*HEADER    ANTIMICROBIAL PROTEIN                   12-JAN-17   5UI6              
*TITLE     SOLUTION NMR STRUCTURE OF LASSO PEPTIDE ACINETODIN                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ACINETODIN;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 33-50;                                        
*COMPND   5 OTHER_DETAILS: LASSO FOLD                                            
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ACINETOBACTER GYLLENBERGII  CIP 110306T;        
*SOURCE   3 ORGANISM_TAXID: 1217657                                              
*KEYWDS    LASSO PEPTIDE RNAP INHIBITOR, STRUCTURE FROM CYANA 2.1, ANTIMICROBIAL 
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    L.B.BUSHIN,M.METELEV,K.SEVERINOV,M.R.SEYEDSAYAMDOST                   
*REVDAT   1   08-FEB-17 5UI6    0                                                
# Restraints file 1: Acinetodin-final_restraints.upl
  8 GLU  HG2    10 TRP  HE1     5.50            #peak     4 #SUP  0.76  #QF  0.76
 10 TRP  HE1    11 VAL  QG1     3.65            #peak     5 #SUP  0.89  #QF  0.89
 10 TRP  HE1    11 VAL  QG2     4.02            #peak    10 #SUP  0.57  #QF  0.57
 17 TYR  H      18 GLY  H       3.89            #peak    14 #SUP  0.91  #QF  0.91
 16 TYR  HB3    17 TYR  H       2.85            #peak    15 #SUP  0.66  #QF  0.66
 17 TYR  H      18 GLY  HA2     5.16            #peak    18 #SUP  0.84  #QF  0.84
  6 ILE  QD1    17 TYR  H       5.11            #peak    19 #SUP  0.90  #QF  0.90
 17 TYR  H      18 GLY  HA3     5.16            #peak    21 #SUP  0.99  #QF  0.99
  4 GLY  HA2    17 TYR  H       5.11            #peak    23 #SUP  0.85  #QF  0.85
  8 GLU  HG2    17 TYR  H       4.00            #peak    24 #SUP  0.43  #QF  0.43
  5 PRO  HG2    17 TYR  H       5.39            #peak    25 #SUP  0.56  #QF  0.56
  5 PRO  HD2    17 TYR  H       4.45            #peak    26 #SUP  0.93  #QF  0.93
  8 GLU  HG3    17 TYR  H       3.72            #peak    30 #SUP  0.92  #QF  0.92
  4 GLY  HA3    17 TYR  H       3.80            #peak    33 #SUP  0.65  #QF  0.65
 16 TYR  QD     17 TYR  H       3.47            #peak    35 #SUP  0.64  #QF  0.64
 17 TYR  H      17 TYR  HB3     3.20            #peak    36 #SUP  0.81  #QF  0.81
 16 TYR  HA     17 TYR  H       2.77            #peak    37 #SUP  0.86  #QF  0.86
  2 GLY  H       8 GLU  HG3     5.20            #peak    42 #SUP  0.85  #QF  0.85
  2 GLY  H       3 LYS  HA      5.16            #peak    45 #SUP  0.92  #QF  0.92
  1 GLY  H       2 GLY  H       3.78            #peak    47 #SUP  0.86  #QF  0.86
  2 GLY  H      15 ASN  HB2     4.40            #peak    52 #SUP  0.87  #QF  0.87
  6 ILE  H       7 PHE  H       4.56            #peak    56 #SUP  0.82  #QF  0.82
  7 PHE  H      17 TYR  H       5.35            #peak    58 #SUP  0.59  #QF  0.59
  6 ILE  HB      7 PHE  H       4.02            #peak    59 #SUP  0.58  #QF  0.58
  7 PHE  H      16 TYR  HB3     5.50            #peak    64 #SUP  0.77  #QF  0.77
  3 LYS  H       4 GLY  H       3.97            #peak    71 #SUP  0.67  #QF  0.67
  3 LYS  H       3 LYS  HA      2.92            #peak    75 #SUP  0.90  #QF  0.90
  3 LYS  H      16 TYR  HB2     5.50            #peak    76 #SUP  0.67  #QF  0.67
  2 GLY  H       3 LYS  H       3.95            #peak    77 #SUP  0.83  #QF  0.83
  3 LYS  H      16 TYR  QD      5.50            #peak    79 #SUP  0.95  #QF  0.95
  3 LYS  H       3 LYS  QE      5.50            #peak    80 #SUP  0.88  #QF  0.88
  3 LYS  H      17 TYR  HB2     5.50            #peak    81 #SUP  0.27  #QF  0.27
  2 GLY  HA3     3 LYS  H       2.40            #peak    82 #SUP  0.21  #QF  0.21
 12 THR  H      12 THR  HB      3.32            #peak    84 #SUP  0.55  #QF  0.55
 11 VAL  QG2    12 THR  H       3.75            #peak    85 #SUP  0.78  #QF  0.78
 11 VAL  QG1    12 THR  H       5.02            #peak    86 #SUP  0.82  #QF  0.82
 11 VAL  HB     12 THR  H       3.74            #peak    87 #SUP  0.53  #QF  0.53
  6 ILE  H       6 ILE  HA      2.93            #peak    89 #SUP  0.96  #QF  0.96
  6 ILE  H      16 TYR  HB3     4.07            #peak    92 #SUP  0.92  #QF  0.92
  6 ILE  H      17 TYR  QD      4.70            #peak    98 #SUP  0.91  #QF  0.91
  4 GLY  HA3     6 ILE  H       3.86            #peak   101 #SUP  0.61  #QF  0.61
  6 ILE  H       6 ILE  HG13    2.72            #peak   104 #SUP  0.37  #QF  0.37
  6 ILE  H      16 TYR  QD      3.52            #peak   105 #SUP  0.79  #QF  0.79
  5 PRO  HG2     6 ILE  H       2.77            #peak   106 #SUP  0.73  #QF  0.73
  5 PRO  HD2     6 ILE  H       3.02            #peak   108 #SUP  0.83  #QF  0.83
  5 PRO  HD3     6 ILE  H       3.93            #peak   109 #SUP  0.97  #QF  0.97
 14 GLY  HA2    15 ASN  H       2.95            #peak   113 #SUP  0.81  #QF  0.81
 15 ASN  H      15 ASN  HB2     3.50            #peak   116 #SUP  0.92  #QF  0.92
 15 ASN  H      15 ASN  HA      2.91            #peak   118 #SUP  0.77  #QF  0.77
  8 GLU  HB2    15 ASN  H       5.50            #peak   121 #SUP  0.58  #QF  0.58
 15 ASN  H      16 TYR  QD      4.58            #peak   122 #SUP  0.84  #QF  0.84
  8 GLU  H      11 VAL  QG2     5.01            #peak   123 #SUP  0.62  #QF  0.62
  8 GLU  H       9 THR  QG2     5.09            #peak   125 #SUP  0.54  #QF  0.54
  6 ILE  QG2     8 GLU  H       4.61            #peak   126 #SUP  0.67  #QF  0.67
  7 PHE  QE      8 GLU  H       5.50            #peak   131 #SUP  0.81  #QF  0.81
  7 PHE  H       8 GLU  H       3.71            #peak   132 #SUP  0.96  #QF  0.96
  8 GLU  H       8 GLU  HG3     3.06            #peak   134 #SUP  0.40  #QF  0.40
  1 GLY  H      16 TYR  H       3.64            #peak   136 #SUP  0.66  #QF  0.66
  6 ILE  H       8 GLU  H       5.50            #peak   137 #SUP  0.91  #QF  0.91
  8 GLU  H       9 THR  HA      5.50            #peak   138 #SUP  0.30  #QF  0.30
 15 ASN  HA     16 TYR  H       2.80            #peak   141 #SUP  0.36  #QF  0.36
  2 GLY  H      16 TYR  H       2.68            #peak   144 #SUP  0.66  #QF  0.66
  2 GLY  HA3    16 TYR  H       4.25            #peak   146 #SUP  0.70  #QF  0.70
  4 GLY  H       6 ILE  H       5.23            #peak   152 #SUP  0.96  #QF  0.96
  4 GLY  H       4 GLY  HA3     2.85            #peak   154 #SUP  0.94  #QF  0.94
  3 LYS  HG3     4 GLY  H       4.53            #peak   155 #SUP  0.86  #QF  0.86
  3 LYS  HG2     4 GLY  H       4.53            #peak   157 #SUP  0.70  #QF  0.70
  4 GLY  H       4 GLY  HA2     2.82            #peak   159 #SUP  0.45  #QF  0.45
 12 THR  H      13 GLU  H       2.97            #peak   161 #SUP  0.57  #QF  0.57
 12 THR  QG2    13 GLU  H       3.81            #peak   162 #SUP  0.47  #QF  0.47
 11 VAL  QG2    13 GLU  H       2.76            #peak   163 #SUP  0.62  #QF  0.62
 13 GLU  H      13 GLU  HB2     3.01            #peak   164 #SUP  0.63  #QF  0.63
 11 VAL  HA     13 GLU  H       4.36            #peak   166 #SUP  0.90  #QF  0.90
 13 GLU  H      14 GLY  HA2     4.91            #peak   168 #SUP  0.93  #QF  0.93
 13 GLU  H      13 GLU  HB3     3.01            #peak   172 #SUP  0.52  #QF  0.52
  5 PRO  HD3    18 GLY  H       5.50            #peak   173 #SUP  0.66  #QF  0.66
  3 LYS  H      18 GLY  H       5.50            #peak   175 #SUP  0.98  #QF  0.98
 16 TYR  HA     18 GLY  H       5.50            #peak   178 #SUP  0.98  #QF  0.98
  6 ILE  HB     18 GLY  H       4.83            #peak   179 #SUP  0.59  #QF  0.59
  6 ILE  H      18 GLY  H       5.50            #peak   180 #SUP  0.44  #QF  0.44
  6 ILE  QD1    18 GLY  H       4.53            #peak   182 #SUP  0.52  #QF  0.52
  8 GLU  HG2    18 GLY  H       4.83            #peak   183 #SUP  0.91  #QF  0.91
  4 GLY  HA2    18 GLY  H       5.50            #peak   184 #SUP  0.91  #QF  0.91
  6 ILE  HG13   18 GLY  H       5.03            #peak   185 #SUP  0.94  #QF  0.94
  4 GLY  HA3    18 GLY  H       4.04            #peak   187 #SUP  0.39  #QF  0.39
  5 PRO  HD2    18 GLY  H       4.26            #peak   189 #SUP  0.56  #QF  0.56
 17 TYR  HB3    18 GLY  H       3.61            #peak   191 #SUP  0.67  #QF  0.67
  1 GLY  H       8 GLU  HG2     3.87            #peak   194 #SUP  0.83  #QF  0.83
  1 GLY  H       8 GLU  HG3     3.74            #peak   196 #SUP  0.61  #QF  0.61
  1 GLY  H       8 GLU  HB2     4.20            #peak   197 #SUP  0.62  #QF  0.62
  1 GLY  H      15 ASN  HB2     4.76            #peak   200 #SUP  0.80  #QF  0.80
 11 VAL  QG2    14 GLY  H       3.09            #peak   201 #SUP  0.68  #QF  0.68
 13 GLU  HA     14 GLY  H       3.57            #peak   203 #SUP  0.82  #QF  0.82
 13 GLU  H      14 GLY  H       2.73            #peak   204 #SUP  0.86  #QF  0.86
 11 VAL  HB     14 GLY  H       3.86            #peak   205 #SUP  0.70  #QF  0.70
 14 GLY  H      15 ASN  H       3.48            #peak   206 #SUP  0.90  #QF  0.90
 14 GLY  H      15 ASN  HA      4.90            #peak   208 #SUP  0.48  #QF  0.48
  7 PHE  QD     14 GLY  H       4.21            #peak   210 #SUP  0.48  #QF  0.48
 12 THR  QG2    14 GLY  H       5.38            #peak   215 #SUP  0.75  #QF  0.75
  8 GLU  HB2    14 GLY  H       5.50            #peak   216 #SUP  0.45  #QF  0.45
 12 THR  H      14 GLY  H       4.69            #peak   217 #SUP  0.75  #QF  0.75
 14 GLY  H      15 ASN  HB2     5.50            #peak   218 #SUP  0.94  #QF  0.94
 10 TRP  HE3    17 TYR  QE      5.50            #peak   225 #SUP  0.58  #QF  0.58
  9 THR  QG2    10 TRP  HE3     4.32            #peak   228 #SUP  0.38  #QF  0.38
 10 TRP  HE3    11 VAL  QG2     4.81            #peak   235 #SUP  0.30  #QF  0.30
  6 ILE  QG2    10 TRP  HE3     5.28            #peak   236 #SUP  0.60  #QF  0.60
 14 GLY  HA3    15 ASN  HD21    5.22            #peak   238 #SUP  0.64  #QF  0.64
 13 GLU  HB2    15 ASN  HD21    4.57            #peak   239 #SUP  0.90  #QF  0.90
 15 ASN  HB2    15 ASN  HD21    2.82            #peak   242 #SUP  0.65  #QF  0.65
  1 GLY  HA3    15 ASN  HD21    5.15            #peak   243 #SUP  0.85  #QF  0.85
  2 GLY  H      15 ASN  HD21    5.50            #peak   244 #SUP  0.94  #QF  0.94
 13 GLU  HG2    15 ASN  HD21    5.47            #peak   245 #SUP  0.68  #QF  0.68
 13 GLU  HB3    15 ASN  HD21    4.57            #peak   247 #SUP  0.92  #QF  0.92
  1 GLY  HA2    15 ASN  HD21    5.15            #peak   248 #SUP  0.93  #QF  0.93
 15 ASN  H      15 ASN  HD21    4.33            #peak   251 #SUP  0.90  #QF  0.90
 13 GLU  HG3    15 ASN  HD21    5.47            #peak   252 #SUP  0.91  #QF  0.91
  9 THR  QG2    10 TRP  H       4.48            #peak   255 #SUP  0.99  #QF  0.99
  9 THR  HB     10 TRP  H       5.33            #peak   256 #SUP  0.95  #QF  0.95
  7 PHE  HZ     12 THR  QG2     5.50            #peak   258 #SUP  0.54  #QF  0.54
  7 PHE  HZ     14 GLY  H       4.16            #peak   259 #SUP  0.97  #QF  0.97
  7 PHE  HZ     13 GLU  HA      5.50            #peak   262 #SUP  0.84  #QF  0.84
  7 PHE  HZ     15 ASN  H       4.81            #peak   264 #SUP  0.95  #QF  0.95
  7 PHE  HZ     11 VAL  QG2     5.50            #peak   265 #SUP  0.97  #QF  0.97
  7 PHE  HA      7 PHE  QE      5.31            #peak   271 #SUP  0.68  #QF  0.68
  7 PHE  QE     11 VAL  QG2     5.35            #peak   272 #SUP  0.99  #QF  0.99
  7 PHE  QE     15 ASN  HA      5.50            #peak   273 #SUP  0.78  #QF  0.78
  7 PHE  QE     14 GLY  H       4.31            #peak   275 #SUP  1.00
  7 PHE  QE     15 ASN  HB2     5.50            #peak   281 #SUP  0.84  #QF  0.84
  7 PHE  QE     15 ASN  H       3.19            #peak   282 #SUP  0.89  #QF  0.89
  7 PHE  QE     14 GLY  HA2     3.33            #peak   283 #SUP  0.76  #QF  0.76
  7 PHE  H       7 PHE  QE      5.50            #peak   285 #SUP  0.92  #QF  0.92
  7 PHE  QE      9 THR  HA      3.39            #peak   287 #SUP  0.45  #QF  0.45
  8 GLU  HG2    17 TYR  QD      2.66            #peak   291 #SUP  0.72  #QF  0.72
  8 GLU  HG3    17 TYR  QD      3.21            #peak   292 #SUP  0.83  #QF  0.83
 17 TYR  QD     18 GLY  H       2.76            #peak   296 #SUP  0.94  #QF  0.94
 16 TYR  HA     17 TYR  QD      4.00            #peak   297 #SUP  0.69  #QF  0.69
  6 ILE  QD1    17 TYR  QD      3.54            #peak   303 #SUP  0.65  #QF  0.65
 17 TYR  H      17 TYR  QD      3.21            #peak   304 #SUP  0.67  #QF  0.67
  8 GLU  H      17 TYR  QD      3.46            #peak   307 #SUP  0.71  #QF  0.71
  6 ILE  HB     17 TYR  QD      2.79            #peak   308 #SUP  0.29  #QF  0.29
 16 TYR  HB3    17 TYR  QD      4.95            #peak   310 #SUP  0.93  #QF  0.93
  7 PHE  H      17 TYR  QD      5.20            #peak   312 #SUP  0.91  #QF  0.91
 10 TRP  HD1    11 VAL  HB      4.98            #peak   313 #SUP  0.85  #QF  0.85
 10 TRP  HD1    11 VAL  HA      4.15            #peak   317 #SUP  0.87  #QF  0.87
 10 TRP  HA     10 TRP  HD1     4.52            #peak   320 #SUP  0.79  #QF  0.79
 10 TRP  HD1    11 VAL  QG1     3.19            #peak   321 #SUP  0.61  #QF  0.61
 10 TRP  HZ3    17 TYR  HB3     5.38            #peak   323 #SUP  0.73  #QF  0.73
  6 ILE  QG2    10 TRP  HZ3     3.77            #peak   324 #SUP  0.61  #QF  0.61
  8 GLU  HG2    10 TRP  HZ3     4.33            #peak   325 #SUP  0.81  #QF  0.81
  9 THR  HA     10 TRP  HZ3     5.50            #peak   330 #SUP  0.89  #QF  0.89
  8 GLU  HB2    10 TRP  HZ3     5.12            #peak   331 #SUP  0.84  #QF  0.84
  9 THR  QG2    10 TRP  HZ3     4.35            #peak   332 #SUP  0.51  #QF  0.51
  6 ILE  QD1    10 TRP  HZ3     5.01            #peak   333 #SUP  0.57  #QF  0.57
  8 GLU  HG3    10 TRP  HZ3     5.42            #peak   334 #SUP  0.98  #QF  0.98
 17 TYR  QE     18 GLY  H       3.77            #peak   337 #SUP  0.94  #QF  0.94
  6 ILE  QD1    17 TYR  QE      3.03            #peak   338 #SUP  0.76  #QF  0.76
  8 GLU  HG2    17 TYR  QE      4.14            #peak   339 #SUP  0.50  #QF  0.50
  6 ILE  QG2    17 TYR  QE      2.46            #peak   340 #SUP  0.24  #QF  0.24
  8 GLU  HG3    16 TYR  QD      4.73            #peak   342 #SUP  0.74  #QF  0.74
 16 TYR  H      16 TYR  QD      3.05            #peak   346 #SUP  0.63  #QF  0.63
  7 PHE  HA     16 TYR  QD      2.82            #peak   347 #SUP  0.38  #QF  0.38
  3 LYS  HA     16 TYR  QD      3.64            #peak   348 #SUP  0.61  #QF  0.61
  2 GLY  H      16 TYR  QD      4.98            #peak   349 #SUP  0.85  #QF  0.85
 15 ASN  HA     16 TYR  QD      2.78            #peak   351 #SUP  0.51  #QF  0.51
 15 ASN  HB3    16 TYR  QD      4.38            #peak   356 #SUP  0.77  #QF  0.77
  7 PHE  H       7 PHE  QD      3.74            #peak   358 #SUP  0.60  #QF  0.20
  7 PHE  H      16 TYR  QD      4.07            #peak   358 #SUP  0.60  #QF  0.20
  7 PHE  QD      9 THR  HA      4.14            #peak   362 #SUP  0.86  #QF  0.86
  7 PHE  QD     11 VAL  QG2     4.35            #peak   363 #SUP  0.52  #QF  0.52
 15 ASN  HA     16 TYR  QE      4.18            #peak   368 #SUP  0.49  #QF  0.49
  5 PRO  HA     16 TYR  QE      4.56            #peak   371 #SUP  0.78  #QF  0.33
  6 ILE  HA     16 TYR  QE      4.89            #peak   371 #SUP  0.78  #QF  0.33
  7 PHE  HA     16 TYR  QE      3.68            #peak   373 #SUP  0.90  #QF  0.90
  6 ILE  H      16 TYR  QE      5.43            #peak   374 #SUP  0.98  #QF  0.98
 15 ASN  H      16 TYR  QE      5.04            #peak   378 #SUP  0.97  #QF  0.97
  7 PHE  H      16 TYR  QE      3.90            #peak   380 #SUP  0.59  #QF  0.59
 10 TRP  HH2    17 TYR  HB3     5.50            #peak   383 #SUP  0.45  #QF  0.45
  6 ILE  QG2    10 TRP  HH2     5.01            #peak   384 #SUP  0.82  #QF  0.82
  8 GLU  HG2    10 TRP  HH2     5.50            #peak   385 #SUP  0.93  #QF  0.93
 10 TRP  HH2    17 TYR  HB2     5.50            #peak   386 #SUP  0.73  #QF  0.73
  3 LYS  HA     16 TYR  HA      4.99            #peak   391 #SUP  0.79  #QF  0.79
  2 GLY  H      16 TYR  HA      5.50            #peak   392 #SUP  0.76  #QF  0.76
 16 TYR  HA     17 TYR  HB3     5.01            #peak   395 #SUP  0.96  #QF  0.45
 16 TYR  HA     16 TYR  QE      4.89            #peak   396 #SUP  0.98  #QF  0.98
  6 ILE  H      16 TYR  HA      5.50            #peak   397 #SUP  0.99  #QF  0.99
  7 PHE  H      16 TYR  HA      5.50            #peak   398 #SUP  0.99  #QF  0.99
  6 ILE  HB     16 TYR  HA      4.73            #peak   399 #SUP  0.92  #QF  0.92
  6 ILE  QG2    16 TYR  HA      5.50            #peak   400 #SUP  0.69  #QF  0.69
  8 GLU  HG2    16 TYR  HA      3.67            #peak   401 #SUP  0.88  #QF  0.88
  7 PHE  HA     16 TYR  HA      3.16            #peak   404 #SUP  0.63  #QF  0.63
 16 TYR  HA     16 TYR  QD      3.20            #peak   405 #SUP  0.75  #QF  0.75
  8 GLU  HG3    16 TYR  HA      3.25            #peak   407 #SUP  0.61  #QF  0.61
  1 GLY  QA     15 ASN  HD21    4.38            #peak   243
  1 GLY  QA     16 TYR  H       5.34            #peak   143
  3 LYS  QG      4 GLY  H       3.86            #peak   157
  5 PRO  QB      6 ILE  H       3.79            #peak    95
  6 ILE  H      18 GLY  QA      4.13            #peak    93
  7 PHE  QB     16 TYR  HA      4.65            #peak   395
 13 GLU  H      13 GLU  QB      2.59            #peak   164
 13 GLU  QG     14 GLY  H       4.06            #peak   219
 13 GLU  QG     15 ASN  HD21    4.65            #peak   245
 17 TYR  QD     18 GLY  QA      4.13            #peak   300
 17 TYR  QE     18 GLY  QA      4.91            #peak   341
 18 GLY  H      18 GLY  QA      2.43            #peak   190
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1   1.811  -0.001   0.854
    2    HA2  GLY   1          2HA       GLY   1   2.145  -1.013  -1.611
    3    HA3  GLY   1          3HA       GLY   1   1.533   0.594  -1.972
    4    H    GLY   2           H        GLY   2   4.063  -1.063  -0.096
    5    HA2  GLY   2          2HA       GLY   2   6.253   0.161  -1.160
    6    HA3  GLY   2          3HA       GLY   2   5.691   1.305   0.049
    7    H    LYS   3           H        LYS   3   6.253   1.003   2.123
    8    HA   LYS   3           HA       LYS   3   6.770  -1.502   3.313
    9    HB2  LYS   3          2HB       LYS   3   8.831  -0.884   1.710
   10    HB3  LYS   3          3HB       LYS   3   9.329  -0.004   3.149
   11    HG2  LYS   3          2HG       LYS   3   9.023  -2.144   4.433
   12    HG3  LYS   3          3HG       LYS   3   8.820  -2.954   2.878
   13    HD2  LYS   3          2HD       LYS   3  11.221  -1.258   3.518
   14    HD3  LYS   3          3HD       LYS   3  11.153  -2.982   3.888
   15    HE2  LYS   3          2HE       LYS   3  10.328  -2.383   1.164
   16    HE3  LYS   3          3HE       LYS   3  11.973  -1.849   1.506
   17    HZ1  LYS   3          1HZ       LYS   3  10.931  -4.591   1.977
   18    HZ2  LYS   3          2HZ       LYS   3  12.518  -4.071   2.247
   19    HZ3  LYS   3          3HZ       LYS   3  11.903  -4.126   0.672
   20    H    GLY   4           H        GLY   4   6.392  -1.236   5.415
   21    HA2  GLY   4          2HA       GLY   4   7.535   0.624   7.111
   22    HA3  GLY   4          3HA       GLY   4   6.047   1.361   6.533
   23    HA   PRO   5           HA       PRO   5   5.115  -1.195  10.309
   24    HB2  PRO   5          2HB       PRO   5   3.748   0.763  11.602
   25    HB3  PRO   5          3HB       PRO   5   5.501   0.571  11.728
   26    HG2  PRO   5          2HG       PRO   5   3.919   2.456  10.023
   27    HG3  PRO   5          3HG       PRO   5   5.387   2.766  10.969
   28    HD2  PRO   5          2HD       PRO   5   5.438   2.358   8.292
   29    HD3  PRO   5          3HD       PRO   5   6.767   1.861   9.359
   30    H    ILE   6           H        ILE   6   3.051   1.175   8.638
   31    HA   ILE   6           HA       ILE   6   0.660  -0.349   9.193
   32    HB   ILE   6           HB       ILE   6   0.891   1.964   7.279
   33   HG12  ILE   6          2HG1      ILE   6   0.457   2.048  10.272
   34   HG13  ILE   6          3HG1      ILE   6   1.880   2.634   9.418
   35   HG21  ILE   6          1HG2      ILE   6  -1.507   1.849   8.843
   36   HG22  ILE   6          2HG2      ILE   6  -1.312   1.775   7.093
   37   HG23  ILE   6          3HG2      ILE   6  -1.230   0.297   8.052
   38   HD11  ILE   6          1HD1      ILE   6   0.896   4.617   9.396
   39   HD12  ILE   6          2HD1      ILE   6  -0.227   3.955   8.208
   40   HD13  ILE   6          3HD1      ILE   6  -0.644   3.938   9.921
   41    H    PHE   7           H        PHE   7  -0.359  -1.744   7.874
   42    HA   PHE   7           HA       PHE   7   1.013  -2.565   5.454
   43    HB2  PHE   7          2HB       PHE   7   0.329  -4.535   6.297
   44    HB3  PHE   7          3HB       PHE   7  -0.866  -3.767   7.336
   45    HD1  PHE   7           HD1      PHE   7  -3.138  -3.362   6.529
   46    HD2  PHE   7           HD2      PHE   7  -0.263  -5.419   4.158
   47    HE1  PHE   7           HE1      PHE   7  -4.939  -4.198   5.076
   48    HE2  PHE   7           HE2      PHE   7  -2.060  -6.257   2.701
   49    HZ   PHE   7           HZ       PHE   7  -4.401  -5.647   3.158
   50    H    GLU   8           H        GLU   8  -1.059  -0.172   6.062
   51    HA   GLU   8           HA       GLU   8  -2.331   1.151   4.705
   52    HB2  GLU   8          2HB       GLU   8  -1.903  -0.842   2.485
   53    HB3  GLU   8          3HB       GLU   8  -2.300   0.864   2.343
   54    HG2  GLU   8          2HG       GLU   8  -0.114   1.481   3.162
   55    HG3  GLU   8          3HG       GLU   8   0.291  -0.214   3.427
   56    H    THR   9           H        THR   9  -4.477   1.300   4.772
   57    HA   THR   9           HA       THR   9  -6.038  -1.196   4.705
   58    HB   THR   9           HB       THR   9  -7.735  -0.057   6.030
   59    HG1  THR   9           HG1      THR   9  -7.438   2.069   6.694
   60   HG21  THR   9          1HG2      THR   9  -5.787  -1.167   7.150
   61   HG22  THR   9          2HG2      THR   9  -6.555   0.097   8.110
   62   HG23  THR   9          3HG2      THR   9  -5.032   0.421   7.282
   63    H    TRP  10           H        TRP  10  -5.795  -0.808   2.282
   64    HA   TRP  10           HA       TRP  10  -8.270   0.051   1.248
   65    HB2  TRP  10          2HB       TRP  10  -7.618   2.004  -0.026
   66    HB3  TRP  10          3HB       TRP  10  -7.276   2.289   1.678
   67    HD1  TRP  10           HD1      TRP  10  -5.491   1.630  -1.657
   68    HE1  TRP  10           HE1      TRP  10  -3.039   2.380  -1.430
   69    HE3  TRP  10           HE3      TRP  10  -5.427   2.693   3.343
   70    HZ2  TRP  10           HZ2      TRP  10  -1.307   3.299   0.600
   71    HZ3  TRP  10           HZ3      TRP  10  -3.332   3.502   4.350
   72    HH2  TRP  10           HH2      TRP  10  -1.316   3.798   3.005
   73    H    VAL  11           H        VAL  11  -4.885  -0.673   0.678
   74    HA   VAL  11           HA       VAL  11  -5.221  -1.371  -2.078
   75    HB   VAL  11           HB       VAL  11  -2.946  -2.469  -1.756
   76   HG11  VAL  11          1HG1      VAL  11  -3.696   0.170  -2.122
   77   HG12  VAL  11          2HG1      VAL  11  -2.450   0.248  -0.875
   78   HG13  VAL  11          3HG1      VAL  11  -2.101  -0.518  -2.425
   79   HG21  VAL  11          1HG2      VAL  11  -3.011  -1.036   0.890
   80   HG22  VAL  11          2HG2      VAL  11  -3.279  -2.771   0.722
   81   HG23  VAL  11          3HG2      VAL  11  -1.733  -2.067   0.247
   82    H    THR  12           H        THR  12  -5.333  -3.084   0.975
   83    HA   THR  12           HA       THR  12  -5.588  -5.320   1.471
   84    HB   THR  12           HB       THR  12  -7.882  -4.562   1.053
   85    HG1  THR  12           HG1      THR  12  -8.720  -6.694   0.503
   86   HG21  THR  12          1HG2      THR  12  -8.896  -5.229  -1.190
   87   HG22  THR  12          2HG2      THR  12  -7.239  -5.341  -1.783
   88   HG23  THR  12          3HG2      THR  12  -7.859  -3.803  -1.182
   89    H    GLU  13           H        GLU  13  -3.475  -5.027  -0.329
   90    HA   GLU  13           HA       GLU  13  -3.808  -7.409  -2.032
   91    HB2  GLU  13          2HB       GLU  13  -3.470  -5.186  -3.223
   92    HB3  GLU  13          3HB       GLU  13  -1.848  -5.176  -2.547
   93    HG2  GLU  13          2HG       GLU  13  -1.094  -6.711  -3.992
   94    HG3  GLU  13          3HG       GLU  13  -2.583  -7.652  -3.932
   95    H    GLY  14           H        GLY  14  -1.677  -5.605   0.115
   96    HA2  GLY  14          2HA       GLY  14  -0.490  -7.134   1.723
   97    HA3  GLY  14          3HA       GLY  14   0.053  -7.994   0.290
   98    H    ASN  15           H        ASN  15   0.048  -4.696   1.643
   99    HA   ASN  15           HA       ASN  15   2.902  -4.504   1.158
  100    HB2  ASN  15          2HB       ASN  15   0.871  -2.792  -0.260
  101    HB3  ASN  15          3HB       ASN  15   2.513  -2.222   0.027
  102   HD21  ASN  15          1HD2      ASN  15   0.505  -3.928  -2.028
  103   HD22  ASN  15          2HD2      ASN  15   1.712  -4.658  -3.025
  104    H    TYR  16           H        TYR  16   3.451  -1.972   1.699
  105    HA   TYR  16           HA       TYR  16   1.938  -1.191   4.082
  106    HB2  TYR  16          2HB       TYR  16   4.921  -1.674   4.005
  107    HB3  TYR  16          3HB       TYR  16   4.092  -0.838   5.313
  108    HD1  TYR  16           HD1      TYR  16   3.154  -2.048   7.084
  109    HD2  TYR  16           HD2      TYR  16   4.223  -4.085   3.505
  110    HE1  TYR  16           HE1      TYR  16   2.713  -4.202   8.186
  111    HE2  TYR  16           HE2      TYR  16   3.784  -6.245   4.596
  112    HH   TYR  16           HH       TYR  16   2.382  -6.427   7.813
  113    H    TYR  17           H        TYR  17   3.248   0.910   4.984
  114    HA   TYR  17           HA       TYR  17   4.390   2.625   3.047
  115    HB2  TYR  17          2HB       TYR  17   2.656   3.801   2.204
  116    HB3  TYR  17          3HB       TYR  17   1.697   2.398   2.662
  117    HD1  TYR  17           HD1      TYR  17   0.437   2.431   4.826
  118    HD2  TYR  17           HD2      TYR  17   2.348   5.897   3.265
  119    HE1  TYR  17           HE1      TYR  17  -0.927   3.843   6.307
  120    HE2  TYR  17           HE2      TYR  17   0.990   7.319   4.743
  121    HH   TYR  17           HH       TYR  17  -1.636   6.010   6.647
  122    H    GLY  18           H        GLY  18   2.599   2.285   6.055
  123    HA2  GLY  18          2HA       GLY  18   3.359   3.013   8.156
  124    HA3  GLY  18          3HA       GLY  18   4.509   4.069   7.349
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1   1.813  -0.005   0.877
    2    HA2  GLY   1          2HA       GLY   1   2.135  -0.994  -1.596
    3    HA3  GLY   1          3HA       GLY   1   1.525   0.617  -1.943
    4    H    GLY   2           H        GLY   2   4.057  -1.057  -0.083
    5    HA2  GLY   2          2HA       GLY   2   6.246   0.170  -1.150
    6    HA3  GLY   2          3HA       GLY   2   5.691   1.306   0.071
    7    H    LYS   3           H        LYS   3   6.260   0.987   2.140
    8    HA   LYS   3           HA       LYS   3   6.777  -1.529   3.308
    9    HB2  LYS   3          2HB       LYS   3   8.857  -0.775   1.707
   10    HB3  LYS   3          3HB       LYS   3   9.352  -0.102   3.254
   11    HG2  LYS   3          2HG       LYS   3   9.805  -2.113   4.124
   12    HG3  LYS   3          3HG       LYS   3   8.378  -2.858   3.400
   13    HD2  LYS   3          2HD       LYS   3  10.300  -3.889   2.430
   14    HD3  LYS   3          3HD       LYS   3   9.588  -2.836   1.206
   15    HE2  LYS   3          2HE       LYS   3  11.464  -1.650   1.048
   16    HE3  LYS   3          3HE       LYS   3  11.509  -1.392   2.792
   17    HZ1  LYS   3          1HZ       LYS   3  12.642  -3.674   1.276
   18    HZ2  LYS   3          2HZ       LYS   3  12.488  -3.670   2.960
   19    HZ3  LYS   3          3HZ       LYS   3  13.478  -2.529   2.199
   20    H    GLY   4           H        GLY   4   6.405  -1.279   5.412
   21    HA2  GLY   4          2HA       GLY   4   7.558   0.566   7.119
   22    HA3  GLY   4          3HA       GLY   4   6.069   1.309   6.554
   23    HA   PRO   5           HA       PRO   5   5.146  -1.276  10.312
   24    HB2  PRO   5          2HB       PRO   5   3.787   0.673  11.625
   25    HB3  PRO   5          3HB       PRO   5   5.540   0.477  11.743
   26    HG2  PRO   5          2HG       PRO   5   3.955   2.379  10.060
   27    HG3  PRO   5          3HG       PRO   5   5.427   2.679  11.003
   28    HD2  PRO   5          2HD       PRO   5   5.467   2.293   8.323
   29    HD3  PRO   5          3HD       PRO   5   6.799   1.785   9.381
   30    H    ILE   6           H        ILE   6   3.079   1.111   8.667
   31    HA   ILE   6           HA       ILE   6   0.688  -0.413   9.219
   32    HB   ILE   6           HB       ILE   6   0.919   1.915   7.322
   33   HG12  ILE   6          2HG1      ILE   6   0.491   1.974  10.318
   34   HG13  ILE   6          3HG1      ILE   6   1.912   2.566   9.465
   35   HG21  ILE   6          1HG2      ILE   6  -1.292   1.765   7.158
   36   HG22  ILE   6          2HG2      ILE   6  -1.199   0.245   8.044
   37   HG23  ILE   6          3HG2      ILE   6  -1.475   1.755   8.912
   38   HD11  ILE   6          1HD1      ILE   6  -0.610   3.868   9.984
   39   HD12  ILE   6          2HD1      ILE   6   0.930   4.550   9.459
   40   HD13  ILE   6          3HD1      ILE   6  -0.197   3.898   8.270
   41    H    PHE   7           H        PHE   7  -0.337  -1.796   7.894
   42    HA   PHE   7           HA       PHE   7   1.024  -2.601   5.463
   43    HB2  PHE   7          2HB       PHE   7   0.340  -4.576   6.295
   44    HB3  PHE   7          3HB       PHE   7  -0.853  -3.813   7.341
   45    HD1  PHE   7           HD1      PHE   7  -3.126  -3.403   6.542
   46    HD2  PHE   7           HD2      PHE   7  -0.257  -5.442   4.148
   47    HE1  PHE   7           HE1      PHE   7  -4.931  -4.226   5.086
   48    HE2  PHE   7           HE2      PHE   7  -2.057  -6.267   2.688
   49    HZ   PHE   7           HZ       PHE   7  -4.397  -5.659   3.155
   50    H    GLU   8           H        GLU   8  -1.042  -0.209   6.096
   51    HA   GLU   8           HA       GLU   8  -2.316   1.126   4.754
   52    HB2  GLU   8          2HB       GLU   8  -1.897  -0.849   2.516
   53    HB3  GLU   8          3HB       GLU   8  -2.292   0.859   2.390
   54    HG2  GLU   8          2HG       GLU   8  -0.103   1.466   3.206
   55    HG3  GLU   8          3HG       GLU   8   0.301  -0.231   3.459
   56    H    THR   9           H        THR   9  -4.462   1.279   4.820
   57    HA   THR   9           HA       THR   9  -6.027  -1.215   4.741
   58    HB   THR   9           HB       THR   9  -6.280  -0.190   6.879
   59    HG1  THR   9           HG1      THR   9  -8.243  -0.909   5.860
   60   HG21  THR   9          1HG2      THR   9  -6.343   2.303   5.298
   61   HG22  THR   9          2HG2      THR   9  -5.683   1.994   6.904
   62   HG23  THR   9          3HG2      THR   9  -7.416   2.250   6.697
   63    H    TRP  10           H        TRP  10  -5.788  -0.808   2.319
   64    HA   TRP  10           HA       TRP  10  -8.264   0.063   1.298
   65    HB2  TRP  10          2HB       TRP  10  -7.612   2.025   0.037
   66    HB3  TRP  10          3HB       TRP  10  -7.265   2.296   1.743
   67    HD1  TRP  10           HD1      TRP  10  -5.489   1.656  -1.602
   68    HE1  TRP  10           HE1      TRP  10  -3.036   2.401  -1.376
   69    HE3  TRP  10           HE3      TRP  10  -5.411   2.686   3.405
   70    HZ2  TRP  10           HZ2      TRP  10  -1.297   3.304   0.656
   71    HZ3  TRP  10           HZ3      TRP  10  -3.313   3.486   4.412
   72    HH2  TRP  10           HH2      TRP  10  -1.300   3.787   3.065
   73    H    VAL  11           H        VAL  11  -4.881  -0.661   0.714
   74    HA   VAL  11           HA       VAL  11  -5.226  -1.340  -2.046
   75    HB   VAL  11           HB       VAL  11  -2.951  -2.445  -1.736
   76   HG11  VAL  11          1HG1      VAL  11  -2.107  -0.493  -2.401
   77   HG12  VAL  11          2HG1      VAL  11  -3.699   0.199  -2.085
   78   HG13  VAL  11          3HG1      VAL  11  -2.446   0.267  -0.846
   79   HG21  VAL  11          1HG2      VAL  11  -3.002  -1.018   0.915
   80   HG22  VAL  11          2HG2      VAL  11  -3.282  -2.751   0.745
   81   HG23  VAL  11          3HG2      VAL  11  -1.733  -2.057   0.266
   82    H    THR  12           H        THR  12  -5.328  -3.074   0.995
   83    HA   THR  12           HA       THR  12  -5.584  -5.314   1.475
   84    HB   THR  12           HB       THR  12  -7.879  -4.551   1.073
   85    HG1  THR  12           HG1      THR  12  -8.614  -6.567   1.136
   86   HG21  THR  12          1HG2      THR  12  -7.250  -5.308  -1.771
   87   HG22  THR  12          2HG2      THR  12  -7.865  -3.774  -1.156
   88   HG23  THR  12          3HG2      THR  12  -8.903  -5.200  -1.169
   89    H    GLU  13           H        GLU  13  -3.478  -5.010  -0.332
   90    HA   GLU  13           HA       GLU  13  -3.822  -7.380  -2.051
   91    HB2  GLU  13          2HB       GLU  13  -3.505  -5.190  -3.263
   92    HB3  GLU  13          3HB       GLU  13  -1.901  -5.105  -2.549
   93    HG2  GLU  13          2HG       GLU  13  -1.505  -5.989  -4.647
   94    HG3  GLU  13          3HG       GLU  13  -1.529  -7.413  -3.608
   95    H    GLY  14           H        GLY  14  -1.694  -5.599   0.114
   96    HA2  GLY  14          2HA       GLY  14  -0.494  -7.137   1.699
   97    HA3  GLY  14          3HA       GLY  14   0.043  -7.987   0.257
   98    H    ASN  15           H        ASN  15   0.046  -4.701   1.640
   99    HA   ASN  15           HA       ASN  15   2.898  -4.506   1.142
  100    HB2  ASN  15          2HB       ASN  15   0.861  -2.777  -0.250
  101    HB3  ASN  15          3HB       ASN  15   2.507  -2.216   0.029
  102   HD21  ASN  15          1HD2      ASN  15   0.461  -4.249  -1.821
  103   HD22  ASN  15          2HD2      ASN  15   1.663  -4.840  -2.912
  104    H    TYR  16           H        TYR  16   3.450  -1.979   1.701
  105    HA   TYR  16           HA       TYR  16   1.948  -1.216   4.097
  106    HB2  TYR  16          2HB       TYR  16   4.930  -1.703   4.004
  107    HB3  TYR  16          3HB       TYR  16   4.107  -0.877   5.322
  108    HD1  TYR  16           HD1      TYR  16   3.173  -2.099   7.086
  109    HD2  TYR  16           HD2      TYR  16   4.229  -4.109   3.488
  110    HE1  TYR  16           HE1      TYR  16   2.732  -4.261   8.172
  111    HE2  TYR  16           HE2      TYR  16   3.790  -6.277   4.563
  112    HH   TYR  16           HH       TYR  16   2.583  -7.208   6.405
  113    H    TYR  17           H        TYR  17   3.266   0.875   5.011
  114    HA   TYR  17           HA       TYR  17   4.403   2.605   3.085
  115    HB2  TYR  17          2HB       TYR  17   2.669   3.789   2.257
  116    HB3  TYR  17          3HB       TYR  17   1.709   2.385   2.706
  117    HD1  TYR  17           HD1      TYR  17   2.369   5.878   3.338
  118    HD2  TYR  17           HD2      TYR  17   0.457   2.402   4.875
  119    HE1  TYR  17           HE1      TYR  17   1.017   7.290   4.830
  120    HE2  TYR  17           HE2      TYR  17  -0.902   3.805   6.371
  121    HH   TYR  17           HH       TYR  17  -1.590   5.954   6.759
  122    H    GLY  18           H        GLY  18   2.621   2.242   6.096
  123    HA2  GLY  18          2HA       GLY  18   3.388   2.952   8.200
  124    HA3  GLY  18          3HA       GLY  18   4.537   4.013   7.399
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1   1.810   0.089   0.841
    2    HA2  GLY   1          2HA       GLY   1   2.143  -0.873  -1.641
    3    HA3  GLY   1          3HA       GLY   1   1.494   0.726  -1.973
    4    H    GLY   2           H        GLY   2   4.079  -0.910  -0.157
    5    HA2  GLY   2          2HA       GLY   2   6.230   0.382  -1.219
    6    HA3  GLY   2          3HA       GLY   2   5.656   1.492   0.017
    7    H    LYS   3           H        LYS   3   6.256   1.168   2.076
    8    HA   LYS   3           HA       LYS   3   6.836  -1.347   3.216
    9    HB2  LYS   3          2HB       LYS   3   8.821  -1.147   1.734
   10    HB3  LYS   3          3HB       LYS   3   9.262   0.337   2.568
   11    HG2  LYS   3          2HG       LYS   3  10.116  -0.755   4.328
   12    HG3  LYS   3          3HG       LYS   3   8.839  -1.973   4.323
   13    HD2  LYS   3          2HD       LYS   3  10.960  -1.945   2.203
   14    HD3  LYS   3          3HD       LYS   3  11.248  -2.709   3.768
   15    HE2  LYS   3          2HE       LYS   3   9.248  -4.108   3.418
   16    HE3  LYS   3          3HE       LYS   3   9.033  -3.374   1.830
   17    HZ1  LYS   3          1HZ       LYS   3  10.275  -5.071   1.124
   18    HZ2  LYS   3          2HZ       LYS   3  10.864  -5.432   2.667
   19    HZ3  LYS   3          3HZ       LYS   3  11.593  -4.214   1.748
   20    H    GLY   4           H        GLY   4   6.475  -1.125   5.326
   21    HA2  GLY   4          2HA       GLY   4   7.601   0.730   7.041
   22    HA3  GLY   4          3HA       GLY   4   6.091   1.444   6.494
   23    HA   PRO   5           HA       PRO   5   5.260  -1.197  10.235
   24    HB2  PRO   5          2HB       PRO   5   3.868   0.709  11.579
   25    HB3  PRO   5          3HB       PRO   5   5.626   0.552  11.680
   26    HG2  PRO   5          2HG       PRO   5   3.984   2.432  10.028
   27    HG3  PRO   5          3HG       PRO   5   5.456   2.757  10.962
   28    HD2  PRO   5          2HD       PRO   5   5.482   2.397   8.278
   29    HD3  PRO   5          3HD       PRO   5   6.834   1.910   9.320
   30    H    ILE   6           H        ILE   6   3.126   1.156   8.628
   31    HA   ILE   6           HA       ILE   6   0.775  -0.428   9.186
   32    HB   ILE   6           HB       ILE   6   0.935   1.924   7.310
   33   HG12  ILE   6          2HG1      ILE   6   0.530   1.945  10.309
   34   HG13  ILE   6          3HG1      ILE   6   1.933   2.575   9.452
   35   HG21  ILE   6          1HG2      ILE   6  -1.273   1.727   7.165
   36   HG22  ILE   6          2HG2      ILE   6  -1.136   0.198   8.031
   37   HG23  ILE   6          3HG2      ILE   6  -1.440   1.691   8.920
   38   HD11  ILE   6          1HD1      ILE   6  -0.611   3.819  10.002
   39   HD12  ILE   6          2HD1      ILE   6   0.909   4.538   9.469
   40   HD13  ILE   6          3HD1      ILE   6  -0.215   3.872   8.285
   41    H    PHE   7           H        PHE   7  -0.230  -1.821   7.855
   42    HA   PHE   7           HA       PHE   7   1.129  -2.570   5.405
   43    HB2  PHE   7          2HB       PHE   7   0.498  -4.569   6.219
   44    HB3  PHE   7          3HB       PHE   7  -0.698  -3.846   7.288
   45    HD1  PHE   7           HD1      PHE   7  -2.989  -3.473   6.518
   46    HD2  PHE   7           HD2      PHE   7  -0.106  -5.429   4.074
   47    HE1  PHE   7           HE1      PHE   7  -4.793  -4.321   5.075
   48    HE2  PHE   7           HE2      PHE   7  -1.904  -6.279   2.626
   49    HZ   PHE   7           HZ       PHE   7  -4.251  -5.725   3.125
   50    H    GLU   8           H        GLU   8  -0.986  -0.233   6.079
   51    HA   GLU   8           HA       GLU   8  -2.302   1.085   4.760
   52    HB2  GLU   8          2HB       GLU   8  -1.860  -0.862   2.502
   53    HB3  GLU   8          3HB       GLU   8  -2.297   0.838   2.394
   54    HG2  GLU   8          2HG       GLU   8  -0.113   1.487   3.198
   55    HG3  GLU   8          3HG       GLU   8   0.332  -0.204   3.424
   56    H    THR   9           H        THR   9  -4.449   1.187   4.863
   57    HA   THR   9           HA       THR   9  -5.959  -1.339   4.771
   58    HB   THR   9           HB       THR   9  -6.211  -0.342   6.922
   59    HG1  THR   9           HG1      THR   9  -8.376  -0.339   6.949
   60   HG21  THR   9          1HG2      THR   9  -7.462   2.110   6.584
   61   HG22  THR   9          2HG2      THR   9  -6.146   2.136   5.410
   62   HG23  THR   9          3HG2      THR   9  -5.801   1.847   7.115
   63    H    TRP  10           H        TRP  10  -5.758  -0.905   2.352
   64    HA   TRP  10           HA       TRP  10  -8.263  -0.079   1.367
   65    HB2  TRP  10          2HB       TRP  10  -7.669   1.909   0.118
   66    HB3  TRP  10          3HB       TRP  10  -7.310   2.172   1.822
   67    HD1  TRP  10           HD1      TRP  10  -5.557   1.606  -1.547
   68    HE1  TRP  10           HE1      TRP  10  -3.118   2.402  -1.340
   69    HE3  TRP  10           HE3      TRP  10  -5.446   2.585   3.469
   70    HZ2  TRP  10           HZ2      TRP  10  -1.378   3.323   0.683
   71    HZ3  TRP  10           HZ3      TRP  10  -3.356   3.420   4.462
   72    HH2  TRP  10           HH2      TRP  10  -1.364   3.780   3.096
   73    H    VAL  11           H        VAL  11  -4.873  -0.724   0.739
   74    HA   VAL  11           HA       VAL  11  -5.236  -1.385  -2.024
   75    HB   VAL  11           HB       VAL  11  -2.930  -2.437  -1.752
   76   HG11  VAL  11          1HG1      VAL  11  -2.146  -0.460  -2.415
   77   HG12  VAL  11          2HG1      VAL  11  -3.749   0.192  -2.068
   78   HG13  VAL  11          3HG1      VAL  11  -2.477   0.278  -0.848
   79   HG21  VAL  11          1HG2      VAL  11  -1.697  -2.035   0.236
   80   HG22  VAL  11          2HG2      VAL  11  -2.981  -1.031   0.911
   81   HG23  VAL  11          3HG2      VAL  11  -3.222  -2.769   0.730
   82    H    THR  12           H        THR  12  -5.258  -3.146   1.003
   83    HA   THR  12           HA       THR  12  -5.453  -5.396   1.467
   84    HB   THR  12           HB       THR  12  -7.771  -4.685   1.098
   85    HG1  THR  12           HG1      THR  12  -8.467  -6.721   1.133
   86   HG21  THR  12          1HG2      THR  12  -8.806  -5.340  -1.138
   87   HG22  THR  12          2HG2      THR  12  -7.157  -5.405  -1.759
   88   HG23  THR  12          3HG2      THR  12  -7.802  -3.891  -1.124
   89    H    GLU  13           H        GLU  13  -3.377  -5.025  -0.362
   90    HA   GLU  13           HA       GLU  13  -3.685  -7.384  -2.102
   91    HB2  GLU  13          2HB       GLU  13  -3.433  -5.210  -3.320
   92    HB3  GLU  13          3HB       GLU  13  -1.849  -5.033  -2.579
   93    HG2  GLU  13          2HG       GLU  13  -1.181  -5.971  -4.512
   94    HG3  GLU  13          3HG       GLU  13  -1.539  -7.459  -3.638
   95    H    GLY  14           H        GLY  14  -1.555  -5.573   0.042
   96    HA2  GLY  14          2HA       GLY  14  -0.318  -7.109   1.608
   97    HA3  GLY  14          3HA       GLY  14   0.224  -7.929   0.151
   98    H    ASN  15           H        ASN  15   0.167  -4.659   1.569
   99    HA   ASN  15           HA       ASN  15   3.010  -4.396   1.055
  100    HB2  ASN  15          2HB       ASN  15   0.926  -2.708  -0.315
  101    HB3  ASN  15          3HB       ASN  15   2.555  -2.102  -0.032
  102   HD21  ASN  15          1HD2      ASN  15   0.627  -3.562  -2.226
  103   HD22  ASN  15          2HD2      ASN  15   1.822  -4.346  -3.197
  104    H    TYR  16           H        TYR  16   3.510  -1.863   1.633
  105    HA   TYR  16           HA       TYR  16   2.007  -1.156   4.046
  106    HB2  TYR  16          2HB       TYR  16   4.999  -1.570   3.927
  107    HB3  TYR  16          3HB       TYR  16   4.167  -0.776   5.259
  108    HD1  TYR  16           HD1      TYR  16   3.277  -2.036   7.018
  109    HD2  TYR  16           HD2      TYR  16   4.348  -3.988   3.392
  110    HE1  TYR  16           HE1      TYR  16   2.896  -4.219   8.087
  111    HE2  TYR  16           HE2      TYR  16   3.969  -6.175   4.451
  112    HH   TYR  16           HH       TYR  16   2.997  -7.205   6.254
  113    H    TYR  17           H        TYR  17   3.285   0.958   4.969
  114    HA   TYR  17           HA       TYR  17   4.365   2.730   3.049
  115    HB2  TYR  17          2HB       TYR  17   2.597   3.882   2.246
  116    HB3  TYR  17          3HB       TYR  17   1.673   2.451   2.691
  117    HD1  TYR  17           HD1      TYR  17   2.258   5.954   3.348
  118    HD2  TYR  17           HD2      TYR  17   0.440   2.421   4.871
  119    HE1  TYR  17           HE1      TYR  17   0.887   7.320   4.865
  120    HE2  TYR  17           HE2      TYR  17  -0.937   3.778   6.391
  121    HH   TYR  17           HH       TYR  17  -1.687   5.921   6.777
  122    H    GLY  18           H        GLY  18   2.619   2.299   6.071
  123    HA2  GLY  18          2HA       GLY  18   3.385   3.009   8.175
  124    HA3  GLY  18          3HA       GLY  18   4.506   4.101   7.375
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1   1.768  -0.157   0.749
    2    HA2  GLY   1          2HA       GLY   1   2.007  -1.166  -1.727
    3    HA3  GLY   1          3HA       GLY   1   1.429   0.459  -2.066
    4    H    GLY   2           H        GLY   2   3.964  -1.275  -0.269
    5    HA2  GLY   2          2HA       GLY   2   6.156  -0.105  -1.388
    6    HA3  GLY   2          3HA       GLY   2   5.659   1.047  -0.158
    7    H    LYS   3           H        LYS   3   6.274   0.721   1.896
    8    HA   LYS   3           HA       LYS   3   6.754  -1.804   3.061
    9    HB2  LYS   3          2HB       LYS   3   8.741  -1.501   1.449
   10    HB3  LYS   3          3HB       LYS   3   9.302  -0.277   2.580
   11    HG2  LYS   3          2HG       LYS   3   8.948  -2.215   4.328
   12    HG3  LYS   3          3HG       LYS   3   9.145  -3.226   2.894
   13    HD2  LYS   3          2HD       LYS   3  11.318  -3.023   3.691
   14    HD3  LYS   3          3HD       LYS   3  11.239  -1.774   2.447
   15    HE2  LYS   3          2HE       LYS   3  10.347  -0.656   4.907
   16    HE3  LYS   3          3HE       LYS   3  11.869  -1.496   5.199
   17    HZ1  LYS   3          1HZ       LYS   3  12.975   0.110   4.176
   18    HZ2  LYS   3          2HZ       LYS   3  11.542   1.005   4.093
   19    HZ3  LYS   3          3HZ       LYS   3  11.995   0.013   2.800
   20    H    GLY   4           H        GLY   4   6.442  -1.538   5.174
   21    HA2  GLY   4          2HA       GLY   4   7.684   0.282   6.844
   22    HA3  GLY   4          3HA       GLY   4   6.201   1.062   6.312
   23    HA   PRO   5           HA       PRO   5   5.306  -1.486  10.102
   24    HB2  PRO   5          2HB       PRO   5   4.030   0.502  11.441
   25    HB3  PRO   5          3HB       PRO   5   5.780   0.262  11.517
   26    HG2  PRO   5          2HG       PRO   5   4.203   2.198   9.865
   27    HG3  PRO   5          3HG       PRO   5   5.704   2.463  10.770
   28    HD2  PRO   5          2HD       PRO   5   5.669   2.067   8.092
   29    HD3  PRO   5          3HD       PRO   5   7.013   1.529   9.119
   30    H    ILE   6           H        ILE   6   3.261   0.948   8.500
   31    HA   ILE   6           HA       ILE   6   0.846  -0.513   9.117
   32    HB   ILE   6           HB       ILE   6   1.087   1.802   7.206
   33   HG12  ILE   6          2HG1      ILE   6   0.738   1.884  10.211
   34   HG13  ILE   6          3HG1      ILE   6   2.153   2.434   9.319
   35   HG21  ILE   6          1HG2      ILE   6  -1.265   1.681   8.876
   36   HG22  ILE   6          2HG2      ILE   6  -1.134   1.740   7.119
   37   HG23  ILE   6          3HG2      ILE   6  -1.051   0.191   7.957
   38   HD11  ILE   6          1HD1      ILE   6   1.224   4.444   9.333
   39   HD12  ILE   6          2HD1      ILE   6   0.052   3.819   8.173
   40   HD13  ILE   6          3HD1      ILE   6  -0.320   3.805   9.897
   41    H    PHE   7           H        PHE   7  -0.248  -1.872   7.822
   42    HA   PHE   7           HA       PHE   7   1.031  -2.719   5.360
   43    HB2  PHE   7          2HB       PHE   7   0.318  -4.674   6.213
   44    HB3  PHE   7          3HB       PHE   7  -0.825  -3.879   7.290
   45    HD1  PHE   7           HD1      PHE   7  -0.361  -5.530   4.088
   46    HD2  PHE   7           HD2      PHE   7  -3.107  -3.406   6.550
   47    HE1  PHE   7           HE1      PHE   7  -2.222  -6.311   2.680
   48    HE2  PHE   7           HE2      PHE   7  -4.972  -4.183   5.147
   49    HZ   PHE   7           HZ       PHE   7  -4.531  -5.638   3.210
   50    H    GLU   8           H        GLU   8  -0.956  -0.273   6.036
   51    HA   GLU   8           HA       GLU   8  -2.228   1.091   4.721
   52    HB2  GLU   8          2HB       GLU   8  -1.918  -0.904   2.482
   53    HB3  GLU   8          3HB       GLU   8  -2.273   0.813   2.358
   54    HG2  GLU   8          2HG       GLU   8  -0.048   1.366   3.117
   55    HG3  GLU   8          3HG       GLU   8   0.318  -0.340   3.363
   56    H    THR   9           H        THR   9  -4.366   1.298   4.854
   57    HA   THR   9           HA       THR   9  -5.997  -1.153   4.821
   58    HB   THR   9           HB       THR   9  -6.166  -0.116   6.961
   59    HG1  THR   9           HG1      THR   9  -8.179  -0.749   5.839
   60   HG21  THR   9          1HG2      THR   9  -7.294   2.382   6.648
   61   HG22  THR   9          2HG2      THR   9  -6.045   2.343   5.403
   62   HG23  THR   9          3HG2      THR   9  -5.619   2.052   7.089
   63    H    TRP  10           H        TRP  10  -5.814  -0.759   2.393
   64    HA   TRP  10           HA       TRP  10  -8.292   0.174   1.436
   65    HB2  TRP  10          2HB       TRP  10  -7.623   2.115   0.151
   66    HB3  TRP  10          3HB       TRP  10  -7.224   2.381   1.845
   67    HD1  TRP  10           HD1      TRP  10  -5.556   1.689  -1.543
   68    HE1  TRP  10           HE1      TRP  10  -3.079   2.369  -1.385
   69    HE3  TRP  10           HE3      TRP  10  -5.316   2.724   3.458
   70    HZ2  TRP  10           HZ2      TRP  10  -1.263   3.229   0.598
   71    HZ3  TRP  10           HZ3      TRP  10  -3.172   3.469   4.406
   72    HH2  TRP  10           HH2      TRP  10  -1.188   3.716   3.004
   73    H    VAL  11           H        VAL  11  -4.947  -0.641   0.764
   74    HA   VAL  11           HA       VAL  11  -5.383  -1.317  -1.984
   75    HB   VAL  11           HB       VAL  11  -3.130  -2.479  -1.733
   76   HG11  VAL  11          1HG1      VAL  11  -3.819   0.182  -2.067
   77   HG12  VAL  11          2HG1      VAL  11  -2.533   0.220  -0.859
   78   HG13  VAL  11          3HG1      VAL  11  -2.254  -0.549  -2.422
   79   HG21  VAL  11          1HG2      VAL  11  -3.077  -1.053   0.918
   80   HG22  VAL  11          2HG2      VAL  11  -3.399  -2.779   0.753
   81   HG23  VAL  11          3HG2      VAL  11  -1.848  -2.119   0.235
   82    H    THR  12           H        THR  12  -5.450  -3.040   1.064
   83    HA   THR  12           HA       THR  12  -5.752  -5.271   1.559
   84    HB   THR  12           HB       THR  12  -8.036  -4.450   1.213
   85    HG1  THR  12           HG1      THR  12  -7.876  -7.025   0.036
   86   HG21  THR  12          1HG2      THR  12  -7.500  -5.231  -1.643
   87   HG22  THR  12          2HG2      THR  12  -8.060  -3.680  -1.018
   88   HG23  THR  12          3HG2      THR  12  -9.134  -5.079  -1.000
   89    H    GLU  13           H        GLU  13  -3.686  -5.028  -0.302
   90    HA   GLU  13           HA       GLU  13  -4.136  -7.391  -2.005
   91    HB2  GLU  13          2HB       GLU  13  -3.737  -5.105  -3.137
   92    HB3  GLU  13          3HB       GLU  13  -2.074  -5.284  -2.595
   93    HG2  GLU  13          2HG       GLU  13  -1.609  -6.591  -4.312
   94    HG3  GLU  13          3HG       GLU  13  -2.910  -7.696  -3.871
   95    H    GLY  14           H        GLY  14  -1.893  -5.657   0.085
   96    HA2  GLY  14          2HA       GLY  14  -0.701  -7.227   1.650
   97    HA3  GLY  14          3HA       GLY  14  -0.224  -8.093   0.198
   98    H    ASN  15           H        ASN  15  -0.097  -4.808   1.574
   99    HA   ASN  15           HA       ASN  15   2.745  -4.689   1.005
  100    HB2  ASN  15          2HB       ASN  15   0.722  -2.915  -0.348
  101    HB3  ASN  15          3HB       ASN  15   2.387  -2.392  -0.106
  102   HD21  ASN  15          1HD2      ASN  15   0.253  -4.346  -1.926
  103   HD22  ASN  15          2HD2      ASN  15   1.417  -4.984  -3.032
  104    H    TYR  16           H        TYR  16   3.378  -2.175   1.540
  105    HA   TYR  16           HA       TYR  16   1.955  -1.365   3.968
  106    HB2  TYR  16          2HB       TYR  16   4.920  -1.928   3.804
  107    HB3  TYR  16          3HB       TYR  16   4.152  -1.077   5.139
  108    HD1  TYR  16           HD1      TYR  16   3.232  -2.268   6.930
  109    HD2  TYR  16           HD2      TYR  16   4.143  -4.317   3.315
  110    HE1  TYR  16           HE1      TYR  16   2.763  -4.415   8.036
  111    HE2  TYR  16           HE2      TYR  16   3.676  -6.470   4.410
  112    HH   TYR  16           HH       TYR  16   2.322  -6.635   7.635
  113    H    TYR  17           H        TYR  17   3.349   0.695   4.840
  114    HA   TYR  17           HA       TYR  17   4.482   2.387   2.879
  115    HB2  TYR  17          2HB       TYR  17   2.758   3.614   2.090
  116    HB3  TYR  17          3HB       TYR  17   1.774   2.236   2.569
  117    HD1  TYR  17           HD1      TYR  17   2.540   5.713   3.171
  118    HD2  TYR  17           HD2      TYR  17   0.577   2.293   4.768
  119    HE1  TYR  17           HE1      TYR  17   1.262   7.164   4.691
  120    HE2  TYR  17           HE2      TYR  17  -0.707   3.735   6.292
  121    HH   TYR  17           HH       TYR  17  -0.386   7.264   6.189
  122    H    GLY  18           H        GLY  18   2.768   2.082   5.935
  123    HA2  GLY  18          2HA       GLY  18   3.606   2.779   8.016
  124    HA3  GLY  18          3HA       GLY  18   4.761   3.808   7.182
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1   1.858   0.117   0.901
    2    HA2  GLY   1          2HA       GLY   1   2.213  -0.836  -1.584
    3    HA3  GLY   1          3HA       GLY   1   1.556   0.761  -1.913
    4    H    GLY   2           H        GLY   2   4.136  -0.862  -0.075
    5    HA2  GLY   2          2HA       GLY   2   6.288   0.444  -1.122
    6    HA3  GLY   2          3HA       GLY   2   5.698   1.547   0.112
    7    H    LYS   3           H        LYS   3   6.273   1.219   2.179
    8    HA   LYS   3           HA       LYS   3   6.864  -1.294   3.316
    9    HB2  LYS   3          2HB       LYS   3   8.898  -0.617   1.722
   10    HB3  LYS   3          3HB       LYS   3   9.376   0.293   3.150
   11    HG2  LYS   3          2HG       LYS   3  10.023  -1.542   4.238
   12    HG3  LYS   3          3HG       LYS   3   8.591  -2.449   3.746
   13    HD2  LYS   3          2HD       LYS   3  10.744  -1.876   1.753
   14    HD3  LYS   3          3HD       LYS   3  10.954  -3.186   2.918
   15    HE2  LYS   3          2HE       LYS   3   8.328  -3.283   1.741
   16    HE3  LYS   3          3HE       LYS   3   9.567  -3.267   0.487
   17    HZ1  LYS   3          1HZ       LYS   3  10.266  -5.029   2.607
   18    HZ2  LYS   3          2HZ       LYS   3  10.109  -5.352   0.954
   19    HZ3  LYS   3          3HZ       LYS   3   8.755  -5.434   1.963
   20    H    GLY   4           H        GLY   4   6.487  -1.083   5.424
   21    HA2  GLY   4          2HA       GLY   4   7.581   0.775   7.154
   22    HA3  GLY   4          3HA       GLY   4   6.071   1.480   6.596
   23    HA   PRO   5           HA       PRO   5   5.224  -1.176  10.322
   24    HB2  PRO   5          2HB       PRO   5   3.805   0.714  11.656
   25    HB3  PRO   5          3HB       PRO   5   5.562   0.571  11.774
   26    HG2  PRO   5          2HG       PRO   5   3.922   2.443  10.111
   27    HG3  PRO   5          3HG       PRO   5   5.382   2.777  11.060
   28    HD2  PRO   5          2HD       PRO   5   5.438   2.424   8.376
   29    HD3  PRO   5          3HD       PRO   5   6.783   1.945   9.430
   30    H    ILE   6           H        ILE   6   3.086   1.166   8.704
   31    HA   ILE   6           HA       ILE   6   0.743  -0.439   9.233
   32    HB   ILE   6           HB       ILE   6   0.900   1.920   7.367
   33   HG12  ILE   6          2HG1      ILE   6   0.474   1.929  10.363
   34   HG13  ILE   6          3HG1      ILE   6   1.876   2.574   9.518
   35   HG21  ILE   6          1HG2      ILE   6  -1.309   1.726   7.216
   36   HG22  ILE   6          2HG2      ILE   6  -1.161   0.177   8.045
   37   HG23  ILE   6          3HG2      ILE   6  -1.483   1.644   8.969
   38   HD11  ILE   6          1HD1      ILE   6  -0.686   3.792  10.050
   39   HD12  ILE   6          2HD1      ILE   6   0.834   4.527   9.540
   40   HD13  ILE   6          3HD1      ILE   6  -0.268   3.858   8.338
   41    H    PHE   7           H        PHE   7  -0.241  -1.832   7.887
   42    HA   PHE   7           HA       PHE   7   1.147  -2.562   5.447
   43    HB2  PHE   7          2HB       PHE   7   0.524  -4.569   6.251
   44    HB3  PHE   7          3HB       PHE   7  -0.692  -3.858   7.307
   45    HD1  PHE   7           HD1      PHE   7  -2.976  -3.505   6.511
   46    HD2  PHE   7           HD2      PHE   7  -0.046  -5.423   4.093
   47    HE1  PHE   7           HE1      PHE   7  -4.754  -4.363   5.043
   48    HE2  PHE   7           HE2      PHE   7  -1.819  -6.283   2.620
   49    HZ   PHE   7           HZ       PHE   7  -4.177  -5.753   3.094
   50    H    GLU   8           H        GLU   8  -0.992  -0.244   6.110
   51    HA   GLU   8           HA       GLU   8  -2.305   1.070   4.785
   52    HB2  GLU   8          2HB       GLU   8  -1.824  -0.862   2.521
   53    HB3  GLU   8          3HB       GLU   8  -2.273   0.834   2.417
   54    HG2  GLU   8          2HG       GLU   8  -0.104   1.499   3.242
   55    HG3  GLU   8          3HG       GLU   8   0.353  -0.188   3.475
   56    H    THR   9           H        THR   9  -4.455   1.155   4.855
   57    HA   THR   9           HA       THR   9  -5.943  -1.383   4.740
   58    HB   THR   9           HB       THR   9  -6.227  -0.396   6.891
   59    HG1  THR   9           HG1      THR   9  -8.540   0.420   5.459
   60   HG21  THR   9          1HG2      THR   9  -7.411   2.001   6.797
   61   HG22  THR   9          2HG2      THR   9  -6.426   2.122   5.339
   62   HG23  THR   9          3HG2      THR   9  -5.662   1.809   6.897
   63    H    TRP  10           H        TRP  10  -5.716  -0.938   2.325
   64    HA   TRP  10           HA       TRP  10  -8.217  -0.130   1.314
   65    HB2  TRP  10          2HB       TRP  10  -7.626   1.869   0.080
   66    HB3  TRP  10          3HB       TRP  10  -7.288   2.127   1.789
   67    HD1  TRP  10           HD1      TRP  10  -5.494   1.589  -1.563
   68    HE1  TRP  10           HE1      TRP  10  -3.064   2.405  -1.327
   69    HE3  TRP  10           HE3      TRP  10  -5.446   2.550   3.458
   70    HZ2  TRP  10           HZ2      TRP  10  -1.354   3.333   0.718
   71    HZ3  TRP  10           HZ3      TRP  10  -3.373   3.399   4.476
   72    HH2  TRP  10           HH2      TRP  10  -1.370   3.782   3.133
   73    H    VAL  11           H        VAL  11  -4.814  -0.742   0.723
   74    HA   VAL  11           HA       VAL  11  -5.136  -1.392  -2.047
   75    HB   VAL  11           HB       VAL  11  -2.829  -2.432  -1.751
   76   HG11  VAL  11          1HG1      VAL  11  -2.412   0.281  -0.814
   77   HG12  VAL  11          2HG1      VAL  11  -2.042  -0.443  -2.380
   78   HG13  VAL  11          3HG1      VAL  11  -3.656   0.192  -2.060
   79   HG21  VAL  11          1HG2      VAL  11  -1.624  -2.032   0.258
   80   HG22  VAL  11          2HG2      VAL  11  -2.931  -1.055   0.926
   81   HG23  VAL  11          3HG2      VAL  11  -3.146  -2.793   0.720
   82    H    THR  12           H        THR  12  -5.186  -3.173   0.970
   83    HA   THR  12           HA       THR  12  -5.375  -5.426   1.418
   84    HB   THR  12           HB       THR  12  -7.692  -4.725   1.026
   85    HG1  THR  12           HG1      THR  12  -8.482  -6.849   0.506
   86   HG21  THR  12          1HG2      THR  12  -8.698  -5.371  -1.226
   87   HG22  THR  12          2HG2      THR  12  -7.041  -5.423  -1.828
   88   HG23  THR  12          3HG2      THR  12  -7.701  -3.917  -1.191
   89    H    GLU  13           H        GLU  13  -3.280  -5.033  -0.384
   90    HA   GLU  13           HA       GLU  13  -3.553  -7.388  -2.136
   91    HB2  GLU  13          2HB       GLU  13  -3.316  -5.216  -3.354
   92    HB3  GLU  13          3HB       GLU  13  -1.745  -5.010  -2.593
   93    HG2  GLU  13          2HG       GLU  13  -1.180  -5.878  -4.643
   94    HG3  GLU  13          3HG       GLU  13  -1.212  -7.320  -3.629
   95    H    GLY  14           H        GLY  14  -1.481  -5.574   0.056
   96    HA2  GLY  14          2HA       GLY  14  -0.233  -7.095   1.617
   97    HA3  GLY  14          3HA       GLY  14   0.329  -7.908   0.164
   98    H    ASN  15           H        ASN  15   0.240  -4.651   1.608
   99    HA   ASN  15           HA       ASN  15   3.081  -4.359   1.109
  100    HB2  ASN  15          2HB       ASN  15   0.994  -2.679  -0.268
  101    HB3  ASN  15          3HB       ASN  15   2.619  -2.066   0.025
  102   HD21  ASN  15          1HD2      ASN  15   0.644  -4.033  -1.924
  103   HD22  ASN  15          2HD2      ASN  15   1.873  -4.612  -2.992
  104    H    TYR  16           H        TYR  16   3.557  -1.824   1.701
  105    HA   TYR  16           HA       TYR  16   2.028  -1.137   4.103
  106    HB2  TYR  16          2HB       TYR  16   5.024  -1.532   4.010
  107    HB3  TYR  16          3HB       TYR  16   4.174  -0.747   5.337
  108    HD1  TYR  16           HD1      TYR  16   3.278  -2.019   7.084
  109    HD2  TYR  16           HD2      TYR  16   4.392  -3.952   3.461
  110    HE1  TYR  16           HE1      TYR  16   2.901  -4.207   8.143
  111    HE2  TYR  16           HE2      TYR  16   4.017  -6.145   4.509
  112    HH   TYR  16           HH       TYR  16   2.465  -6.483   7.562
  113    H    TYR  17           H        TYR  17   3.281   0.982   5.045
  114    HA   TYR  17           HA       TYR  17   4.368   2.769   3.142
  115    HB2  TYR  17          2HB       TYR  17   2.600   3.911   2.326
  116    HB3  TYR  17          3HB       TYR  17   1.681   2.473   2.758
  117    HD1  TYR  17           HD1      TYR  17   0.427   2.427   4.925
  118    HD2  TYR  17           HD2      TYR  17   2.236   5.976   3.431
  119    HE1  TYR  17           HE1      TYR  17  -0.973   3.770   6.437
  120    HE2  TYR  17           HE2      TYR  17   0.842   7.329   4.940
  121    HH   TYR  17           HH       TYR  17  -0.544   7.258   6.724
  122    H    GLY  18           H        GLY  18   2.596   2.315   6.146
  123    HA2  GLY  18          2HA       GLY  18   3.341   3.021   8.260
  124    HA3  GLY  18          3HA       GLY  18   4.456   4.128   7.472
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1   1.770   0.002   0.824
    2    HA2  GLY   1          2HA       GLY   1   2.063  -0.985  -1.655
    3    HA3  GLY   1          3HA       GLY   1   1.448   0.626  -1.992
    4    H    GLY   2           H        GLY   2   4.005  -1.050  -0.170
    5    HA2  GLY   2          2HA       GLY   2   6.179   0.183  -1.260
    6    HA3  GLY   2          3HA       GLY   2   5.638   1.315  -0.029
    7    H    LYS   3           H        LYS   3   6.226   0.987   2.035
    8    HA   LYS   3           HA       LYS   3   6.763  -1.530   3.187
    9    HB2  LYS   3          2HB       LYS   3   8.861  -0.597   1.595
   10    HB3  LYS   3          3HB       LYS   3   9.348  -0.214   3.241
   11    HG2  LYS   3          2HG       LYS   3   9.284  -2.466   3.901
   12    HG3  LYS   3          3HG       LYS   3   8.377  -2.945   2.464
   13    HD2  LYS   3          2HD       LYS   3  10.570  -3.661   2.045
   14    HD3  LYS   3          3HD       LYS   3  10.415  -2.157   1.135
   15    HE2  LYS   3          2HE       LYS   3  12.332  -1.593   2.155
   16    HE3  LYS   3          3HE       LYS   3  11.299  -1.245   3.540
   17    HZ1  LYS   3          1HZ       LYS   3  12.675  -2.664   4.570
   18    HZ2  LYS   3          2HZ       LYS   3  13.186  -3.405   3.138
   19    HZ3  LYS   3          3HZ       LYS   3  11.721  -3.862   3.851
   20    H    GLY   4           H        GLY   4   6.421  -1.289   5.298
   21    HA2  GLY   4          2HA       GLY   4   7.589   0.553   6.996
   22    HA3  GLY   4          3HA       GLY   4   6.092   1.295   6.451
   23    HA   PRO   5           HA       PRO   5   5.220  -1.303  10.212
   24    HB2  PRO   5          2HB       PRO   5   3.870   0.638  11.547
   25    HB3  PRO   5          3HB       PRO   5   5.625   0.448  11.644
   26    HG2  PRO   5          2HG       PRO   5   4.015   2.348   9.984
   27    HG3  PRO   5          3HG       PRO   5   5.496   2.651  10.910
   28    HD2  PRO   5          2HD       PRO   5   5.507   2.272   8.229
   29    HD3  PRO   5          3HD       PRO   5   6.852   1.766   9.271
   30    H    ILE   6           H        ILE   6   3.126   1.081   8.600
   31    HA   ILE   6           HA       ILE   6   0.748  -0.454   9.174
   32    HB   ILE   6           HB       ILE   6   0.945   1.884   7.286
   33   HG12  ILE   6          2HG1      ILE   6   0.547   1.932  10.286
   34   HG13  ILE   6          3HG1      ILE   6   1.965   2.521   9.424
   35   HG21  ILE   6          1HG2      ILE   6  -1.426   1.700   8.911
   36   HG22  ILE   6          2HG2      ILE   6  -1.268   1.736   7.156
   37   HG23  ILE   6          3HG2      ILE   6  -1.157   0.202   8.020
   38   HD11  ILE   6          1HD1      ILE   6  -0.788   3.679   9.532
   39   HD12  ILE   6          2HD1      ILE   6   0.761   4.443   9.890
   40   HD13  ILE   6          3HD1      ILE   6   0.320   4.082   8.221
   41    H    PHE   7           H        PHE   7  -0.291  -1.832   7.853
   42    HA   PHE   7           HA       PHE   7   1.045  -2.620   5.402
   43    HB2  PHE   7          2HB       PHE   7   0.378  -4.602   6.232
   44    HB3  PHE   7          3HB       PHE   7  -0.805  -3.849   7.296
   45    HD1  PHE   7           HD1      PHE   7  -3.089  -3.442   6.526
   46    HD2  PHE   7           HD2      PHE   7  -0.242  -5.458   4.088
   47    HE1  PHE   7           HE1      PHE   7  -4.908  -4.264   5.088
   48    HE2  PHE   7           HE2      PHE   7  -2.056  -6.283   2.645
   49    HZ   PHE   7           HZ       PHE   7  -4.393  -5.685   3.144
   50    H    GLU   8           H        GLU   8  -1.022  -0.239   6.072
   51    HA   GLU   8           HA       GLU   8  -2.316   1.099   4.752
   52    HB2  GLU   8          2HB       GLU   8  -1.917  -0.865   2.500
   53    HB3  GLU   8          3HB       GLU   8  -2.321   0.842   2.386
   54    HG2  GLU   8          2HG       GLU   8  -0.124   1.455   3.177
   55    HG3  GLU   8          3HG       GLU   8   0.289  -0.242   3.419
   56    H    THR   9           H        THR   9  -4.462   1.243   4.848
   57    HA   THR   9           HA       THR   9  -6.019  -1.255   4.774
   58    HB   THR   9           HB       THR   9  -6.249  -0.241   6.920
   59    HG1  THR   9           HG1      THR   9  -8.229  -0.960   6.200
   60   HG21  THR   9          1HG2      THR   9  -6.502   2.281   5.348
   61   HG22  THR   9          2HG2      THR   9  -5.573   1.954   6.810
   62   HG23  THR   9          3HG2      THR   9  -7.320   2.166   6.905
   63    H    TRP  10           H        TRP  10  -5.811  -0.835   2.352
   64    HA   TRP  10           HA       TRP  10  -8.302   0.032   1.366
   65    HB2  TRP  10          2HB       TRP  10  -7.672   2.002   0.106
   66    HB3  TRP  10          3HB       TRP  10  -7.305   2.266   1.808
   67    HD1  TRP  10           HD1      TRP  10  -5.570   1.650  -1.561
   68    HE1  TRP  10           HE1      TRP  10  -3.116   2.401  -1.363
   69    HE3  TRP  10           HE3      TRP  10  -5.431   2.653   3.450
   70    HZ2  TRP  10           HZ2      TRP  10  -1.354   3.299   0.651
   71    HZ3  TRP  10           HZ3      TRP  10  -3.323   3.454   4.434
   72    HH2  TRP  10           HH2      TRP  10  -1.328   3.769   3.062
   73    H    VAL  11           H        VAL  11  -4.925  -0.679   0.737
   74    HA   VAL  11           HA       VAL  11  -5.302  -1.346  -2.022
   75    HB   VAL  11           HB       VAL  11  -3.018  -2.443  -1.745
   76   HG11  VAL  11          1HG1      VAL  11  -3.783   0.199  -2.074
   77   HG12  VAL  11          2HG1      VAL  11  -2.510   0.267  -0.854
   78   HG13  VAL  11          3HG1      VAL  11  -2.195  -0.486  -2.419
   79   HG21  VAL  11          1HG2      VAL  11  -3.041  -1.025   0.910
   80   HG22  VAL  11          2HG2      VAL  11  -3.316  -2.758   0.739
   81   HG23  VAL  11          3HG2      VAL  11  -1.776  -2.057   0.242
   82    H    THR  12           H        THR  12  -5.353  -3.095   1.013
   83    HA   THR  12           HA       THR  12  -5.592  -5.338   1.486
   84    HB   THR  12           HB       THR  12  -7.896  -4.583   1.122
   85    HG1  THR  12           HG1      THR  12  -7.245  -6.920   1.414
   86   HG21  THR  12          1HG2      THR  12  -7.307  -5.322  -1.735
   87   HG22  THR  12          2HG2      THR  12  -7.920  -3.795  -1.102
   88   HG23  THR  12          3HG2      THR  12  -8.952  -5.225  -1.107
   89    H    GLU  13           H        GLU  13  -3.515  -5.018  -0.350
   90    HA   GLU  13           HA       GLU  13  -3.877  -7.378  -2.078
   91    HB2  GLU  13          2HB       GLU  13  -3.529  -5.066  -3.180
   92    HB3  GLU  13          3HB       GLU  13  -1.866  -5.212  -2.630
   93    HG2  GLU  13          2HG       GLU  13  -1.496  -6.220  -4.576
   94    HG3  GLU  13          3HG       GLU  13  -2.278  -7.621  -3.846
   95    H    GLY  14           H        GLY  14  -1.720  -5.605   0.065
   96    HA2  GLY  14          2HA       GLY  14  -0.497  -7.152   1.625
   97    HA3  GLY  14          3HA       GLY  14   0.024  -7.988   0.170
   98    H    ASN  15           H        ASN  15   0.041  -4.721   1.593
   99    HA   ASN  15           HA       ASN  15   2.883  -4.510   1.063
  100    HB2  ASN  15          2HB       ASN  15   0.827  -2.808  -0.326
  101    HB3  ASN  15          3HB       ASN  15   2.454  -2.205  -0.030
  102   HD21  ASN  15          1HD2      ASN  15   0.477  -4.233  -1.937
  103   HD22  ASN  15          2HD2      ASN  15   1.705  -4.808  -3.008
  104    H    TYR  16           H        TYR  16   3.435  -1.986   1.627
  105    HA   TYR  16           HA       TYR  16   1.947  -1.233   4.035
  106    HB2  TYR  16          2HB       TYR  16   4.930  -1.706   3.917
  107    HB3  TYR  16          3HB       TYR  16   4.113  -0.889   5.245
  108    HD1  TYR  16           HD1      TYR  16   3.207  -2.123   7.014
  109    HD2  TYR  16           HD2      TYR  16   4.228  -4.113   3.395
  110    HE1  TYR  16           HE1      TYR  16   2.785  -4.291   8.095
  111    HE2  TYR  16           HE2      TYR  16   3.808  -6.287   4.465
  112    HH   TYR  16           HH       TYR  16   2.989  -6.517   7.898
  113    H    TYR  17           H        TYR  17   3.269   0.860   4.944
  114    HA   TYR  17           HA       TYR  17   4.381   2.599   3.011
  115    HB2  TYR  17          2HB       TYR  17   2.634   3.780   2.205
  116    HB3  TYR  17          3HB       TYR  17   1.683   2.372   2.661
  117    HD1  TYR  17           HD1      TYR  17   0.455   2.380   4.845
  118    HD2  TYR  17           HD2      TYR  17   2.337   5.866   3.291
  119    HE1  TYR  17           HE1      TYR  17  -0.890   3.774   6.360
  120    HE2  TYR  17           HE2      TYR  17   0.998   7.269   4.803
  121    HH   TYR  17           HH       TYR  17  -0.286   7.182   6.743
  122    H    GLY  18           H        GLY  18   2.634   2.220   6.040
  123    HA2  GLY  18          2HA       GLY  18   3.414   2.929   8.138
  124    HA3  GLY  18          3HA       GLY  18   4.560   3.988   7.330
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1   1.760  -0.075   0.812
    2    HA2  GLY   1          2HA       GLY   1   2.052  -1.069  -1.660
    3    HA3  GLY   1          3HA       GLY   1   1.452   0.546  -2.008
    4    H    GLY   2           H        GLY   2   3.992  -1.150  -0.181
    5    HA2  GLY   2          2HA       GLY   2   6.178   0.062  -1.267
    6    HA3  GLY   2          3HA       GLY   2   5.645   1.202  -0.041
    7    H    LYS   3           H        LYS   3   6.242   0.881   2.020
    8    HA   LYS   3           HA       LYS   3   6.747  -1.640   3.184
    9    HB2  LYS   3          2HB       LYS   3   8.731  -1.537   1.703
   10    HB3  LYS   3          3HB       LYS   3   9.217  -0.040   2.486
   11    HG2  LYS   3          2HG       LYS   3   9.821  -1.100   4.442
   12    HG3  LYS   3          3HG       LYS   3   8.788  -2.496   4.126
   13    HD2  LYS   3          2HD       LYS   3  10.785  -3.446   3.609
   14    HD3  LYS   3          3HD       LYS   3  10.442  -2.717   2.038
   15    HE2  LYS   3          2HE       LYS   3  11.742  -0.716   2.768
   16    HE3  LYS   3          3HE       LYS   3  12.191  -1.601   4.225
   17    HZ1  LYS   3          1HZ       LYS   3  13.189  -3.307   2.782
   18    HZ2  LYS   3          2HZ       LYS   3  13.928  -1.796   2.607
   19    HZ3  LYS   3          3HZ       LYS   3  12.848  -2.351   1.429
   20    H    GLY   4           H        GLY   4   6.403  -1.384   5.293
   21    HA2  GLY   4          2HA       GLY   4   7.595   0.451   6.983
   22    HA3  GLY   4          3HA       GLY   4   6.106   1.208   6.435
   23    HA   PRO   5           HA       PRO   5   5.204  -1.363  10.207
   24    HB2  PRO   5          2HB       PRO   5   3.877   0.599  11.533
   25    HB3  PRO   5          3HB       PRO   5   5.630   0.389  11.631
   26    HG2  PRO   5          2HG       PRO   5   4.042   2.301   9.963
   27    HG3  PRO   5          3HG       PRO   5   5.526   2.590  10.888
   28    HD2  PRO   5          2HD       PRO   5   5.533   2.200   8.209
   29    HD3  PRO   5          3HD       PRO   5   6.873   1.682   9.252
   30    H    ILE   6           H        ILE   6   3.139   1.039   8.584
   31    HA   ILE   6           HA       ILE   6   0.741  -0.464   9.166
   32    HB   ILE   6           HB       ILE   6   0.967   1.860   7.263
   33   HG12  ILE   6          2HG1      ILE   6   0.580   1.927  10.264
   34   HG13  ILE   6          3HG1      ILE   6   1.996   2.505   9.391
   35   HG21  ILE   6          1HG2      ILE   6  -1.155   0.208   8.017
   36   HG22  ILE   6          2HG2      ILE   6  -1.405   1.720   8.888
   37   HG23  ILE   6          3HG2      ILE   6  -1.247   1.731   7.131
   38   HD11  ILE   6          1HD1      ILE   6  -0.509   3.830   9.941
   39   HD12  ILE   6          2HD1      ILE   6   1.031   4.498   9.397
   40   HD13  ILE   6          3HD1      ILE   6  -0.116   3.855   8.222
   41    H    PHE   7           H        PHE   7  -0.312  -1.839   7.853
   42    HA   PHE   7           HA       PHE   7   1.014  -2.656   5.406
   43    HB2  PHE   7          2HB       PHE   7   0.325  -4.626   6.245
   44    HB3  PHE   7          3HB       PHE   7  -0.847  -3.854   7.309
   45    HD1  PHE   7           HD1      PHE   7  -0.309  -5.488   4.109
   46    HD2  PHE   7           HD2      PHE   7  -3.127  -3.421   6.539
   47    HE1  PHE   7           HE1      PHE   7  -2.136  -6.298   2.674
   48    HE2  PHE   7           HE2      PHE   7  -4.959  -4.229   5.109
   49    HZ   PHE   7           HZ       PHE   7  -4.465  -5.670   3.174
   50    H    GLU   8           H        GLU   8  -1.025  -0.248   6.063
   51    HA   GLU   8           HA       GLU   8  -2.304   1.097   4.735
   52    HB2  GLU   8          2HB       GLU   8  -1.931  -0.886   2.496
   53    HB3  GLU   8          3HB       GLU   8  -2.315   0.825   2.371
   54    HG2  GLU   8          2HG       GLU   8  -0.110   1.416   3.160
   55    HG3  GLU   8          3HG       GLU   8   0.284  -0.285   3.405
   56    H    THR   9           H        THR   9  -4.447   1.267   4.839
   57    HA   THR   9           HA       THR   9  -6.034  -1.212   4.781
   58    HB   THR   9           HB       THR   9  -6.249  -0.185   6.921
   59    HG1  THR   9           HG1      THR   9  -8.510   0.369   6.873
   60   HG21  THR   9          1HG2      THR   9  -5.729   1.994   7.049
   61   HG22  THR   9          2HG2      THR   9  -7.412   2.292   6.614
   62   HG23  THR   9          3HG2      THR   9  -6.167   2.283   5.366
   63    H    TRP  10           H        TRP  10  -5.826  -0.810   2.356
   64    HA   TRP  10           HA       TRP  10  -8.308   0.081   1.369
   65    HB2  TRP  10          2HB       TRP  10  -7.657   2.037   0.097
   66    HB3  TRP  10          3HB       TRP  10  -7.285   2.307   1.797
   67    HD1  TRP  10           HD1      TRP  10  -5.562   1.653  -1.571
   68    HE1  TRP  10           HE1      TRP  10  -3.099   2.375  -1.380
   69    HE3  TRP  10           HE3      TRP  10  -5.404   2.678   3.435
   70    HZ2  TRP  10           HZ2      TRP  10  -1.324   3.262   0.627
   71    HZ3  TRP  10           HZ3      TRP  10  -3.285   3.459   4.412
   72    HH2  TRP  10           HH2      TRP  10  -1.288   3.743   3.036
   73    H    VAL  11           H        VAL  11  -4.941  -0.672   0.738
   74    HA   VAL  11           HA       VAL  11  -5.330  -1.349  -2.017
   75    HB   VAL  11           HB       VAL  11  -3.060  -2.472  -1.738
   76   HG11  VAL  11          1HG1      VAL  11  -2.521   0.236  -0.856
   77   HG12  VAL  11          2HG1      VAL  11  -2.211  -0.526  -2.417
   78   HG13  VAL  11          3HG1      VAL  11  -3.792   0.178  -2.077
   79   HG21  VAL  11          1HG2      VAL  11  -1.810  -2.090   0.245
   80   HG22  VAL  11          2HG2      VAL  11  -3.064  -1.045   0.914
   81   HG23  VAL  11          3HG2      VAL  11  -3.355  -2.776   0.745
   82    H    THR  12           H        THR  12  -5.400  -3.081   1.027
   83    HA   THR  12           HA       THR  12  -5.667  -5.319   1.513
   84    HB   THR  12           HB       THR  12  -7.962  -4.537   1.146
   85    HG1  THR  12           HG1      THR  12  -8.243  -6.587   1.623
   86   HG21  THR  12          1HG2      THR  12  -9.027  -5.177  -1.080
   87   HG22  THR  12          2HG2      THR  12  -7.383  -5.300  -1.707
   88   HG23  THR  12          3HG2      THR  12  -7.976  -3.761  -1.083
   89    H    GLU  13           H        GLU  13  -3.587  -5.033  -0.327
   90    HA   GLU  13           HA       GLU  13  -3.977  -7.400  -2.039
   91    HB2  GLU  13          2HB       GLU  13  -3.629  -5.137  -3.193
   92    HB3  GLU  13          3HB       GLU  13  -1.978  -5.217  -2.594
   93    HG2  GLU  13          2HG       GLU  13  -1.375  -6.558  -4.244
   94    HG3  GLU  13          3HG       GLU  13  -2.686  -7.680  -3.886
   95    H    GLY  14           H        GLY  14  -1.802  -5.637   0.092
   96    HA2  GLY  14          2HA       GLY  14  -0.591  -7.185   1.658
   97    HA3  GLY  14          3HA       GLY  14  -0.082  -8.038   0.208
   98    H    ASN  15           H        ASN  15  -0.024  -4.763   1.612
   99    HA   ASN  15           HA       ASN  15   2.818  -4.586   1.069
  100    HB2  ASN  15          2HB       ASN  15   0.779  -2.842  -0.301
  101    HB3  ASN  15          3HB       ASN  15   2.434  -2.296  -0.044
  102   HD21  ASN  15          1HD2      ASN  15   0.351  -4.051  -2.018
  103   HD22  ASN  15          2HD2      ASN  15   1.531  -4.757  -3.064
  104    H    TYR  16           H        TYR  16   3.398  -2.064   1.618
  105    HA   TYR  16           HA       TYR  16   1.931  -1.285   4.030
  106    HB2  TYR  16          2HB       TYR  16   4.907  -1.796   3.902
  107    HB3  TYR  16          3HB       TYR  16   4.107  -0.961   5.229
  108    HD1  TYR  16           HD1      TYR  16   3.185  -2.173   7.006
  109    HD2  TYR  16           HD2      TYR  16   4.178  -4.197   3.398
  110    HE1  TYR  16           HE1      TYR  16   2.739  -4.330   8.101
  111    HE2  TYR  16           HE2      TYR  16   3.735  -6.360   4.482
  112    HH   TYR  16           HH       TYR  16   2.329  -6.560   7.678
  113    H    TYR  17           H        TYR  17   3.280   0.796   4.925
  114    HA   TYR  17           HA       TYR  17   4.407   2.513   2.982
  115    HB2  TYR  17          2HB       TYR  17   2.673   3.712   2.174
  116    HB3  TYR  17          3HB       TYR  17   1.706   2.316   2.638
  117    HD1  TYR  17           HD1      TYR  17   2.406   5.805   3.256
  118    HD2  TYR  17           HD2      TYR  17   0.481   2.348   4.821
  119    HE1  TYR  17           HE1      TYR  17   1.085   7.230   4.763
  120    HE2  TYR  17           HE2      TYR  17  -0.847   3.765   6.332
  121    HH   TYR  17           HH       TYR  17  -1.633   6.166   6.387
  122    H    GLY  18           H        GLY  18   2.660   2.171   6.015
  123    HA2  GLY  18          2HA       GLY  18   3.460   2.877   8.109
  124    HA3  GLY  18          3HA       GLY  18   4.607   3.928   7.291
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1   1.781   0.004   0.848
    2    HA2  GLY   1          2HA       GLY   1   2.083  -0.980  -1.629
    3    HA3  GLY   1          3HA       GLY   1   1.472   0.632  -1.970
    4    H    GLY   2           H        GLY   2   4.020  -1.050  -0.142
    5    HA2  GLY   2          2HA       GLY   2   6.199   0.182  -1.222
    6    HA3  GLY   2          3HA       GLY   2   5.656   1.312   0.010
    7    H    LYS   3           H        LYS   3   6.237   0.979   2.074
    8    HA   LYS   3           HA       LYS   3   6.767  -1.542   3.223
    9    HB2  LYS   3          2HB       LYS   3   8.817  -0.856   1.602
   10    HB3  LYS   3          3HB       LYS   3   9.334  -0.073   3.090
   11    HG2  LYS   3          2HG       LYS   3   9.689  -2.040   4.169
   12    HG3  LYS   3          3HG       LYS   3   8.427  -2.888   3.273
   13    HD2  LYS   3          2HD       LYS   3  10.481  -3.802   2.539
   14    HD3  LYS   3          3HD       LYS   3   9.937  -2.727   1.249
   15    HE2  LYS   3          2HE       LYS   3  11.945  -1.769   1.358
   16    HE3  LYS   3          3HE       LYS   3  11.440  -1.091   2.905
   17    HZ1  LYS   3          1HZ       LYS   3  12.596  -3.797   2.784
   18    HZ2  LYS   3          2HZ       LYS   3  12.562  -2.709   4.078
   19    HZ3  LYS   3          3HZ       LYS   3  13.610  -2.442   2.778
   20    H    GLY   4           H        GLY   4   6.417  -1.303   5.333
   21    HA2  GLY   4          2HA       GLY   4   7.586   0.533   7.038
   22    HA3  GLY   4          3HA       GLY   4   6.092   1.279   6.490
   23    HA   PRO   5           HA       PRO   5   5.204  -1.323  10.245
   24    HB2  PRO   5          2HB       PRO   5   3.852   0.619  11.577
   25    HB3  PRO   5          3HB       PRO   5   5.606   0.426  11.679
   26    HG2  PRO   5          2HG       PRO   5   4.004   2.331  10.016
   27    HG3  PRO   5          3HG       PRO   5   5.483   2.630  10.948
   28    HD2  PRO   5          2HD       PRO   5   5.502   2.254   8.267
   29    HD3  PRO   5          3HD       PRO   5   6.844   1.745   9.312
   30    H    ILE   6           H        ILE   6   3.118   1.068   8.630
   31    HA   ILE   6           HA       ILE   6   0.736  -0.466   9.193
   32    HB   ILE   6           HB       ILE   6   0.941   1.876   7.311
   33   HG12  ILE   6          2HG1      ILE   6   0.535   1.918  10.309
   34   HG13  ILE   6          3HG1      ILE   6   1.956   2.507   9.453
   35   HG21  ILE   6          1HG2      ILE   6  -1.162   0.196   8.015
   36   HG22  ILE   6          2HG2      ILE   6  -1.433   1.672   8.939
   37   HG23  ILE   6          3HG2      ILE   6  -1.276   1.747   7.185
   38   HD11  ILE   6          1HD1      ILE   6  -0.795   3.669   9.556
   39   HD12  ILE   6          2HD1      ILE   6   0.754   4.430   9.918
   40   HD13  ILE   6          3HD1      ILE   6   0.316   4.073   8.248
   41    H    PHE   7           H        PHE   7  -0.301  -1.839   7.865
   42    HA   PHE   7           HA       PHE   7   1.041  -2.624   5.417
   43    HB2  PHE   7          2HB       PHE   7   0.370  -4.607   6.240
   44    HB3  PHE   7          3HB       PHE   7  -0.815  -3.855   7.303
   45    HD1  PHE   7           HD1      PHE   7  -3.096  -3.443   6.529
   46    HD2  PHE   7           HD2      PHE   7  -0.246  -5.458   4.093
   47    HE1  PHE   7           HE1      PHE   7  -4.913  -4.260   5.084
   48    HE2  PHE   7           HE2      PHE   7  -2.058  -6.276   2.644
   49    HZ   PHE   7           HZ       PHE   7  -4.395  -5.677   3.138
   50    H    GLU   8           H        GLU   8  -1.025  -0.242   6.086
   51    HA   GLU   8           HA       GLU   8  -2.313   1.100   4.765
   52    HB2  GLU   8          2HB       GLU   8  -1.911  -0.860   2.510
   53    HB3  GLU   8          3HB       GLU   8  -2.313   0.848   2.399
   54    HG2  GLU   8          2HG       GLU   8  -0.117   1.457   3.197
   55    HG3  GLU   8          3HG       GLU   8   0.294  -0.241   3.436
   56    H    THR   9           H        THR   9  -4.459   1.248   4.855
   57    HA   THR   9           HA       THR   9  -6.019  -1.248   4.774
   58    HB   THR   9           HB       THR   9  -6.254  -0.238   6.921
   59    HG1  THR   9           HG1      THR   9  -8.581   0.722   5.657
   60   HG21  THR   9          1HG2      THR   9  -6.277   2.256   5.365
   61   HG22  THR   9          2HG2      THR   9  -5.700   1.946   7.002
   62   HG23  THR   9          3HG2      THR   9  -7.418   2.212   6.708
   63    H    TRP  10           H        TRP  10  -5.805  -0.826   2.353
   64    HA   TRP  10           HA       TRP  10  -8.292   0.046   1.361
   65    HB2  TRP  10          2HB       TRP  10  -7.656   2.018   0.107
   66    HB3  TRP  10          3HB       TRP  10  -7.293   2.279   1.810
   67    HD1  TRP  10           HD1      TRP  10  -5.550   1.665  -1.556
   68    HE1  TRP  10           HE1      TRP  10  -3.096   2.413  -1.350
   69    HE3  TRP  10           HE3      TRP  10  -5.423   2.661   3.457
   70    HZ2  TRP  10           HZ2      TRP  10  -1.338   3.306   0.670
   71    HZ3  TRP  10           HZ3      TRP  10  -3.316   3.458   4.448
   72    HH2  TRP  10           HH2      TRP  10  -1.317   3.772   3.082
   73    H    VAL  11           H        VAL  11  -4.914  -0.668   0.741
   74    HA   VAL  11           HA       VAL  11  -5.285  -1.330  -2.021
   75    HB   VAL  11           HB       VAL  11  -3.003  -2.430  -1.739
   76   HG11  VAL  11          1HG1      VAL  11  -2.176  -0.473  -2.408
   77   HG12  VAL  11          2HG1      VAL  11  -3.765   0.214  -2.068
   78   HG13  VAL  11          3HG1      VAL  11  -2.495   0.278  -0.846
   79   HG21  VAL  11          1HG2      VAL  11  -3.031  -1.013   0.917
   80   HG22  VAL  11          2HG2      VAL  11  -3.308  -2.746   0.743
   81   HG23  VAL  11          3HG2      VAL  11  -1.766  -2.046   0.251
   82    H    THR  12           H        THR  12  -5.343  -3.084   1.012
   83    HA   THR  12           HA       THR  12  -5.584  -5.328   1.481
   84    HB   THR  12           HB       THR  12  -7.887  -4.569   1.116
   85    HG1  THR  12           HG1      THR  12  -8.166  -6.622   1.570
   86   HG21  THR  12          1HG2      THR  12  -7.907  -3.778  -1.108
   87   HG22  THR  12          2HG2      THR  12  -8.941  -5.207  -1.117
   88   HG23  THR  12          3HG2      THR  12  -7.295  -5.305  -1.741
   89    H    GLU  13           H        GLU  13  -3.505  -5.005  -0.353
   90    HA   GLU  13           HA       GLU  13  -3.867  -7.362  -2.086
   91    HB2  GLU  13          2HB       GLU  13  -3.549  -5.117  -3.245
   92    HB3  GLU  13          3HB       GLU  13  -1.913  -5.125  -2.601
   93    HG2  GLU  13          2HG       GLU  13  -1.767  -5.934  -4.805
   94    HG3  GLU  13          3HG       GLU  13  -1.584  -7.335  -3.751
   95    H    GLY  14           H        GLY  14  -1.710  -5.596   0.064
   96    HA2  GLY  14          2HA       GLY  14  -0.493  -7.150   1.622
   97    HA3  GLY  14          3HA       GLY  14   0.030  -7.982   0.165
   98    H    ASN  15           H        ASN  15   0.051  -4.724   1.607
   99    HA   ASN  15           HA       ASN  15   2.893  -4.512   1.084
  100    HB2  ASN  15          2HB       ASN  15   0.843  -2.814  -0.317
  101    HB3  ASN  15          3HB       ASN  15   2.464  -2.200  -0.004
  102   HD21  ASN  15          1HD2      ASN  15   0.517  -4.209  -1.952
  103   HD22  ASN  15          2HD2      ASN  15   1.760  -4.784  -3.005
  104    H    TYR  16           H        TYR  16   3.446  -1.990   1.654
  105    HA   TYR  16           HA       TYR  16   1.949  -1.239   4.057
  106    HB2  TYR  16          2HB       TYR  16   4.932  -1.714   3.951
  107    HB3  TYR  16          3HB       TYR  16   4.110  -0.898   5.276
  108    HD1  TYR  16           HD1      TYR  16   3.197  -2.135   7.040
  109    HD2  TYR  16           HD2      TYR  16   4.229  -4.120   3.420
  110    HE1  TYR  16           HE1      TYR  16   2.770  -4.305   8.115
  111    HE2  TYR  16           HE2      TYR  16   3.803  -6.295   4.485
  112    HH   TYR  16           HH       TYR  16   2.151  -6.962   6.713
  113    H    TYR  17           H        TYR  17   3.272   0.852   4.974
  114    HA   TYR  17           HA       TYR  17   4.391   2.592   3.047
  115    HB2  TYR  17          2HB       TYR  17   2.648   3.777   2.237
  116    HB3  TYR  17          3HB       TYR  17   1.693   2.369   2.690
  117    HD1  TYR  17           HD1      TYR  17   0.458   2.378   4.869
  118    HD2  TYR  17           HD2      TYR  17   2.354   5.861   3.328
  119    HE1  TYR  17           HE1      TYR  17  -0.888   3.773   6.382
  120    HE2  TYR  17           HE2      TYR  17   1.014   7.266   4.838
  121    HH   TYR  17           HH       TYR  17  -1.696   6.328   6.298
  122    H    GLY  18           H        GLY  18   2.635   2.212   6.070
  123    HA2  GLY  18          2HA       GLY  18   3.411   2.916   8.172
  124    HA3  GLY  18          3HA       GLY  18   4.560   3.975   7.368
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1   1.876   0.065   0.899
    2    HA2  GLY   1          2HA       GLY   1   2.239  -0.920  -1.573
    3    HA3  GLY   1          3HA       GLY   1   1.593   0.677  -1.923
    4    H    GLY   2           H        GLY   2   4.152  -0.939  -0.051
    5    HA2  GLY   2          2HA       GLY   2   6.319   0.340  -1.100
    6    HA3  GLY   2          3HA       GLY   2   5.728   1.462   0.117
    7    H    LYS   3           H        LYS   3   6.293   1.157   2.189
    8    HA   LYS   3           HA       LYS   3   6.861  -1.347   3.360
    9    HB2  LYS   3          2HB       LYS   3   8.909  -0.692   1.770
   10    HB3  LYS   3          3HB       LYS   3   9.384   0.220   3.197
   11    HG2  LYS   3          2HG       LYS   3  10.223  -1.620   4.086
   12    HG3  LYS   3          3HG       LYS   3   8.623  -2.366   4.055
   13    HD2  LYS   3          2HD       LYS   3  10.130  -2.304   1.505
   14    HD3  LYS   3          3HD       LYS   3  10.727  -3.390   2.762
   15    HE2  LYS   3          2HE       LYS   3   8.902  -4.742   2.649
   16    HE3  LYS   3          3HE       LYS   3   7.814  -3.421   2.226
   17    HZ1  LYS   3          1HZ       LYS   3   9.503  -3.643   0.085
   18    HZ2  LYS   3          2HZ       LYS   3   7.908  -4.199   0.163
   19    HZ3  LYS   3          3HZ       LYS   3   9.187  -5.247   0.519
   20    H    GLY   4           H        GLY   4   6.471  -1.107   5.463
   21    HA2  GLY   4          2HA       GLY   4   7.568   0.765   7.177
   22    HA3  GLY   4          3HA       GLY   4   6.065   1.472   6.602
   23    HA   PRO   5           HA       PRO   5   5.181  -1.136  10.354
   24    HB2  PRO   5          2HB       PRO   5   3.767   0.780  11.659
   25    HB3  PRO   5          3HB       PRO   5   5.523   0.626  11.788
   26    HG2  PRO   5          2HG       PRO   5   3.904   2.490  10.095
   27    HG3  PRO   5          3HG       PRO   5   5.362   2.825  11.047
   28    HD2  PRO   5          2HD       PRO   5   5.429   2.441   8.368
   29    HD3  PRO   5          3HD       PRO   5   6.766   1.965   9.434
   30    H    ILE   6           H        ILE   6   3.068   1.202   8.696
   31    HA   ILE   6           HA       ILE   6   0.711  -0.380   9.233
   32    HB   ILE   6           HB       ILE   6   0.896   1.955   7.339
   33   HG12  ILE   6          2HG1      ILE   6   0.438   2.006  10.330
   34   HG13  ILE   6          3HG1      ILE   6   1.862   2.618   9.496
   35   HG21  ILE   6          1HG2      ILE   6  -1.312   1.769   7.171
   36   HG22  ILE   6          2HG2      ILE   6  -1.182   0.234   8.027
   37   HG23  ILE   6          3HG2      ILE   6  -1.501   1.719   8.924
   38   HD11  ILE   6          1HD1      ILE   6   0.210   4.143   8.253
   39   HD12  ILE   6          2HD1      ILE   6  -0.911   3.727   9.549
   40   HD13  ILE   6          3HD1      ILE   6   0.618   4.520   9.927
   41    H    PHE   7           H        PHE   7  -0.273  -1.785   7.899
   42    HA   PHE   7           HA       PHE   7   1.122  -2.554   5.476
   43    HB2  PHE   7          2HB       PHE   7   0.480  -4.547   6.300
   44    HB3  PHE   7          3HB       PHE   7  -0.735  -3.814   7.342
   45    HD1  PHE   7           HD1      PHE   7  -3.013  -3.453   6.531
   46    HD2  PHE   7           HD2      PHE   7  -0.086  -5.425   4.150
   47    HE1  PHE   7           HE1      PHE   7  -4.791  -4.316   5.065
   48    HE2  PHE   7           HE2      PHE   7  -1.859  -6.290   2.681
   49    HZ   PHE   7           HZ       PHE   7  -4.215  -5.735   3.136
   50    H    GLU   8           H        GLU   8  -1.003  -0.213   6.098
   51    HA   GLU   8           HA       GLU   8  -2.300   1.093   4.748
   52    HB2  GLU   8          2HB       GLU   8  -1.822  -0.872   2.513
   53    HB3  GLU   8          3HB       GLU   8  -2.258   0.826   2.384
   54    HG2  GLU   8          2HG       GLU   8  -0.088   1.486   3.213
   55    HG3  GLU   8          3HG       GLU   8   0.355  -0.201   3.468
   56    H    THR   9           H        THR   9  -4.449   1.195   4.809
   57    HA   THR   9           HA       THR   9  -5.955  -1.334   4.718
   58    HB   THR   9           HB       THR   9  -6.243  -0.318   6.855
   59    HG1  THR   9           HG1      THR   9  -8.445  -0.164   6.851
   60   HG21  THR   9          1HG2      THR   9  -6.505   2.192   5.269
   61   HG22  THR   9          2HG2      THR   9  -5.614   1.889   6.760
   62   HG23  THR   9          3HG2      THR   9  -7.368   2.070   6.802
   63    H    TRP  10           H        TRP  10  -5.713  -0.920   2.298
   64    HA   TRP  10           HA       TRP  10  -8.204  -0.106   1.265
   65    HB2  TRP  10          2HB       TRP  10  -7.591   1.872   0.009
   66    HB3  TRP  10          3HB       TRP  10  -7.259   2.150   1.716
   67    HD1  TRP  10           HD1      TRP  10  -5.453   1.557  -1.620
   68    HE1  TRP  10           HE1      TRP  10  -3.019   2.358  -1.382
   69    HE3  TRP  10           HE3      TRP  10  -5.423   2.578   3.389
   70    HZ2  TRP  10           HZ2      TRP  10  -1.311   3.297   0.660
   71    HZ3  TRP  10           HZ3      TRP  10  -3.348   3.424   4.407
   72    HH2  TRP  10           HH2      TRP  10  -1.336   3.775   3.070
   73    H    VAL  11           H        VAL  11  -4.802  -0.751   0.698
   74    HA   VAL  11           HA       VAL  11  -5.117  -1.435  -2.065
   75    HB   VAL  11           HB       VAL  11  -2.817  -2.485  -1.744
   76   HG11  VAL  11          1HG1      VAL  11  -2.383   0.237  -0.850
   77   HG12  VAL  11          2HG1      VAL  11  -2.019  -0.512  -2.406
   78   HG13  VAL  11          3HG1      VAL  11  -3.628   0.141  -2.094
   79   HG21  VAL  11          1HG2      VAL  11  -2.917  -1.062   0.907
   80   HG22  VAL  11          2HG2      VAL  11  -3.152  -2.801   0.734
   81   HG23  VAL  11          3HG2      VAL  11  -1.619  -2.068   0.264
   82    H    THR  12           H        THR  12  -5.191  -3.173   0.975
   83    HA   THR  12           HA       THR  12  -5.396  -5.419   1.453
   84    HB   THR  12           HB       THR  12  -7.707  -4.711   1.040
   85    HG1  THR  12           HG1      THR  12  -7.544  -6.852   1.577
   86   HG21  THR  12          1HG2      THR  12  -7.046  -5.450  -1.802
   87   HG22  THR  12          2HG2      THR  12  -7.701  -3.932  -1.188
   88   HG23  THR  12          3HG2      THR  12  -8.704  -5.382  -1.208
   89    H    GLU  13           H        GLU  13  -3.289  -5.063  -0.344
   90    HA   GLU  13           HA       GLU  13  -3.569  -7.437  -2.068
   91    HB2  GLU  13          2HB       GLU  13  -3.310  -5.306  -3.328
   92    HB3  GLU  13          3HB       GLU  13  -1.760  -5.061  -2.535
   93    HG2  GLU  13          2HG       GLU  13  -1.230  -7.429  -3.514
   94    HG3  GLU  13          3HG       GLU  13  -2.526  -7.020  -4.638
   95    H    GLY  14           H        GLY  14  -1.485  -5.609   0.103
   96    HA2  GLY  14          2HA       GLY  14  -0.264  -7.125   1.695
   97    HA3  GLY  14          3HA       GLY  14   0.300  -7.958   0.255
   98    H    ASN  15           H        ASN  15   0.222  -4.679   1.649
   99    HA   ASN  15           HA       ASN  15   3.070  -4.416   1.172
  100    HB2  ASN  15          2HB       ASN  15   1.005  -2.746  -0.246
  101    HB3  ASN  15          3HB       ASN  15   2.627  -2.130   0.059
  102   HD21  ASN  15          1HD2      ASN  15   0.682  -3.922  -2.002
  103   HD22  ASN  15          2HD2      ASN  15   1.920  -4.591  -3.005
  104    H    TYR  16           H        TYR  16   3.561  -1.878   1.735
  105    HA   TYR  16           HA       TYR  16   2.022  -1.151   4.118
  106    HB2  TYR  16          2HB       TYR  16   5.015  -1.564   4.048
  107    HB3  TYR  16          3HB       TYR  16   4.162  -0.759   5.360
  108    HD1  TYR  16           HD1      TYR  16   4.372  -3.987   3.524
  109    HD2  TYR  16           HD2      TYR  16   3.246  -2.005   7.117
  110    HE1  TYR  16           HE1      TYR  16   3.979  -6.165   4.596
  111    HE2  TYR  16           HE2      TYR  16   2.851  -4.178   8.199
  112    HH   TYR  16           HH       TYR  16   3.947  -7.075   6.960
  113    H    TYR  17           H        TYR  17   3.285   0.972   5.042
  114    HA   TYR  17           HA       TYR  17   4.393   2.728   3.124
  115    HB2  TYR  17          2HB       TYR  17   2.638   3.871   2.282
  116    HB3  TYR  17          3HB       TYR  17   1.709   2.443   2.724
  117    HD1  TYR  17           HD1      TYR  17   2.276   5.952   3.358
  118    HD2  TYR  17           HD2      TYR  17   0.442   2.429   4.886
  119    HE1  TYR  17           HE1      TYR  17   0.877   7.330   4.840
  120    HE2  TYR  17           HE2      TYR  17  -0.962   3.797   6.371
  121    HH   TYR  17           HH       TYR  17  -0.531   6.420   7.408
  122    H    GLY  18           H        GLY  18   2.601   2.321   6.122
  123    HA2  GLY  18          2HA       GLY  18   3.323   3.053   8.231
  124    HA3  GLY  18          3HA       GLY  18   4.466   4.130   7.442
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1   1.860   0.044   0.918
    2    HA2  GLY   1          2HA       GLY   1   2.257  -0.954  -1.537
    3    HA3  GLY   1          3HA       GLY   1   1.631   0.644  -1.915
    4    H    GLY   2           H        GLY   2   4.152  -0.987  -0.006
    5    HA2  GLY   2          2HA       GLY   2   6.341   0.273  -1.024
    6    HA3  GLY   2          3HA       GLY   2   5.743   1.405   0.180
    7    H    LYS   3           H        LYS   3   6.290   1.110   2.256
    8    HA   LYS   3           HA       LYS   3   6.813  -1.394   3.450
    9    HB2  LYS   3          2HB       LYS   3   8.911  -0.631   1.884
   10    HB3  LYS   3          3HB       LYS   3   9.369   0.073   3.429
   11    HG2  LYS   3          2HG       LYS   3   9.748  -1.933   4.387
   12    HG3  LYS   3          3HG       LYS   3   8.443  -2.726   3.502
   13    HD2  LYS   3          2HD       LYS   3  10.621  -1.852   1.775
   14    HD3  LYS   3          3HD       LYS   3  11.141  -3.003   3.009
   15    HE2  LYS   3          2HE       LYS   3   9.697  -4.662   2.239
   16    HE3  LYS   3          3HE       LYS   3   8.682  -3.510   1.373
   17    HZ1  LYS   3          1HZ       LYS   3  10.677  -3.124  -0.093
   18    HZ2  LYS   3          2HZ       LYS   3   9.923  -4.630  -0.253
   19    HZ3  LYS   3          3HZ       LYS   3  11.369  -4.495   0.616
   20    H    GLY   4           H        GLY   4   6.398  -1.136   5.546
   21    HA2  GLY   4          2HA       GLY   4   7.493   0.735   7.263
   22    HA3  GLY   4          3HA       GLY   4   6.005   1.453   6.665
   23    HA   PRO   5           HA       PRO   5   5.051  -1.124  10.421
   24    HB2  PRO   5          2HB       PRO   5   3.644   0.814  11.700
   25    HB3  PRO   5          3HB       PRO   5   5.397   0.642  11.850
   26    HG2  PRO   5          2HG       PRO   5   3.817   2.514  10.129
   27    HG3  PRO   5          3HG       PRO   5   5.268   2.838  11.096
   28    HD2  PRO   5          2HD       PRO   5   5.360   2.439   8.419
   29    HD3  PRO   5          3HD       PRO   5   6.680   1.954   9.503
   30    H    ILE   6           H        ILE   6   2.987   1.222   8.718
   31    HA   ILE   6           HA       ILE   6   0.604  -0.328   9.240
   32    HB   ILE   6           HB       ILE   6   0.838   1.992   7.332
   33   HG12  ILE   6          2HG1      ILE   6   0.359   2.065  10.319
   34   HG13  ILE   6          3HG1      ILE   6   1.787   2.669   9.487
   35   HG21  ILE   6          1HG2      ILE   6  -1.367   1.811   7.131
   36   HG22  ILE   6          2HG2      ILE   6  -1.270   0.299   8.032
   37   HG23  ILE   6          3HG2      ILE   6  -1.580   1.813   8.881
   38   HD11  ILE   6          1HD1      ILE   6  -0.315   3.969   8.247
   39   HD12  ILE   6          2HD1      ILE   6  -0.760   3.942   9.953
   40   HD13  ILE   6          3HD1      ILE   6   0.780   4.641   9.455
   41    H    PHE   7           H        PHE   7  -0.379  -1.732   7.904
   42    HA   PHE   7           HA       PHE   7   1.037  -2.532   5.502
   43    HB2  PHE   7          2HB       PHE   7   0.365  -4.513   6.330
   44    HB3  PHE   7          3HB       PHE   7  -0.851  -3.761   7.357
   45    HD1  PHE   7           HD1      PHE   7  -0.192  -5.399   4.183
   46    HD2  PHE   7           HD2      PHE   7  -3.118  -3.377   6.521
   47    HE1  PHE   7           HE1      PHE   7  -1.962  -6.254   2.702
   48    HE2  PHE   7           HE2      PHE   7  -4.892  -4.229   5.044
   49    HZ   PHE   7           HZ       PHE   7  -4.315  -5.670   3.133
   50    H    GLU   8           H        GLU   8  -1.072  -0.165   6.084
   51    HA   GLU   8           HA       GLU   8  -2.339   1.145   4.711
   52    HB2  GLU   8          2HB       GLU   8  -1.859  -0.843   2.496
   53    HB3  GLU   8          3HB       GLU   8  -2.275   0.859   2.349
   54    HG2  GLU   8          2HG       GLU   8  -0.106   1.499   3.202
   55    HG3  GLU   8          3HG       GLU   8   0.316  -0.192   3.462
   56    H    THR   9           H        THR   9  -4.486   1.270   4.757
   57    HA   THR   9           HA       THR   9  -6.019  -1.242   4.665
   58    HB   THR   9           HB       THR   9  -7.746  -0.119   5.969
   59    HG1  THR   9           HG1      THR   9  -5.977   2.119   5.974
   60   HG21  THR   9          1HG2      THR   9  -6.641  -0.077   8.051
   61   HG22  THR   9          2HG2      THR   9  -5.122   0.451   7.327
   62   HG23  THR   9          3HG2      THR   9  -5.704  -1.192   7.058
   63    H    TRP  10           H        TRP  10  -5.751  -0.846   2.245
   64    HA   TRP  10           HA       TRP  10  -8.222  -0.011   1.184
   65    HB2  TRP  10          2HB       TRP  10  -7.575   1.951  -0.080
   66    HB3  TRP  10          3HB       TRP  10  -7.257   2.237   1.629
   67    HD1  TRP  10           HD1      TRP  10  -5.425   1.603  -1.685
   68    HE1  TRP  10           HE1      TRP  10  -2.984   2.377  -1.427
   69    HE3  TRP  10           HE3      TRP  10  -5.432   2.654   3.318
   70    HZ2  TRP  10           HZ2      TRP  10  -1.286   3.309   0.626
   71    HZ3  TRP  10           HZ3      TRP  10  -3.358   3.483   4.352
   72    HH2  TRP  10           HH2      TRP  10  -1.329   3.802   3.032
   73    H    VAL  11           H        VAL  11  -4.823  -0.699   0.653
   74    HA   VAL  11           HA       VAL  11  -5.122  -1.399  -2.108
   75    HB   VAL  11           HB       VAL  11  -2.836  -2.470  -1.760
   76   HG11  VAL  11          1HG1      VAL  11  -2.014  -0.511  -2.433
   77   HG12  VAL  11          2HG1      VAL  11  -3.618   0.162  -2.137
   78   HG13  VAL  11          3HG1      VAL  11  -2.377   0.254  -0.886
   79   HG21  VAL  11          1HG2      VAL  11  -1.649  -2.048   0.252
   80   HG22  VAL  11          2HG2      VAL  11  -2.940  -1.023   0.879
   81   HG23  VAL  11          3HG2      VAL  11  -3.194  -2.761   0.718
   82    H    THR  12           H        THR  12  -5.240  -3.113   0.944
   83    HA   THR  12           HA       THR  12  -5.471  -5.353   1.438
   84    HB   THR  12           HB       THR  12  -7.771  -4.626   0.997
   85    HG1  THR  12           HG1      THR  12  -8.562  -6.676   0.859
   86   HG21  THR  12          1HG2      THR  12  -7.736  -3.865  -1.237
   87   HG22  THR  12          2HG2      THR  12  -8.755  -5.305  -1.254
   88   HG23  THR  12          3HG2      THR  12  -7.091  -5.395  -1.831
   89    H    GLU  13           H        GLU  13  -3.345  -5.031  -0.343
   90    HA   GLU  13           HA       GLU  13  -3.632  -7.415  -2.053
   91    HB2  GLU  13          2HB       GLU  13  -3.333  -5.288  -3.319
   92    HB3  GLU  13          3HB       GLU  13  -1.786  -5.067  -2.515
   93    HG2  GLU  13          2HG       GLU  13  -0.753  -6.657  -3.752
   94    HG3  GLU  13          3HG       GLU  13  -2.211  -7.633  -3.920
   95    H    GLY  14           H        GLY  14  -1.541  -5.591   0.118
   96    HA2  GLY  14          2HA       GLY  14  -0.359  -7.114   1.738
   97    HA3  GLY  14          3HA       GLY  14   0.212  -7.961   0.308
   98    H    ASN  15           H        ASN  15   0.153  -4.672   1.679
   99    HA   ASN  15           HA       ASN  15   3.010  -4.443   1.231
  100    HB2  ASN  15          2HB       ASN  15   0.981  -2.745  -0.209
  101    HB3  ASN  15          3HB       ASN  15   2.617  -2.168   0.094
  102   HD21  ASN  15          1HD2      ASN  15   0.620  -4.034  -1.895
  103   HD22  ASN  15          2HD2      ASN  15   1.845  -4.699  -2.915
  104    H    TYR  16           H        TYR  16   3.520  -1.905   1.783
  105    HA   TYR  16           HA       TYR  16   1.964  -1.147   4.146
  106    HB2  TYR  16          2HB       TYR  16   4.954  -1.592   4.110
  107    HB3  TYR  16          3HB       TYR  16   4.096  -0.770   5.408
  108    HD1  TYR  16           HD1      TYR  16   3.147  -1.994   7.162
  109    HD2  TYR  16           HD2      TYR  16   4.296  -4.011   3.596
  110    HE1  TYR  16           HE1      TYR  16   2.717  -4.156   8.254
  111    HE2  TYR  16           HE2      TYR  16   3.868  -6.179   4.677
  112    HH   TYR  16           HH       TYR  16   3.801  -7.071   7.046
  113    H    TYR  17           H        TYR  17   3.243   0.968   5.069
  114    HA   TYR  17           HA       TYR  17   4.388   2.700   3.152
  115    HB2  TYR  17          2HB       TYR  17   2.653   3.856   2.285
  116    HB3  TYR  17          3HB       TYR  17   1.704   2.441   2.727
  117    HD1  TYR  17           HD1      TYR  17   2.307   5.947   3.347
  118    HD2  TYR  17           HD2      TYR  17   0.413   2.456   4.873
  119    HE1  TYR  17           HE1      TYR  17   0.910   7.350   4.806
  120    HE2  TYR  17           HE2      TYR  17  -0.990   3.849   6.335
  121    HH   TYR  17           HH       TYR  17  -1.464   7.035   5.939
  122    H    GLY  18           H        GLY  18   2.559   2.333   6.133
  123    HA2  GLY  18          2HA       GLY  18   3.279   3.067   8.246
  124    HA3  GLY  18          3HA       GLY  18   4.427   4.138   7.457