LYS  44 -11.485  -2.957 -33.598
  300    HG3  LYS  44           3HG      LYS  44 -11.523  -2.364 -31.936
  301    HD2  LYS  44           2HD      LYS  44 -12.279  -4.560 -31.746
  302    HD3  LYS  44           3HD      LYS  44 -13.770  -3.615 -31.770
  303    HE2  LYS  44           2HE      LYS  44 -13.348  -4.085 -34.427
  304    HE3  LYS  44           3HE      LYS  44 -12.739  -5.568 -33.695
  305    HZ1  LYS  44           3HZ      LYS  44 -15.137  -4.958 -32.432
  306    HZ2  LYS  44           1HZ      LYS  44 -14.823  -6.239 -33.491
  307    HZ3  LYS  44           2HZ      LYS  44 -15.411  -4.771 -34.090
  Start of MODEL   20
    1    H1   ARG   1           H        ARG   1  -2.885  -7.447  -1.560
    2    HA   ARG   1           HA       ARG   1  -4.225  -5.683  -0.955
    3    HB2  ARG   1           2HB      ARG   1  -2.795  -6.155   1.409
    4    HB3  ARG   1           3HB      ARG   1  -2.606  -4.436   1.090
    5    HG2  ARG   1           2HG      ARG   1  -4.594  -4.117   2.006
    6    HG3  ARG   1           3HG      ARG   1  -5.307  -4.977   0.640
    7    HD2  ARG   1           2HD      ARG   1  -4.316  -6.256   3.186
    8    HD3  ARG   1           3HD      ARG   1  -6.004  -5.908   2.812
    9    HE   ARG   1           HE       ARG   1  -5.112  -7.438   0.721
   10   HH11  ARG   1          1HH1      ARG   1  -5.291  -7.804   4.178
   11   HH12  ARG   1          2HH1      ARG   1  -5.474  -9.526   4.117
   12   HH21  ARG   1          1HH2      ARG   1  -5.352  -9.704   0.627
   13   HH22  ARG   1          2HH2      ARG   1  -5.508 -10.606   2.097
   14    H    CYS   2           H        CYS   2  -4.238  -4.067  -2.358
   15    HA   CYS   2           HA       CYS   2  -1.743  -2.566  -2.806
   16    HB2  CYS   2           2HB      CYS   2  -4.070  -2.816  -4.718
   17    HB3  CYS   2           3HB      CYS   2  -2.478  -2.142  -5.055
   18    H    GLN   3           H        GLN   3  -2.587  -0.366  -4.072
   19    HA   GLN   3           HA       GLN   3  -4.302   0.948  -2.073
   20    HB2  GLN   3           2HB      GLN   3  -3.143   3.015  -2.595
   21    HB3  GLN   3           3HB      GLN   3  -1.977   1.770  -2.169
   22    HG2  GLN   3           2HG      GLN   3  -2.307   1.626  -4.954
   23    HG3  GLN   3           3HG      GLN   3  -2.165   3.336  -4.550
   24   HE21  GLN   3          1HE2      GLN   3  -0.531   0.403  -4.978
   25   HE22  GLN   3          2HE2      GLN   3   1.039   0.924  -4.482
   26    H    TYR   4           H        TYR   4  -4.975   3.244  -3.292
   27    HA   TYR   4           HA       TYR   4  -7.022   2.412  -5.092
   28    HB2  TYR   4           2HB      TYR   4  -6.967   4.404  -3.388
   29    HB3  TYR   4           3HB      TYR   4  -6.258   5.288  -4.735
   30    HD1  TYR   4           HD1      TYR   4  -9.246   3.352  -3.696
   31    HD2  TYR   4           HD2      TYR   4  -7.609   6.128  -6.473
   32    HE1  TYR   4           HE1      TYR   4 -11.497   3.768  -4.597
   33    HE2  TYR   4           HE2      TYR   4  -9.854   6.553  -7.381
   34    HH   TYR   4           HH       TYR   4 -12.026   5.455  -7.510
   35    H    GLY   5           H        GLY   5  -7.205   2.673  -7.275
   36    HA2  GLY   5           2HA      GLY   5  -6.598   3.154  -9.448
   37    HA3  GLY   5           3HA      GLY   5  -5.376   4.247  -8.814
   38    H    TRP   6           H        TRP   6  -5.320   1.029  -7.625
   39    HA   TRP   6           HA       TRP   6  -3.492   0.052  -9.644
   40    HB2  TRP   6           2HB      TRP   6  -2.580   0.773  -6.863
   41    HB3  TRP   6           3HB      TRP   6  -1.735  -0.427  -7.838
   42    HD1  TRP   6           HD1      TRP   6  -1.497   3.073  -7.016
   43    HE1  TRP   6           HE1      TRP   6  -0.188   4.393  -8.797
   44    HE3  TRP   6           HE3      TRP   6  -1.581  -0.364 -10.800
   45    HZ2  TRP   6           HZ2      TRP   6   0.692   4.026 -11.454
   46    HZ3  TRP   6           HZ3      TRP   6  -0.483   0.198 -12.929
   47    HH2  TRP   6           HH2      TRP   6   0.629   2.348 -13.247
   48    H    GLN   7           H        GLN   7  -4.934  -1.645  -9.910
   49    HA   GLN   7           HA       GLN   7  -5.365  -3.396  -7.592
   50    HB2  GLN   7           2HB      GLN   7  -7.221  -4.341  -8.773
   51    HB3  GLN   7           3HB      GLN   7  -7.357  -2.590  -8.875
   52    HG2  GLN   7           2HG      GLN   7  -6.402  -2.668 -11.137
   53    HG3  GLN   7           3HG      GLN   7  -6.336  -4.426 -11.030
   54   HE21  GLN   7          1HE2      GLN   7  -7.655  -3.779 -13.085
   55   HE22  GLN   7          2HE2      GLN   7  -9.369  -3.804 -12.872
   56    H    GLY   8           H        GLY   8  -5.848  -5.792  -8.775
   57    HA2  GLY   8           2HA      GLY   8  -4.864  -7.373 -10.315
   58    HA3  GLY   8           3HA      GLY   8  -3.401  -6.401 -10.301
   59    H    LEU   9           H        LEU   9  -2.844  -8.887  -9.941
   60    HA   LEU   9           HA       LEU   9  -3.096  -9.843  -7.263
   61    HB2  LEU   9           2HB      LEU   9  -2.834 -11.336  -9.192
   62    HB3  LEU   9           3HB      LEU   9  -1.213 -10.698  -9.458
   63    HG   LEU   9           HG       LEU   9  -0.588 -11.600  -7.201
   64   HD11  LEU   9          1HD1      LEU   9  -2.485 -11.946  -5.975
   65   HD12  LEU   9          2HD1      LEU   9  -2.215 -13.575  -6.592
   66   HD13  LEU   9          3HD1      LEU   9  -3.410 -12.530  -7.359
   67   HD21  LEU   9          3HD2      LEU   9  -0.552 -12.785  -9.624
   68   HD22  LEU   9          1HD2      LEU   9  -1.504 -13.957  -8.711
   69   HD23  LEU   9          2HD2      LEU   9   0.113 -13.514  -8.161
   70    H    TYR  10           H        TYR  10  -0.302  -8.654  -9.135
   71    HA   TYR  10           HA       TYR  10   1.122  -8.197  -6.611
   72    HB2  TYR  10           2HB      TYR  10   2.001  -8.583  -9.450
   73    HB3  TYR  10           3HB      TYR  10   3.058  -7.747  -8.317
   74    HD1  TYR  10           HD1      TYR  10   1.344 -10.949  -9.005
   75    HD2  TYR  10           HD2      TYR  10   4.277  -8.944  -6.664
   76    HE1  TYR  10           HE1      TYR  10   2.154 -13.117  -8.174
   77    HE2  TYR  10           HE2      TYR  10   5.096 -11.106  -5.827
   78    HH   TYR  10           HH       TYR  10   3.648 -14.164  -6.913
   79    H    CYS  11           H        CYS  11  -1.040  -6.479  -7.704
   80    HA   CYS  11           HA       CYS  11  -1.533  -4.272  -7.958
   81    HB2  CYS  11           2HB      CYS  11   1.156  -3.757  -6.680
   82    HB3  CYS  11           3HB      CYS  11  -0.259  -2.709  -6.660
   83    H    ASP  12           H        ASP  12  -0.635  -5.333 -10.257
   84    HA   ASP  12           HA       ASP  12   1.068  -3.203 -11.374
   85    HB2  ASP  12           2HB      ASP  12   2.150  -5.494 -11.259
   86    HB3  ASP  12           3HB      ASP  12   0.945  -6.029 -12.427
   87    H    LYS  13           H        LYS  13  -1.420  -2.514 -11.384
   88    HA   LYS  13           HA       LYS  13  -2.161  -2.453 -14.133
   89    HB2  LYS  13           2HB      LYS  13  -3.422  -4.434 -12.383
   90    HB3  LYS  13           3HB      LYS  13  -4.577  -3.384 -13.193
   91    HG2  LYS  13           2HG      LYS  13  -3.240  -3.957 -15.329
   92    HG3  LYS  13           3HG      LYS  13  -2.624  -5.310 -14.377
   93    HD2  LYS  13           2HD      LYS  13  -5.553  -4.878 -14.345
   94    HD3  LYS  13           3HD      LYS  13  -4.851  -5.458 -15.857
   95    HE2  LYS  13           2HE      LYS  13  -4.068  -7.422 -14.881
   96    HE3  LYS  13           3HE      LYS  13  -4.163  -6.761 -13.249
   97    HZ1  LYS  13           3HZ      LYS  13  -6.611  -6.761 -13.502
   98    HZ2  LYS  13           1HZ      LYS  13  -5.932  -8.310 -13.552
   99    HZ3  LYS  13           2HZ      LYS  13  -6.435  -7.561 -14.982
  100    H    CYS  14           H        CYS  14  -3.065  -0.536 -14.499
  101    HA   CYS  14           HA       CYS  14  -4.037   1.007 -12.214
  102    HB2  CYS  14           2HB      CYS  14  -3.719   2.957 -13.551
  103    HB3  CYS  14           3HB      CYS  14  -2.305   1.938 -13.800
  104    H    ILE  15           H        ILE  15  -5.583  -1.161 -13.540
  105    HA   ILE  15           HA       ILE  15  -7.704  -1.599 -14.246
  106    HB   ILE  15           HB       ILE  15  -8.614   1.091 -13.328
  107   HG12  ILE  15          2HG1      ILE  15  -7.635  -1.124 -11.515
  108   HG13  ILE  15          3HG1      ILE  15  -6.948   0.490 -11.661
  109   HG21  ILE  15          1HG2      ILE  15  -9.977  -1.030 -14.170
  110   HG22  ILE  15          2HG2      ILE  15  -9.835  -1.469 -12.469
  111   HG23  ILE  15          3HG2      ILE  15 -10.597   0.054 -12.926
  112   HD11  ILE  15          3HD1      ILE  15  -9.126  -0.445 -10.029
  113   HD12  ILE  15          1HD1      ILE  15  -8.232   1.073  -9.957
  114   HD13  ILE  15          2HD1      ILE  15  -9.618   0.916 -11.037
  115    HA   PRO  16           HA       PRO  16  -7.171   0.971 -18.061
  116    HB2  PRO  16           2HB      PRO  16  -7.203  -1.146 -19.760
  117    HB3  PRO  16           3HB      PRO  16  -5.732  -0.576 -18.963
  118    HG2  PRO  16           2HG      PRO  16  -7.519  -2.862 -18.229
  119    HG3  PRO  16           3HG      PRO  16  -5.748  -2.789 -18.250
  120    HD2  PRO  16           2HD      PRO  16  -7.189  -2.554 -15.969
  121    HD3  PRO  16           3HD      PRO  16  -5.643  -1.716 -16.213
  122    H    HIS  17           H        HIS  17  -9.405  -1.497 -17.037
  123    HA   HIS  17           HA       HIS  17 -11.290  -1.543 -19.025
  124    HB2  HIS  17           2HB      HIS  17 -11.276  -2.025 -16.143
  125    HB3  HIS  17           3HB      HIS  17 -12.844  -1.485 -16.737
  126    HD1  HIS  17           HD1      HIS  17 -14.179  -3.580 -16.820
  127    HD2  HIS  17           HD2      HIS  17 -10.417  -4.053 -18.519
  128    HE1  HIS  17           HE1      HIS  17 -14.177  -5.889 -17.819
  129    HA   PRO  18           HA       PRO  18 -13.534   2.328 -17.240
  130    HB2  PRO  18           2HB      PRO  18 -12.328   3.673 -15.214
  131    HB3  PRO  18           3HB      PRO  18 -13.443   2.329 -14.944
  132    HG2  PRO  18           2HG      PRO  18 -10.449   2.339 -14.933
  133    HG3  PRO  18           3HG      PRO  18 -11.570   1.534 -13.818
  134    HD2  PRO  18           2HD      PRO  18 -10.317   0.218 -15.826
  135    HD3  PRO  18           3HD      PRO  18 -11.941  -0.225 -15.261
  136    H    GLY  19           H        GLY  19 -12.501   2.790 -19.379
  137    HA2  GLY  19           2HA      GLY  19 -11.899   5.048 -20.244
  138    HA3  GLY  19           3HA      GLY  19 -10.543   4.991 -19.128
  139    H    CYS  20           H        CYS  20 -11.216   1.982 -20.521
  140    HA   CYS  20           HA       CYS  20  -9.931   2.185 -23.005
  141    HB2  CYS  20           2HB      CYS  20  -8.070   2.624 -21.139
  142    HB3  CYS  20           3HB      CYS  20  -8.041   0.864 -21.123
  143    H    VAL  21           H        VAL  21  -9.380   0.043 -23.917
  144    HA   VAL  21           HA       VAL  21 -10.941  -2.088 -22.608
  145    HB   VAL  21           HB       VAL  21 -10.467  -1.797 -25.575
  146   HG11  VAL  21          1HG1      VAL  21 -11.952  -3.575 -25.867
  147   HG12  VAL  21          2HG1      VAL  21 -10.959  -4.075 -24.497
  148   HG13  VAL  21          3HG1      VAL  21 -12.582  -3.441 -24.225
  149   HG21  VAL  21          3HG2      VAL  21 -12.546  -0.653 -23.801
  150   HG22  VAL  21          1HG2      VAL  21 -11.881  -0.040 -25.315
  151   HG23  VAL  21          2HG2      VAL  21 -13.085  -1.329 -25.339
  152    H    HIS  22           H        HIS  22  -8.225  -1.520 -24.839
  153    HA   HIS  22           HA       HIS  22  -6.875  -3.845 -23.650
  154    HB2  HIS  22           2HB      HIS  22  -6.921  -3.186 -26.603
  155    HB3  HIS  22           3HB      HIS  22  -6.040  -4.514 -25.852
  156    HD1  HIS  22           HD1      HIS  22  -7.484  -6.508 -24.929
  157    HD2  HIS  22           HD2      HIS  22  -9.595  -3.667 -27.105
  158    HE1  HIS  22           HE1      HIS  22  -9.691  -7.583 -25.476
  159    H    GLY  23           H        GLY  23  -4.488  -3.851 -24.200
  160    HA2  GLY  23           2HA      GLY  23  -2.582  -2.493 -24.915
  161    HA3  GLY  23           3HA      GLY  23  -3.473  -1.082 -24.365
  162    H    ILE  24           H        ILE  24  -1.741  -0.450 -23.032
  163    HA   ILE  24           HA       ILE  24  -1.677  -1.889 -20.485
  164    HB   ILE  24           HB       ILE  24   0.734  -1.726 -20.293
  165   HG12  ILE  24          2HG1      ILE  24   1.446  -1.190 -23.023
  166   HG13  ILE  24          3HG1      ILE  24   0.460   0.134 -22.411
  167   HG21  ILE  24          1HG2      ILE  24   0.157  -3.010 -22.948
  168   HG22  ILE  24          2HG2      ILE  24   1.331  -3.498 -21.728
  169   HG23  ILE  24          3HG2      ILE  24  -0.394  -3.697 -21.421
  170   HD11  ILE  24          3HD1      ILE  24   2.711  -0.862 -20.745
  171   HD12  ILE  24          1HD1      ILE  24   3.061   0.148 -22.147
  172   HD13  ILE  24          2HD1      ILE  24   2.018   0.756 -20.861
  173    H    CYS  25           H        CYS  25   0.002  -0.435 -19.029
  174    HA   CYS  25           HA       CYS  25  -0.124   2.368 -19.424
  175    HB2  CYS  25           2HB      CYS  25  -1.768   3.012 -17.815
  176    HB3  CYS  25           3HB      CYS  25  -2.533   1.844 -18.887
  177    H    ASN  26           H        ASN  26   1.091   3.496 -17.915
  178    HA   ASN  26           HA       ASN  26   2.469   1.814 -15.927
  179    HB2  ASN  26           2HB      ASN  26   4.445   3.046 -16.267
  180    HB3  ASN  26           3HB      ASN  26   3.793   2.822 -17.888
  181   HD21  ASN  26          1HD2      ASN  26   2.543   4.604 -18.789
  182   HD22  ASN  26          2HD2      ASN  26   2.976   6.222 -18.366
  183    H    GLU  27           H        GLU  27   0.615   4.674 -16.453
  184    HA   GLU  27           HA       GLU  27   1.049   5.507 -13.663
  185    HB2  GLU  27           2HB      GLU  27   0.600   6.985 -16.169
  186    HB3  GLU  27           3HB      GLU  27  -0.334   7.568 -14.800
  187    HG2  GLU  27           2HG      GLU  27   1.649   7.948 -13.521
  188    HG3  GLU  27           3HG      GLU  27   2.646   7.171 -14.750
  189    HA   PRO  28           HA       PRO  28  -3.073   4.543 -12.518
  190    HB2  PRO  28           2HB      PRO  28  -3.748   6.635 -10.925
  191    HB3  PRO  28           3HB      PRO  28  -2.594   5.388 -10.436
  192    HG2  PRO  28           2HG      PRO  28  -2.075   8.128 -11.524
  193    HG3  PRO  28           3HG      PRO  28  -1.272   7.285 -10.187
  194    HD2  PRO  28           2HD      PRO  28  -0.189   7.452 -12.663
  195    HD3  PRO  28           3HD      PRO  28   0.066   6.052 -11.601
  196    H    TRP  29           H        TRP  29  -4.922   4.640 -13.617
  197    HA   TRP  29           HA       TRP  29  -6.664   5.395 -14.868
  198    HB2  TRP  29           2HB      TRP  29  -5.942   8.169 -13.916
  199    HB3  TRP  29           3HB      TRP  29  -7.514   7.596 -14.467
  200    HD1  TRP  29           HD1      TRP  29  -6.191   8.670 -11.419
  201    HE1  TRP  29           HE1      TRP  29  -7.150   7.430  -9.378
  202    HE3  TRP  29           HE3      TRP  29  -8.152   4.591 -13.796
  203    HZ2  TRP  29           HZ2      TRP  29  -8.551   5.038  -8.846
  204    HZ3  TRP  29           HZ3      TRP  29  -9.285   2.872 -12.448
  205    HH2  TRP  29           HH2      TRP  29  -9.479   3.093 -10.024
  206    H    GLN  30           H        GLN  30  -5.511   4.815 -16.779
  207    HA   GLN  30           HA       GLN  30  -5.174   7.017 -18.585
  208    HB2  GLN  30           2HB      GLN  30  -2.839   5.762 -17.339
  209    HB3  GLN  30           3HB      GLN  30  -2.777   5.768 -19.097
  210    HG2  GLN  30           2HG      GLN  30  -3.628   8.333 -18.228
  211    HG3  GLN  30           3HG      GLN  30  -2.202   7.873 -17.300
  212   HE21  GLN  30          1HE2      GLN  30  -0.243   7.710 -18.307
  213   HE22  GLN  30          2HE2      GLN  30   0.029   8.203 -19.940
  214    H    CYS  31           H        CYS  31  -4.297   6.101 -20.781
  215    HA   CYS  31           HA       CYS  31  -5.050   3.328 -21.225
  216    HB2  CYS  31           2HB      CYS  31  -7.192   4.389 -21.480
  217    HB3  CYS  31           3HB      CYS  31  -6.504   5.650 -22.498
  218    H    LEU  32           H        LEU  32  -3.684   2.433 -22.621
  219    HA   LEU  32           HA       LEU  32  -2.297   4.184 -24.543
  220    HB2  LEU  32           2HB      LEU  32  -1.149   1.760 -23.169
  221    HB3  LEU  32           3HB      LEU  32  -0.311   2.826 -24.295
  222    HG   LEU  32           HG       LEU  32  -1.223   3.491 -21.499
  223   HD11  LEU  32          1HD1      LEU  32   1.115   3.688 -21.004
  224   HD12  LEU  32          2HD1      LEU  32   1.543   3.399 -22.690
  225   HD13  LEU  32          3HD1      LEU  32   0.825   2.107 -21.729
  226   HD21  LEU  32          3HD2      LEU  32   0.419   5.523 -22.478
  227   HD22  LEU  32          1HD2      LEU  32  -1.310   5.615 -22.145
  228   HD23  LEU  32          2HD2      LEU  32  -0.745   5.206 -23.765
  229    H    CYS  33           H        CYS  33  -1.579   3.143 -26.514
  230    HA   CYS  33           HA       CYS  33  -2.325   0.524 -27.240
  231    HB2  CYS  33           2HB      CYS  33  -4.128   1.200 -28.902
  232    HB3  CYS  33           3HB      CYS  33  -4.598   1.195 -27.205
  233    H    GLU  34           H        GLU  34  -2.546   0.524 -29.859
  234    HA   GLU  34           HA       GLU  34  -0.096   1.847 -30.746
  235    HB2  GLU  34           2HB      GLU  34  -1.423  -0.660 -31.344
  236    HB3  GLU  34           3HB      GLU  34  -1.039   0.223 -32.816
  237    HG2  GLU  34           2HG      GLU  34   1.307   0.445 -31.946
  238    HG3  GLU  34           3HG      GLU  34   0.856  -0.682 -30.668
  239    H    THR  35           H        THR  35  -0.059   2.652 -33.030
  240    HA   THR  35           HA       THR  35  -1.821   4.764 -33.382
  241    HB   THR  35           HB       THR  35  -0.241   3.347 -35.538
  242    HG1  THR  35           HG1      THR  35   0.909   4.237 -33.625
  243   HG21  THR  35          3HG2      THR  35  -0.320   5.956 -36.255
  244   HG22  THR  35          1HG2      THR  35  -1.906   5.778 -35.507
  245   HG23  THR  35          2HG2      THR  35  -1.445   4.736 -36.853
  246    H    ASN  36           H        ASN  36  -1.901   1.524 -34.816
  247    HA   ASN  36           HA       ASN  36  -3.998   1.861 -36.597
  248    HB2  ASN  36           2HB      ASN  36  -2.492  -0.291 -35.621
  249    HB3  ASN  36           3HB      ASN  36  -4.167  -0.713 -35.278
  250   HD21  ASN  36          1HD2      ASN  36  -2.198   0.658 -37.891
  251   HD22  ASN  36          2HD2      ASN  36  -2.986  -0.203 -39.165
  252    H    TRP  37           H        TRP  37  -4.055   1.410 -33.124
  253    HA   TRP  37           HA       TRP  37  -6.869   0.940 -32.948
  254    HB2  TRP  37           2HB      TRP  37  -4.836   1.762 -30.866
  255    HB3  TRP  37           3HB      TRP  37  -6.515   1.370 -30.504
  256    HD1  TRP  37           HD1      TRP  37  -3.425  -0.356 -32.099
  257    HE1  TRP  37           HE1      TRP  37  -3.531  -2.860 -31.516
  258    HE3  TRP  37           HE3      TRP  37  -7.901  -0.424 -29.631
  259    HZ2  TRP  37           HZ2      TRP  37  -5.282  -4.631 -30.186
  260    HZ3  TRP  37           HZ3      TRP  37  -8.721  -2.564 -28.734
  261    HH2  TRP  37           HH2      TRP  37  -7.437  -4.623 -29.008
  262    H    GLY  38           H        GLY  38  -8.493   2.362 -32.928
  263    HA2  GLY  38           2HA      GLY  38  -7.795   5.224 -32.702
  264    HA3  GLY  38           3HA      GLY  38  -9.091   4.608 -33.716
  265    H    GLY  39           H        GLY  39 -10.524   6.078 -32.652
  266    HA2  GLY  39           2HA      GLY  39 -12.337   6.310 -31.227
  267    HA3  GLY  39           3HA      GLY  39 -11.798   4.877 -30.363
  268    H    GLN  40           H        GLN  40 -12.371   6.050 -28.423
  269    HA   GLN  40           HA       GLN  40 -10.399   8.109 -27.688
  270    HB2  GLN  40           2HB      GLN  40 -13.218   8.058 -27.435
  271    HB3  GLN  40           3HB      GLN  40 -12.558   7.940 -25.809
  272    HG2  GLN  40           2HG      GLN  40 -11.082   9.932 -27.138
  273    HG3  GLN  40           3HG      GLN  40 -12.782  10.221 -27.505
  274   HE21  GLN  40          1HE2      GLN  40 -13.927  11.303 -26.065
  275   HE22  GLN  40          2HE2      GLN  40 -13.486  11.576 -24.417
  276    H    LEU  41           H        LEU  41 -11.752   5.017 -26.867
  277    HA   LEU  41           HA       LEU  41  -9.991   4.877 -24.510
  278    HB2  LEU  41           2HB      LEU  41 -12.241   2.973 -25.029
  279    HB3  LEU  41           3HB      LEU  41 -11.458   3.377 -23.502
  280    HG   LEU  41           HG       LEU  41 -13.228   5.283 -25.025
  281   HD11  LEU  41          1HD1      LEU  41 -14.367   3.159 -24.248
  282   HD12  LEU  41          2HD1      LEU  41 -15.036   4.675 -23.646
  283   HD13  LEU  41          3HD1      LEU  41 -14.013   3.687 -22.603
  284   HD21  LEU  41          3HD2      LEU  41 -11.469   5.584 -22.820
  285   HD22  LEU  41          1HD2      LEU  41 -13.122   5.727 -22.222
  286   HD23  LEU  41          2HD2      LEU  41 -12.563   6.775 -23.525
  287    H    CYS  42           H        CYS  42  -9.339   4.397 -27.380
  288    HA   CYS  42           HA       CYS  42  -8.206   2.912 -28.685
  289    HB2  CYS  42           2HB      CYS  42  -7.382   1.886 -25.961
  290    HB3  CYS  42           3HB      CYS  42  -6.597   1.452 -27.476
  291    H    ASP  43           H        ASP  43 -10.040   1.910 -29.586
  292    HA   ASP  43           HA       ASP  43 -10.359  -0.876 -28.754
  293    HB2  ASP  43           2HB      ASP  43 -12.853  -0.655 -29.133
  294    HB3  ASP  43           3HB      ASP  43 -12.235   0.127 -27.680
  295    H    LYS  44           H        LYS  44 -11.071  -2.280 -30.413
  296    HA   LYS  44           HA       LYS  44 -10.059  -1.737 -32.959
  297    HB2  LYS  44           2HB      LYS  44 -11.060  -3.825 -33.646
  298    HB3  LYS  44           3HB      LYS  44 -10.410  -4.009 -32.023
  299    HG2  LYS  44           2HG      LYS  44 -12.987  -3.249 -31.527
  300    HG3  LYS  44           3HG      LYS  44 -13.155  -4.231 -32.984
  301    HD2  LYS  44           2HD      LYS  44 -11.750  -5.977 -31.803
  302    HD3  LYS  44           3HD      LYS  44 -11.966  -5.025 -30.334
  303    HE2  LYS  44           2HE      LYS  44 -13.702  -6.521 -30.153
  304    HE3  LYS  44           3HE      LYS  44 -14.499  -5.174 -30.966
  305    HZ1  LYS  44           3HZ      LYS  44 -14.061  -6.331 -33.093
  306    HZ2  LYS  44           1HZ      LYS  44 -15.092  -7.191 -32.063
  307    HZ3  LYS  44           2HZ      LYS  44 -13.475  -7.660 -32.224