*HEADER    HYDROLASE INHIBITOR                     05-JUN-13   2M99              
*TITLE     SOLUTION STRUCTURE OF A CHYMOTRYPSIN INHIBITOR FROM THE TAIWAN COBRA  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEASE INHIBITOR NACI;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: CHYMOTRYPSIN INHIBITOR, NACI;                               
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: NAJA ATRA;                                      
*SOURCE   3 ORGANISM_COMMON: TAIWAN COBRA;                                       
*SOURCE   4 ORGANISM_TAXID: 8656;                                                
*SOURCE   5 GENE: ACI;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET-29A(+)                                 
*KEYWDS    NAJA NAJA ATRA, CHYMOTRYPSIN INHIBITOR, NACI, HYDROLASE INHIBITOR     
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.-J.LIN, T.IKEYA, P.GUNTERT, L.-S.CHANG                              
*REVDAT   1   16-OCT-13 2M99    0                                                


 31 HIS  HA     48 ILE  HB      5.31            #peak    23 #SUP  0.70  #QF  0.70
 47 THR  HA     48 ILE  QG2     4.89            #peak    25 #SUP  0.89  #QF  0.74
 21 TYR  QD     48 ILE  HB      4.86            #peak    28 #SUP  0.99  #QF  0.95
 47 THR  HB     48 ILE  QG2     5.20            #peak    30 #SUP  0.78  #QF  0.78
 47 THR  QG2    48 ILE  QG2     5.10            #peak    34 #SUP  0.83  #QF  0.83
 48 ILE  QG2    49 ASP  HA      4.93            #peak    35 #SUP  0.80  #QF  0.80
 21 TYR  HB3    48 ILE  HB      5.50            #peak    41 #SUP  1.00  #QF  0.97
 48 ILE  QG2    52 ASN  HD22    4.78            #peak    42 #SUP  0.67  #QF  0.67
 48 ILE  QG2    48 ILE  HG12    3.50            #peak    44 #SUP  1.00  #QF  0.96
 29 THR  QG2    48 ILE  QD1     5.50            #peak    45 #SUP  0.25  #QF  0.25
 31 HIS  HA     48 ILE  QD1     5.16            #peak    49 #SUP  0.74  #QF  0.74
 30 CYSS HB2    48 ILE  QD1     5.13            #peak    52 #SUP  0.75  #QF  0.32
 30 CYSS HB3    48 ILE  QD1     5.13            #peak    54 #SUP  0.90  #QF  0.39
 21 TYR  QD     48 ILE  QG2     4.78            #peak    55 #SUP  0.98  #QF  0.47
 21 TYR  QE     48 ILE  QG2     4.42            #peak    57 #SUP  0.96  #QF  0.46
 48 ILE  HA     48 ILE  QD1     4.28            #peak    64 #SUP  0.92  #QF  0.92
  4 PHE  HA     42 ALA  QB      5.17            #peak    66 #SUP  0.34  #QF  0.34
  4 PHE  QD     42 ALA  QB      4.79            #peak    67 #SUP  0.57  #QF  0.42
  4 PHE  HB2    42 ALA  QB      4.78            #peak    73 #SUP  0.46  #QF  0.46
 41 ASN  HA     42 ALA  QB      5.17            #peak    74 #SUP  0.46  #QF  0.46
  4 PHE  QE     42 ALA  QB      5.24            #peak    75 #SUP  0.76  #QF  0.52
 18 VAL  QG2    35 TYR  HB2     5.31            #peak    89 #SUP  0.89  #QF  0.89
 30 CYSS HB3    48 ILE  HG12    5.50            #peak    90 #SUP  0.81  #QF  0.47
 16 ALA  HA     18 VAL  QG2     5.50            #peak    91 #SUP  0.76  #QF  0.61
 48 ILE  HG12   52 ASN  HD21    5.50            #peak    96 #SUP  0.81  #QF  0.81
 18 VAL  QG2    19 PRO  HD2     5.04            #peak    97 #SUP  0.96  #QF  0.68
 18 VAL  QG2    19 PRO  HD3     5.50            #peak    97 #SUP  0.96  #QF  0.68
 17 PHE  HA     18 VAL  QG2     4.92            #peak   102 #SUP  0.88  #QF  0.88
 18 VAL  QG2    19 PRO  HA      5.13            #peak   105 #SUP  0.44  #QF  0.44
 17 PHE  HB2    18 VAL  QG2     5.50            #peak   109 #SUP  0.82  #QF  0.82
 17 PHE  HB3    18 VAL  QG2     5.50            #peak   110 #SUP  0.82  #QF  0.82
 18 VAL  QG2    35 TYR  HB3     5.24            #peak   111 #SUP  0.69  #QF  0.53
 21 TYR  QD     48 ILE  HG12    5.50            #peak   112 #SUP  0.96  #QF  0.82
 30 CYSS HB2    48 ILE  HG12    5.50            #peak   115 #SUP  0.38  #QF  0.38
 48 ILE  HG12   53 ARG  H       5.50            #peak   124 #SUP  0.92  #QF  0.92
 16 ALA  H      18 VAL  QG2     5.45            #peak   127 #SUP  0.70  #QF  0.70
 48 ILE  HG12   49 ASP  HA      4.52            #peak   133 #SUP  0.66  #QF  0.66
  7 LEU  QD2    43 ASN  H       5.19            #peak   154 #SUP  0.43  #QF  0.43
 18 VAL  HA     18 VAL  QG1     4.13            #peak   155 #SUP  0.93  #QF  0.93
 18 VAL  QG1    19 PRO  HG2     5.44            #peak   163 #SUP  0.85  #QF  0.85
  6 GLU  HA      7 LEU  QD2     5.18            #peak   164 #SUP  0.21  #QF  0.21
 18 VAL  QG1    19 PRO  HD2     4.50            #peak   165 #SUP  0.98  #QF  0.45
 52 ASN  QB     56 VAL  QG1     5.05            #peak   169 #SUP  0.99  #QF  0.97
  7 LEU  QD2    42 ALA  QB      4.46            #peak   170 #SUP  0.42  #QF  0.42
 33 PHE  HB2    34 THR  QG2     5.50            #peak   172 #SUP  0.62  #QF  0.62
 33 PHE  HA     34 THR  QG2     4.94            #peak   174 #SUP  0.53  #QF  0.53
  7 LEU  QD2    41 ASN  HB3     5.29            #peak   179 #SUP  0.93  #QF  0.81
  3 ARG  QD      7 LEU  QD2     5.50            #peak   182 #SUP  0.92  #QF  0.69
  4 PHE  HB2     7 LEU  QD2     5.50            #peak   182 #SUP  0.92  #QF  0.69
  7 LEU  HA      7 LEU  QD2     3.87            #peak   188 #SUP  0.76  #QF  0.76
  7 LEU  QD2    42 ALA  H       4.95            #peak   190 #SUP  0.85  #QF  0.85
 28 ASN  HD21   56 VAL  QG1     4.70            #peak   192 #SUP  0.78  #QF  0.78
  7 LEU  H       7 LEU  QD2     4.33            #peak   193 #SUP  0.78  #QF  0.78
 28 ASN  HA     56 VAL  QG1     4.87            #peak   194 #SUP  0.91  #QF  0.43
 52 ASN  HA     56 VAL  QG1     5.29            #peak   194 #SUP  0.91  #QF  0.43
  4 PHE  QD      7 LEU  QD2     5.49            #peak   196 #SUP  0.83  #QF  0.83
  4 PHE  HA      7 LEU  QD2     4.47            #peak   197 #SUP  0.93  #QF  0.59
 19 PRO  HA     34 THR  QG2     5.11            #peak   197 #SUP  0.93  #QF  0.59
 17 PHE  HA     18 VAL  QG1     4.54            #peak   198 #SUP  0.88  #QF  0.88
  7 LEU  QD2    41 ASN  HB2     5.29            #peak   199 #SUP  0.85  #QF  0.85
 17 PHE  QE     34 THR  QG2     4.81            #peak   200 #SUP  0.95  #QF  0.65
 17 PHE  QD     34 THR  QG2     4.30            #peak   203 #SUP  0.89  #QF  0.89
 34 THR  HA     34 THR  QG2     4.02            #peak   204 #SUP  0.91  #QF  0.91
 56 VAL  HA     56 VAL  QG1     4.19            #peak   206 #SUP  0.99  #QF  0.91
 17 PHE  HB3    18 VAL  QG1     4.49            #peak   207 #SUP  0.92  #QF  0.92
  7 LEU  QD2     8 ALA  QB      4.97            #peak   209 #SUP  0.94  #QF  0.94
 48 ILE  HG13   52 ASN  QB      5.50            #peak   215 #SUP  0.99  #QF  0.98
 52 ASN  QB     56 VAL  QG2     5.50            #peak   215 #SUP  0.99  #QF  0.98
 29 THR  QG2    56 VAL  QG2     4.38            #peak   217 #SUP  0.43  #QF  0.43
 52 ASN  HA     56 VAL  QG2     4.39            #peak   221 #SUP  0.91  #QF  0.57
 23 TYR  HA     56 VAL  QG2     5.50            #peak   224 #SUP  0.93  #QF  0.75
 55 CYSS HA     56 VAL  QG2     5.50            #peak   224 #SUP  0.93  #QF  0.75
 28 ASN  HD22   56 VAL  QG2     5.50            #peak   230 #SUP  0.66  #QF  0.66
 25 GLN  HA     56 VAL  QG2     5.50            #peak   231 #SUP  0.90  #QF  0.90
 55 CYSS HB2    56 VAL  QG2     5.46            #peak   232 #SUP  0.89  #QF  0.80
  7 LEU  QD1    42 ALA  QB      4.28            #peak   237 #SUP  0.53  #QF  0.53
  7 LEU  QD1    41 ASN  HB2     4.96            #peak   238 #SUP  0.79  #QF  0.79
  7 LEU  HA      7 LEU  QD1     5.17            #peak   239 #SUP  0.89  #QF  0.57
  4 PHE  HA      7 LEU  QD1     4.48            #peak   245 #SUP  0.78  #QF  0.78
  7 LEU  QD1    41 ASN  HB3     4.96            #peak   247 #SUP  0.95  #QF  0.85
  4 PHE  HB2     7 LEU  QD1     4.93            #peak   248 #SUP  0.90  #QF  0.36
  7 LEU  QD1    41 ASN  HA      5.40            #peak   249 #SUP  0.80  #QF  0.80
 29 THR  HA     29 THR  QG2     4.12            #peak   258 #SUP  0.88  #QF  0.88
 28 ASN  HA     29 THR  QG2     5.50            #peak   264 #SUP  0.54  #QF  0.54
 16 ALA  QB     18 VAL  QG1     4.26            #peak   265 #SUP  0.41  #QF  0.41
 16 ALA  QB     17 PHE  HB3     5.50            #peak   271 #SUP  0.86  #QF  0.69
 24 ASN  HB3    29 THR  QG2     5.13            #peak   276 #SUP  0.67  #QF  0.67
 14 CYSS HA     16 ALA  QB      5.50            #peak   277 #SUP  0.76  #QF  0.76
 16 ALA  QB     18 VAL  QG2     3.37            #peak   278 #SUP  0.75  #QF  0.75
 16 ALA  QB     17 PHE  HB2     5.50            #peak   279 #SUP  0.76  #QF  0.76
 46 ARG  HG3    47 THR  QG2     5.18            #peak   292 #SUP  0.75  #QF  0.75
 47 THR  QG2    50 GLU  H       5.34            #peak   294 #SUP  0.81  #QF  0.81
 46 ARG  HA     47 THR  QG2     5.29            #peak   295 #SUP  0.73  #QF  0.73
 47 THR  QG2    51 CYSS HA      5.50            #peak   296 #SUP  0.70  #QF  0.70
 47 THR  HA     47 THR  QG2     3.98            #peak   299 #SUP  0.69  #QF  0.69
 21 TYR  QE     47 THR  QG2     5.37            #peak   304 #SUP  0.89  #QF  0.89
 47 THR  QG2    50 GLU  QB      5.36            #peak   305 #SUP  0.86  #QF  0.86
 46 ARG  HG2    47 THR  QG2     5.18            #peak   306 #SUP  0.88  #QF  0.88
 47 THR  QG2    49 ASP  HA      4.46            #peak   308 #SUP  0.91  #QF  0.91
 47 THR  QG2    53 ARG  HG2     5.50            #peak   311 #SUP  0.75  #QF  0.75
  9 PRO  HG2    10 SER  HA      5.50            #peak   320 #SUP  0.48  #QF  0.48
  1 ARG  QB     25 GLN  HG3     5.43            #peak   329 #SUP  0.70  #QF  0.70
 25 GLN  HG3    26 TYR  H       5.47            #peak   338 #SUP  0.35  #QF  0.35
  8 ALA  QB     10 SER  HA      4.91            #peak   345 #SUP  0.63  #QF  0.63
  8 ALA  QB      9 PRO  HG3     5.46            #peak   346 #SUP  0.82  #QF  0.82
  8 ALA  QB      9 PRO  HD3     4.59            #peak   347 #SUP  0.91  #QF  0.91
  8 ALA  QB      9 PRO  HD2     4.38            #peak   348 #SUP  0.95  #QF  0.91
  7 LEU  HA      8 ALA  QB      4.47            #peak   353 #SUP  0.83  #QF  0.83
  1 ARG  QG     55 CYSS HA      5.50            #peak   379 #SUP  0.71  #QF  0.71
 51 CYSS HA     54 THR  QG2     4.43            #peak   389 #SUP  0.98  #QF  0.89
 54 THR  HA     54 THR  QG2     4.04            #peak   390 #SUP  0.91  #QF  0.91
  4 PHE  HZ     54 THR  QG2     4.02            #peak   391 #SUP  0.86  #QF  0.68
  2 PRO  HD3    54 THR  QG2     5.16            #peak   397 #SUP  0.92  #QF  0.92
  1 ARG  HA     54 THR  QG2     5.50            #peak   398 #SUP  0.78  #QF  0.78
  2 PRO  HB2    54 THR  QG2     5.50            #peak   401 #SUP  0.88  #QF  0.88
  2 PRO  HB3    54 THR  QG2     5.50            #peak   402 #SUP  0.66  #QF  0.66
 53 ARG  H      54 THR  QG2     5.32            #peak   403 #SUP  0.93  #QF  0.93
 54 THR  QG2    56 VAL  QG2     5.39            #peak   405 #SUP  0.92  #QF  0.92
 54 THR  QG2    55 CYSS HA      4.96            #peak   409 #SUP  0.89  #QF  0.89
 54 THR  QG2    55 CYSS HB3     4.68            #peak   413 #SUP  0.72  #QF  0.72
 53 ARG  QB     54 THR  QG2     5.34            #peak   416 #SUP  0.35  #QF  0.35
  7 LEU  HB2    42 ALA  H       5.50            #peak   420 #SUP  1.00  #QF  0.95
  2 PRO  HG3     4 PHE  QD      5.29            #peak   441 #SUP  0.53  #QF  0.53
  2 PRO  HG3    55 CYSS HB3     5.13            #peak   448 #SUP  0.23  #QF  0.23
  2 PRO  HG3    55 CYSS HA      5.49            #peak   449 #SUP  0.29  #QF  0.29
 49 ASP  HA     53 ARG  HG2     5.46            #peak   457 #SUP  0.93  #QF  0.93
  1 ARG  QB      2 PRO  HD3     5.27            #peak   461 #SUP  0.89  #QF  0.89
 50 GLU  HA     53 ARG  HG2     5.50            #peak   467 #SUP  0.92  #QF  0.44
  1 ARG  QB     55 CYSS HA      5.47            #peak   468 #SUP  0.64  #QF  0.64
 11 ALA  QB     12 GLY  QA      5.50            #peak   481 #SUP  0.83  #QF  0.83
 10 SER  HA     11 ALA  QB      4.46            #peak   484 #SUP  0.86  #QF  0.86
 11 ALA  QB     33 PHE  QD      5.13            #peak   485 #SUP  0.89  #QF  0.89
 11 ALA  QB     35 TYR  QD      5.50            #peak   488 #SUP  0.93  #QF  0.87
 11 ALA  QB     35 TYR  HA      4.73            #peak   489 #SUP  0.98  #QF  0.91
  2 PRO  HA      3 ARG  QG      5.47            #peak   494 #SUP  0.90  #QF  0.90
  3 ARG  QG      7 LEU  QD2     4.35            #peak   499 #SUP  0.35  #QF  0.35
  2 PRO  HG2     4 PHE  H       5.20            #peak   509 #SUP  0.82  #QF  0.36
  2 PRO  HG2     3 ARG  H       4.72            #peak   510 #SUP  0.34  #QF  0.34
 50 GLU  QB     51 CYSS HA      5.50            #peak   515 #SUP  0.93  #QF  0.80
  2 PRO  HG2    55 CYSS HA      5.50            #peak   520 #SUP  0.98  #QF  0.95
  2 PRO  HG2     4 PHE  QE      4.94            #peak   532 #SUP  0.99  #QF  0.85
  4 PHE  HA      7 LEU  HG      4.94            #peak   550 #SUP  0.98  #QF  0.60
  7 LEU  HB3     9 PRO  HA      5.50            #peak   587 #SUP  0.25  #QF  0.25
  1 ARG  QB     55 CYSS HB3     4.78            #peak   599 #SUP  0.36  #QF  0.36
  6 GLU  HB2    25 GLN  HG3     4.54            #peak   618 #SUP  0.49  #QF  0.49
 24 ASN  HB2    29 THR  QG2     5.13            #peak   626 #SUP  0.37  #QF  0.37
  2 PRO  HD2    55 CYSS HB3     4.55            #peak   631 #SUP  0.43  #QF  0.43
 50 GLU  QB     53 ARG  HG2     5.50            #peak   649 #SUP  0.26  #QF  0.26
  6 GLU  QG      7 LEU  HA      5.33            #peak   658 #SUP  0.70  #QF  0.52
  6 GLU  QG      7 LEU  HG      4.98            #peak   665 #SUP  0.41  #QF  0.41
 48 ILE  QG2    49 ASP  QB      5.50            #peak   714 #SUP  0.97  #QF  0.38
 21 TYR  HB3    22 TYR  HB2     5.50            #peak   720 #SUP  0.29  #QF  0.29
 49 ASP  HA     52 ASN  QB      4.84            #peak   730 #SUP  0.59  #QF  0.59
 51 CYSS H      52 ASN  QB      5.49            #peak   731 #SUP  0.67  #QF  0.67
 18 VAL  HB     35 TYR  HB3     4.84            #peak   743 #SUP  0.70  #QF  0.70
 21 TYR  HB2    51 CYSS H       6.00            #peak   754 #SUP  0.45  #QF  0.45
 21 TYR  HB2    48 ILE  H       5.18            #peak   769 #SUP  0.40  #QF  0.40
 16 ALA  HA     17 PHE  HB2     5.50            #peak   787 #SUP  0.86  #QF  0.55
 26 TYR  HB3    28 ASN  H       5.44            #peak   814 #SUP  0.34  #QF  0.34
 48 ILE  HA     50 GLU  QB      5.26            #peak   823 #SUP  0.30  #QF  0.30
  4 PHE  HB3    42 ALA  QB      5.01            #peak   827 #SUP  0.70  #QF  0.42
 48 ILE  HA     51 CYSS HB2     4.96            #peak   832 #SUP  0.73  #QF  0.73
  2 PRO  HG2     4 PHE  HB3     5.50            #peak   839 #SUP  0.99  #QF  0.93
 21 TYR  QD     48 ILE  HA      5.39            #peak   842 #SUP  0.98  #QF  0.98
 21 TYR  HB3    48 ILE  HA      4.64            #peak   843 #SUP  0.76  #QF  0.76
 49 ASP  QB     53 ARG  QD      4.80            #peak   850 #SUP  0.52  #QF  0.52
  9 PRO  HD3    22 TYR  QD      5.45            #peak   862 #SUP  1.00  #QF  0.99
 22 TYR  QD     31 HIS  HB3     5.50            #peak   862 #SUP  1.00  #QF  0.99
 22 TYR  HB3    33 PHE  HB2     5.26            #peak   890 #SUP  0.24  #QF  0.24
  4 PHE  HB2     5 CYSS H       4.34            #peak   902 #SUP  0.46  #QF  0.46
  9 PRO  HD2    22 TYR  QD      5.50            #peak   950 #SUP  0.77  #QF  0.77
  1 ARG  QB      2 PRO  HD2     5.23            #peak  1017 #SUP  0.99  #QF  0.98
  2 PRO  HD2    55 CYSS H       4.98            #peak  1022 #SUP  0.79  #QF  0.79
  2 PRO  HD2    54 THR  QG2     4.97            #peak  1024 #SUP  0.95  #QF  0.92
 50 GLU  HA     54 THR  QG2     5.50            #peak  1024 #SUP  0.95  #QF  0.92
  1 ARG  H       2 PRO  HD2     4.80            #peak  1031 #SUP  0.84  #QF  0.84
  3 ARG  HA      3 ARG  QD      4.91            #peak  1045 #SUP  0.70  #QF  0.70
 53 ARG  HA     54 THR  QG2     5.45            #peak  1046 #SUP  0.92  #QF  0.92
  3 ARG  HA      4 PHE  HA      5.35            #peak  1054 #SUP  0.90  #QF  0.90
  2 PRO  HG2     3 ARG  HA      5.50            #peak  1057 #SUP  0.36  #QF  0.36
 28 ASN  HA     29 THR  HB      5.23            #peak  1070 #SUP  0.89  #QF  0.89
 19 PRO  HA     34 THR  HA      4.46            #peak  1082 #SUP  0.58  #QF  0.58
 18 VAL  QG2    34 THR  HA      5.27            #peak  1092 #SUP  0.79  #QF  0.79
 11 ALA  QB     34 THR  HA      5.50            #peak  1105 #SUP  0.88  #QF  0.88
 34 THR  HA     35 TYR  HA      5.15            #peak  1106 #SUP  0.68  #QF  0.68
 19 PRO  HD3    34 THR  HA      5.50            #peak  1112 #SUP  0.28  #QF  0.28
  2 PRO  HA      3 ARG  HA      4.38            #peak  1113 #SUP  0.64  #QF  0.64
  1 ARG  QB      2 PRO  HA      5.50            #peak  1127 #SUP  0.62  #QF  0.33
 27 SER  HA     28 ASN  HA      5.50            #peak  1148 #SUP  0.74  #QF  0.74
 52 ASN  HA     56 VAL  HA      5.50            #peak  1154 #SUP  0.95  #QF  0.37
 49 ASP  HA     50 GLU  HA      4.83            #peak  1156 #SUP  0.44  #QF  0.44
 52 ASN  HA     53 ARG  HA      5.01            #peak  1157 #SUP  0.65  #QF  0.65
 49 ASP  HA     53 ARG  QB      5.50            #peak  1171 #SUP  0.74  #QF  0.40
  5 CYSS HA      7 LEU  HG      4.79            #peak  1175 #SUP  0.75  #QF  0.75
  4 PHE  QE      5 CYSS HA      5.50            #peak  1182 #SUP  0.99  #QF  0.86
  4 PHE  HB2     5 CYSS HA      5.43            #peak  1183 #SUP  0.68  #QF  0.68
 25 GLN  HG2    26 TYR  HA      5.50            #peak  1203 #SUP  0.85  #QF  0.66
 25 GLN  HG3    26 TYR  HA      5.50            #peak  1203 #SUP  0.85  #QF  0.66
  9 PRO  HA     10 SER  HA      4.85            #peak  1206 #SUP  0.32  #QF  0.32
  6 GLU  HA      7 LEU  HB2     5.50            #peak  1219 #SUP  0.62  #QF  0.41
  7 LEU  HB2     9 PRO  HA      5.50            #peak  1219 #SUP  0.62  #QF  0.41
  9 PRO  HA     43 ASN  H       4.48            #peak  1222 #SUP  0.74  #QF  0.74
  6 GLU  HA      7 LEU  HG      5.36            #peak  1223 #SUP  0.69  #QF  0.69
  7 LEU  HA      8 ALA  HA      4.43            #peak  1238 #SUP  0.68  #QF  0.68
 19 PRO  HA     34 THR  HB      4.98            #peak  1240 #SUP  0.60  #QF  0.60
  7 LEU  HB3     8 ALA  HA      5.16            #peak  1242 #SUP  0.68  #QF  0.68
 18 VAL  HB     19 PRO  HA      5.39            #peak  1247 #SUP  0.50  #QF  0.50
  1 ARG  HA     57 GLY  H       5.50            #peak  1279 #SUP  0.85  #QF  0.58
 17 PHE  HA     19 PRO  HD3     5.50            #peak  1287 #SUP  0.89  #QF  0.53
 17 PHE  HA     34 THR  HB      5.34            #peak  1288 #SUP  0.51  #QF  0.51
 55 CYSS HA     56 VAL  HA      5.03            #peak  1289 #SUP  0.31  #QF  0.31
 11 ALA  HA     12 GLY  QA      4.99            #peak  1295 #SUP  0.69  #QF  0.69
 41 ASN  HA     42 ALA  HA      4.39            #peak  1296 #SUP  0.64  #QF  0.64
 23 TYR  HA     30 CYSS HA      5.34            #peak  1307 #SUP  0.61  #QF  0.61
 48 ILE  QD1    52 ASN  HD21    5.02            #peak  1341 #SUP  0.97  #QF  0.97
 22 TYR  QE     24 ASN  HA      5.24            #peak  1349 #SUP  0.75  #QF  0.75
  9 PRO  HD3    22 TYR  QE      4.67            #peak  1350 #SUP  0.62  #QF  0.62
 22 TYR  QE     33 PHE  HB2     5.49            #peak  1351 #SUP  0.74  #QF  0.74
  9 PRO  HD2    22 TYR  QE      5.30            #peak  1354 #SUP  0.80  #QF  0.80
 22 TYR  QE     33 PHE  HB3     5.50            #peak  1358 #SUP  0.90  #QF  0.90
 22 TYR  QE     33 PHE  QE      5.50            #peak  1359 #SUP  0.81  #QF  0.81
 21 TYR  QD     51 CYSS HB2     5.50            #peak  1363 #SUP  0.81  #QF  0.68
 21 TYR  HA     21 TYR  QD      5.37            #peak  1368 #SUP  0.65  #QF  0.65
 21 TYR  QD     47 THR  HA      4.46            #peak  1370 #SUP  0.80  #QF  0.80
 21 TYR  QD     48 ILE  QD1     4.70            #peak  1373 #SUP  0.93  #QF  0.93
 21 TYR  QD     32 SER  HB2     5.42            #peak  1375 #SUP  0.96  #QF  0.96
 21 TYR  QD     32 SER  HB3     5.42            #peak  1378 #SUP  0.80  #QF  0.80
 21 TYR  QE     47 THR  HB      5.50            #peak  1403 #SUP  0.93  #QF  0.93
 21 TYR  QE     48 ILE  QD1     4.35            #peak  1410 #SUP  0.96  #QF  0.96
 21 TYR  QE     48 ILE  HB      4.91            #peak  1413 #SUP  1.00  #QF  0.96
 21 TYR  QE     32 SER  HB3     5.02            #peak  1414 #SUP  0.79  #QF  0.79
 21 TYR  QE     32 SER  HB2     5.02            #peak  1415 #SUP  0.97  #QF  0.97
 21 TYR  QE     47 THR  HA      4.15            #peak  1416 #SUP  0.77  #QF  0.77
 21 TYR  QE     48 ILE  HA      5.50            #peak  1417 #SUP  1.00  #QF  0.77
 26 TYR  HA     26 TYR  QE      5.23            #peak  1420 #SUP  0.63  #QF  0.63
 21 TYR  QE     47 THR  H       5.20            #peak  1423 #SUP  0.97  #QF  0.97
 22 TYR  QD     23 TYR  QD      5.20 
 22 TYR  QD     31 HIS  H       5.50            #peak  1447 #SUP  0.49  #QF  0.49
 22 TYR  QD     33 PHE  HB2     5.09            #peak  1448 #SUP  0.94  #QF  0.60
 22 TYR  QD     43 ASN  HD21    5.47            #peak  1449 #SUP  0.95  #QF  0.67
 22 TYR  QD     33 PHE  HB3     5.21            #peak  1452 #SUP  0.62  #QF  0.62
 22 TYR  HA     22 TYR  QD      5.33            #peak  1455 #SUP  0.78  #QF  0.78
  4 PHE  QD     43 ASN  H       5.01            #peak  1466 #SUP  0.42  #QF  0.42
  4 PHE  QD      5 CYSS H       4.64            #peak  1474 #SUP  0.45  #QF  0.45
  4 PHE  HA      4 PHE  QD      5.40            #peak  1477 #SUP  0.57  #QF  0.57
  4 PHE  QD      7 LEU  QD1     5.50            #peak  1481 #SUP  0.80  #QF  0.80
  4 PHE  QD      7 LEU  HB2     5.50            #peak  1484 #SUP  0.96  #QF  0.36
  4 PHE  QD     54 THR  QG2     5.50            #peak  1484 #SUP  0.96  #QF  0.36
  4 PHE  QD      6 GLU  H       5.04            #peak  1485 #SUP  0.82  #QF  0.82
 22 TYR  QD     33 PHE  QD      4.25            #peak  1503 #SUP  0.87  #QF  0.87
 21 TYR  HA     33 PHE  QD      5.50            #peak  1504 #SUP  0.65  #QF  0.65
 22 TYR  QE     33 PHE  QD      4.83            #peak  1511 #SUP  0.97  #QF  0.97
 22 TYR  HB3    33 PHE  QD      5.50            #peak  1512 #SUP  0.66  #QF  0.66
 17 PHE  QD     18 VAL  HA      5.50            #peak  1513 #SUP  0.96  #QF  0.28
 33 PHE  QD     35 TYR  HA      5.50            #peak  1513 #SUP  0.96  #QF  0.28
 17 PHE  QD     19 PRO  HD3     5.50            #peak  1515 #SUP  0.83  #QF  0.37
 17 PHE  QD     34 THR  HB      5.50            #peak  1517 #SUP  0.96  #QF  0.53
 33 PHE  QD     34 THR  HB      5.50            #peak  1517 #SUP  0.96  #QF  0.53
  1 ARG  HE     57 GLY  HA3     5.50            #peak  1517 #SUP  0.96  #QF  0.53
 22 TYR  HB2    33 PHE  QD      4.89            #peak  1520 #SUP  0.99  #QF  0.76
 17 PHE  QD     34 THR  HA      5.50            #peak  1523 #SUP  0.98  #QF  0.92
 33 PHE  QD     34 THR  HA      5.50            #peak  1523 #SUP  0.98  #QF  0.92
 17 PHE  HA     17 PHE  QD      4.83            #peak  1524 #SUP  0.83  #QF  0.83
 15 PHE  QD     16 ALA  HA      5.50            #peak  1534 #SUP  0.98  #QF  0.61
 28 ASN  HD21   56 VAL  QG2     5.50            #peak  1543 #SUP  1.00  #QF  0.58
 15 PHE  HA     15 PHE  QD      4.61            #peak  1544 #SUP  0.90  #QF  0.90
 27 SER  HB3    29 THR  H       5.08            #peak  1551 #SUP  0.98  #QF  0.75
 33 PHE  QE     35 TYR  HB2     5.35            #peak  1557 #SUP  0.63  #QF  0.63
 22 TYR  HB3    33 PHE  QE      5.37            #peak  1562 #SUP  0.42  #QF  0.42
 22 TYR  QD     33 PHE  QE      4.75            #peak  1566 #SUP  0.80  #QF  0.80
 22 TYR  HB2    33 PHE  QE      5.50            #peak  1567 #SUP  0.90  #QF  0.24
 22 TYR  HA     33 PHE  QE      5.50            #peak  1568 #SUP  0.74  #QF  0.74
 23 TYR  QE     28 ASN  H       5.32            #peak  1573 #SUP  0.58  #QF  0.58
 26 TYR  HA     26 TYR  QD      4.35            #peak  1575 #SUP  0.81  #QF  0.81
  9 PRO  HG2    33 PHE  QE      5.50            #peak  1576 #SUP  1.00  #QF  0.69
 25 GLN  HG2    26 TYR  QD      5.50            #peak  1576 #SUP  1.00  #QF  0.69
 23 TYR  HA     23 TYR  QE      5.50            #peak  1579 #SUP  0.88  #QF  0.70
 23 TYR  QE     55 CYSS HA      5.50            #peak  1579 #SUP  0.88  #QF  0.70
 23 TYR  QE     55 CYSS HB3     5.50            #peak  1580 #SUP  0.84  #QF  0.29
 21 TYR  HB3    33 PHE  QE      5.46            #peak  1581 #SUP  0.57  #QF  0.57
 23 TYR  QE     54 THR  QG2     5.50            #peak  1583 #SUP  0.56  #QF  0.26
  1 ARG  QB      5 CYSS H       5.45            #peak  1587 #SUP  0.40  #QF  0.40
  3 ARG  QG      5 CYSS H       5.50            #peak  1588 #SUP  0.87  #QF  0.87
  3 ARG  HA      5 CYSS H       5.14            #peak  1594 #SUP  0.97  #QF  0.97
 22 TYR  QE     23 TYR  QD      5.38            #peak  1605 #SUP  0.92  #QF  0.53
 17 PHE  QE     19 PRO  HD3     5.50            #peak  1611 #SUP  0.72  #QF  0.59
 23 TYR  HA     23 TYR  QD      4.91            #peak  1612 #SUP  0.99  #QF  0.84
 17 PHE  QE     34 THR  HA      5.28            #peak  1613 #SUP  0.78  #QF  0.78
 23 TYR  QD     55 CYSS HB3     5.01            #peak  1616 #SUP  0.95  #QF  0.74
 23 TYR  QD     25 GLN  HA      5.50            #peak  1618 #SUP  1.00  #QF  0.49
  6 GLU  HA     23 TYR  QD      4.93            #peak  1619 #SUP  0.89  #QF  0.39
  6 GLU  HB3    23 TYR  QD      5.50            #peak  1620 #SUP  0.99  #QF  0.42
  4 PHE  H       6 GLU  QG      5.50            #peak  1620 #SUP  0.99  #QF  0.42
 17 PHE  QE     19 PRO  HG3     5.50            #peak  1624 #SUP  0.59  #QF  0.59
  4 PHE  H       7 LEU  QD1     5.10            #peak  1637 #SUP  0.94  #QF  0.94
 23 TYR  QD     56 VAL  QG2     5.31            #peak  1647 #SUP  0.96  #QF  0.85
 48 ILE  QD1    52 ASN  HD22    5.02            #peak  1648 #SUP  0.95  #QF  0.95
  2 PRO  HG3     4 PHE  QE      5.37            #peak  1660 #SUP  0.99  #QF  0.85
  7 LEU  H      43 ASN  HB3     5.50            #peak  1666 #SUP  0.91  #QF  0.89
  6 GLU  HB2     7 LEU  H       5.15            #peak  1672 #SUP  0.80  #QF  0.80
  4 PHE  QE      5 CYSS HB3     5.50            #peak  1674 #SUP  1.00  #QF  0.84
  4 PHE  QE      5 CYSS HB2     5.50            #peak  1681 #SUP  0.92  #QF  0.53
 21 TYR  QD     47 THR  H       5.41            #peak  1692 #SUP  0.93  #QF  0.93
 46 ARG  HE     50 GLU  H       5.50            #peak  1709 #SUP  0.23  #QF  0.23
 46 ARG  HE     47 THR  HA      4.10            #peak  1717 #SUP  0.58  #QF  0.58
  5 CYSS H       6 GLU  H       4.15            #peak  1722 #SUP  0.90  #QF  0.90
  6 GLU  H       7 LEU  H       3.02            #peak  1724 #SUP  0.78  #QF  0.55
 26 TYR  QD     27 SER  H       4.81            #peak  1744 #SUP  0.77  #QF  0.77
 27 SER  H      28 ASN  HA      5.50            #peak  1748 #SUP  0.80  #QF  0.80
 26 TYR  HB3    27 SER  H       5.19            #peak  1749 #SUP  0.82  #QF  0.82
 47 THR  H      50 GLU  H       4.46            #peak  1758 #SUP  0.83  #QF  0.83
 50 GLU  H      54 THR  QG2     5.50            #peak  1759 #SUP  0.85  #QF  0.85
  7 LEU  HB3    42 ALA  H       5.50            #peak  1795 #SUP  0.72  #QF  0.72
 55 CYSS H      56 VAL  HA      5.50            #peak  1802 #SUP  0.90  #QF  0.90
 46 ARG  HE     49 ASP  H       5.50            #peak  1834 #SUP  0.50  #QF  0.50
 14 CYSS QB     16 ALA  H       4.62            #peak  1837 #SUP  0.33  #QF  0.33
 16 ALA  H      17 PHE  HB2     5.50            #peak  1847 #SUP  0.40  #QF  0.40
 26 TYR  H      27 SER  HB3     5.50            #peak  1849 #SUP  0.35  #QF  0.35
 22 TYR  QE     43 ASN  HD21    5.50            #peak  1877 #SUP  0.95  #QF  0.80
 53 ARG  H      56 VAL  QG1     5.50            #peak  1886 #SUP  0.93  #QF  0.91
  7 LEU  HB2    43 ASN  H       5.15            #peak  1889 #SUP  0.95  #QF  0.55
 22 TYR  QD     24 ASN  H       5.47            #peak  1890 #SUP  0.99  #QF  0.90
 53 ARG  H      56 VAL  QG2     5.50            #peak  1897 #SUP  1.00  #QF  0.95
 49 ASP  QB     53 ARG  H       5.50            #peak  1904 #SUP  0.91  #QF  0.44
 49 ASP  HA     53 ARG  H       4.52            #peak  1911 #SUP  0.99  #QF  0.99
  1 ARG  HD3    57 GLY  H       5.42            #peak  1954 #SUP  0.26  #QF  0.26
 22 TYR  QD     43 ASN  HD22    5.47            #peak  1957 #SUP  0.95  #QF  0.95
 17 PHE  HA     35 TYR  H       5.50            #peak  1959 #SUP  0.95  #QF  0.80
 28 ASN  HA     57 GLY  H       5.03            #peak  1962 #SUP  0.66  #QF  0.66
 19 PRO  HA     35 TYR  H       3.91            #peak  1963 #SUP  0.92  #QF  0.92
  1 ARG  HD2    57 GLY  H       5.42            #peak  1968 #SUP  0.70  #QF  0.47
 56 VAL  QG2    57 GLY  H       4.77            #peak  1980 #SUP  1.00
 48 ILE  H      48 ILE  QD1     4.86            #peak  2019 #SUP  0.99  #QF  0.99
  7 LEU  HG      8 ALA  H       5.21            #peak  2069 #SUP  0.52  #QF  0.52
 24 ASN  HB2    25 GLN  H       4.76            #peak  2111 #SUP  0.74  #QF  0.74
  6 GLU  HA     25 GLN  H       4.97            #peak  2115 #SUP  0.93  #QF  0.93
 35 TYR  QE     40 GLY  H       5.50            #peak  2138 #SUP  0.94  #QF  0.33
 51 CYSS HB2    52 ASN  H       4.74            #peak  2145 #SUP  0.72  #QF  0.72
 49 ASP  QB     52 ASN  H       5.50            #peak  2151 #SUP  0.46  #QF  0.46
 18 VAL  H      19 PRO  HD3     5.21            #peak  2170 #SUP  0.75  #QF  0.75
 10 SER  HA     41 ASN  H       5.50            #peak  2185 #SUP  0.90  #QF  0.90
 32 SER  H      33 PHE  H       4.79            #peak  2190 #SUP  0.66  #QF  0.66
 30 CYSS H      31 HIS  H       4.90            #peak  2214 #SUP  0.93  #QF  0.93
 21 TYR  H      46 ARG  HA      5.50            #peak  2224 #SUP  0.35  #QF  0.35
 21 TYR  QD     31 HIS  H       5.50            #peak  2227 #SUP  1.00  #QF  0.99
 21 TYR  H      46 ARG  H       5.29            #peak  2230 #SUP  0.66  #QF  0.66
 21 TYR  H      21 TYR  QE      5.50            #peak  2233 #SUP  0.91  #QF  0.59
 22 TYR  HB2    23 TYR  H       5.03            #peak  2278 #SUP  0.93  #QF  0.93
 23 TYR  H      24 ASN  H       5.13            #peak  2281 #SUP  0.95  #QF  0.95
 47 THR  H      50 GLU  QB      4.08            #peak     3 #SUP  0.91  #QF  0.91
 45 PHE  H      47 THR  H       5.50            #peak     5 #SUP  0.89  #QF  0.89
 47 THR  H      51 CYSS HB3     5.50            #peak     9 #SUP  0.70  #QF  0.70
 46 ARG  HG2    47 THR  H       4.83            #peak    14 #SUP  0.92  #QF  0.92
 46 ARG  QB     47 THR  H       3.98            #peak    16 #SUP  0.94  #QF  0.94
 46 ARG  HG3    47 THR  H       4.83            #peak    17 #SUP  0.92  #QF  0.92
 47 THR  H      48 ILE  HA      5.50            #peak    18 #SUP  0.97  #QF  0.97
 47 THR  H      47 THR  QG2     4.05            #peak    19 #SUP  0.91  #QF  0.91
 45 PHE  HA     47 THR  H       4.57            #peak    21 #SUP  0.63  #QF  0.63
 21 TYR  HB3    47 THR  H       5.06            #peak    24 #SUP  0.87  #QF  0.87
 47 THR  H      50 GLU  QG      4.87            #peak    28 #SUP  0.88  #QF  0.88
 47 THR  H      49 ASP  H       5.50            #peak    34 #SUP  0.92  #QF  0.92
 25 GLN  H      29 THR  H       5.50            #peak    35 #SUP  0.93  #QF  0.93
 24 ASN  HB3    29 THR  H       4.81            #peak    40 #SUP  0.90  #QF  0.90
 29 THR  H      29 THR  QG2     4.24            #peak    41 #SUP  0.96  #QF  0.96
 25 GLN  HA     29 THR  H       5.11            #peak    48 #SUP  0.85  #QF  0.85
 24 ASN  HB2    29 THR  H       4.81            #peak    49 #SUP  0.96  #QF  0.96
 28 ASN  HB3    29 THR  H       4.94            #peak    53 #SUP  0.91  #QF  0.91
 28 ASN  HB2    29 THR  H       4.94            #peak    54 #SUP  0.82  #QF  0.82
 23 TYR  QD     29 THR  H       4.96            #peak    55 #SUP  0.61  #QF  0.61
 29 THR  H      30 CYSS HA      5.50            #peak    56 #SUP  0.46  #QF  0.46
 27 SER  HB2    29 THR  H       5.49            #peak    58 #SUP  0.75  #QF  0.75
 39 GLY  H      40 GLY  H       4.82            #peak    62 #SUP  0.91  #QF  0.91
 10 SER  HB2    12 GLY  H       5.50            #peak   702 #SUP  0.83  #QF  0.83
 12 GLY  H      40 GLY  H       5.50            #peak   721 #SUP  0.99  #QF  0.99
 11 ALA  QB     12 GLY  H       4.01            #peak    75 #SUP  1.00
 10 SER  HA     12 GLY  H       4.05            #peak    76 #SUP  0.98  #QF  0.98
 11 ALA  H      12 GLY  H       3.91            #peak    82 #SUP  0.87  #QF  0.87
 22 TYR  HB3    43 ASN  HD22    5.50            #peak    86 #SUP  0.57  #QF  0.57
 22 TYR  HB3    43 ASN  HD21    5.50            #peak   104 #SUP  0.76  #QF  0.76
 48 ILE  HG13   52 ASN  HD22    5.13            #peak   110 #SUP  0.99  #QF  0.99
 49 ASP  HA     52 ASN  HD22    4.83            #peak   113 #SUP  0.95  #QF  0.95
  7 LEU  H      43 ASN  HD21    5.50            #peak   114 #SUP  0.42  #QF  0.42
 22 TYR  QE     43 ASN  HD22    5.50            #peak   115 #SUP  0.51  #QF  0.51
 48 ILE  QG2    52 ASN  HD21    4.78            #peak   118 #SUP  1.00  #QF  0.99
 48 ILE  HG12   52 ASN  HD22    5.50            #peak   121 #SUP  1.00
 48 ILE  HG13   52 ASN  HD21    5.13            #peak   124 #SUP  1.00
 49 ASP  HA     52 ASN  HD21    4.83            #peak   126 #SUP  0.98  #QF  0.89
 27 SER  H      29 THR  QG2     5.50            #peak   165 #SUP  0.96  #QF  0.96
 25 GLN  HG2    27 SER  H       5.50            #peak   168 #SUP  0.83  #QF  0.83
 26 TYR  HB2    27 SER  H       4.15            #peak   170 #SUP  0.68  #QF  0.68
 27 SER  H      29 THR  H       4.43            #peak   171 #SUP  0.92  #QF  0.92
 27 SER  H      28 ASN  HB2     5.50            #peak   176 #SUP  0.90  #QF  0.90
 25 GLN  HA     27 SER  H       5.05            #peak   177 #SUP  0.97  #QF  0.97
 27 SER  H      28 ASN  HB3     5.50            #peak   183 #SUP  0.91  #QF  0.91
  4 PHE  HA      6 GLU  H       4.84            #peak   200 #SUP  0.98  #QF  0.98
  6 GLU  H       7 LEU  QD2     4.79            #peak   203 #SUP  0.98  #QF  0.98
  6 GLU  H       7 LEU  QD1     5.02            #peak   208 #SUP  0.99  #QF  0.99
  6 GLU  H       6 GLU  QG      4.14            #peak  2101 #SUP  0.88  #QF  0.88
  6 GLU  H       7 LEU  HB2     4.98            #peak   211 #SUP  0.95  #QF  0.95
  6 GLU  H       7 LEU  HG      4.21            #peak   212 #SUP  0.93  #QF  0.93
  3 ARG  HA      6 GLU  H       5.43            #peak  2131 #SUP  0.90  #QF  0.90
  3 ARG  QD      6 GLU  H       5.50            #peak   215 #SUP  0.95  #QF  0.49
  4 PHE  HB2     6 GLU  H       5.50            #peak   215 #SUP  0.95  #QF  0.49
  6 GLU  H      42 ALA  QB      5.50            #peak   219 #SUP  0.60  #QF  0.60
 22 TYR  QE     25 GLN  HE21    5.07            #peak   238 #SUP  0.71  #QF  0.71
  6 GLU  HA     25 GLN  HE22    5.00            #peak   239 #SUP  0.99  #QF  0.99
 25 GLN  HB2    25 GLN  HE22    5.50            #peak   240 #SUP  0.83  #QF  0.83
  6 GLU  HB3    25 GLN  HE22    5.18            #peak   241 #SUP  0.96  #QF  0.96
  6 GLU  HA     25 GLN  HE21    5.00            #peak   243 #SUP  0.92  #QF  0.92
 25 GLN  HB2    25 GLN  HE21    5.50            #peak   244 #SUP  0.96  #QF  0.96
 25 GLN  HB3    25 GLN  HE22    5.50            #peak   245 #SUP  0.82  #QF  0.82
  6 GLU  HB3    25 GLN  HE21    5.18            #peak   246 #SUP  0.99  #QF  0.93
 25 GLN  HB3    25 GLN  HE21    5.50            #peak   247 #SUP  0.93  #QF  0.93
  6 GLU  HB2    25 GLN  HE22    4.58            #peak   249 #SUP  0.88  #QF  0.88
 22 TYR  QE     25 GLN  HE22    5.07            #peak   250 #SUP  0.61  #QF  0.61
  6 GLU  HB2    25 GLN  HE21    4.58            #peak   255 #SUP  0.88  #QF  0.88
 28 ASN  HA     28 ASN  HD22    5.50            #peak   274 #SUP  0.99  #QF  0.99
 51 CYSS H      54 THR  H       5.33            #peak   280 #SUP  0.95  #QF  0.95
 28 ASN  HD22   56 VAL  HA      5.50            #peak   282 #SUP  0.98  #QF  0.96
 28 ASN  HD22   56 VAL  QG1     4.70            #peak   283 #SUP  0.99  #QF  0.99
 28 ASN  HD21   56 VAL  HA      5.50            #peak   285 #SUP  0.99  #QF  0.92
 28 ASN  HD21   56 VAL  HB      5.50            #peak   286 #SUP  0.96  #QF  0.96
 53 ARG  HG2    54 THR  H       4.83            #peak   287 #SUP  0.75  #QF  0.75
 28 ASN  HA     28 ASN  HD21    5.50            #peak   289 #SUP  0.99  #QF  0.99
 28 ASN  HD22   56 VAL  HB      5.50            #peak   295 #SUP  0.88  #QF  0.88
 10 SER  H      11 ALA  QB      5.50            #peak   301 #SUP  0.99  #QF  0.99
 53 ARG  QD     54 THR  H       5.50            #peak   303 #SUP  0.88  #QF  0.88
 52 ASN  QB     54 THR  H       5.05            #peak   308 #SUP  0.76  #QF  0.76
 10 SER  H      35 TYR  QD      5.46            #peak   310 #SUP  0.31  #QF  0.31
  8 ALA  H      10 SER  H       5.50            #peak   318 #SUP  0.64  #QF  0.64
 54 THR  H      55 CYSS HA      5.42            #peak   325 #SUP  0.93  #QF  0.93
 54 THR  H      54 THR  QG2     4.19            #peak   329 #SUP  0.97  #QF  0.97
 53 ARG  QB     54 THR  H       4.63            #peak  3311 #SUP  0.98  #QF  0.97
 53 ARG  HG3    54 THR  H       5.19            #peak  3311 #SUP  0.98  #QF  0.97
 51 CYSS HA     54 THR  H       5.17            #peak  3312 #SUP  0.93  #QF  0.77
  9 PRO  HD3    10 SER  H       5.50            #peak   333 #SUP  0.95  #QF  0.88
 52 ASN  HA     54 THR  H       5.10            #peak   334 #SUP  0.96  #QF  0.96
 54 THR  H      56 VAL  QG2     5.50            #peak   341 #SUP  0.82  #QF  0.82
 10 SER  H      11 ALA  HA      5.45            #peak   344 #SUP  0.93  #QF  0.93
 52 ASN  HA     55 CYSS H       4.87            #peak   359 #SUP  0.98  #QF  0.98
 55 CYSS H      56 VAL  HB      4.94            #peak   361 #SUP  1.00
 54 THR  QG2    55 CYSS H       4.06            #peak   362 #SUP  0.99  #QF  0.95
 23 TYR  QD     55 CYSS H       5.42            #peak   365 #SUP  0.78  #QF  0.78
 54 THR  H      55 CYSS H       3.53            #peak   366 #SUP  1.00  #QF  0.89
 54 THR  HB     55 CYSS H       4.31            #peak   367 #SUP  0.98  #QF  0.98
  1 ARG  QB     55 CYSS H       5.50            #peak   368 #SUP  0.69  #QF  0.43
 53 ARG  HG2    55 CYSS H       5.50            #peak   368 #SUP  0.69  #QF  0.43
 55 CYSS H      56 VAL  QG2     4.63            #peak   370 #SUP  0.99  #QF  0.99
 55 CYSS H      56 VAL  QG1     5.35            #peak   371 #SUP  0.97  #QF  0.97
  1 ARG  HA     55 CYSS H       5.21            #peak   372 #SUP  0.85  #QF  0.85
 53 ARG  H      55 CYSS H       5.15            #peak   374 #SUP  0.91  #QF  0.91
 51 CYSS HA     55 CYSS H       4.86            #peak   375 #SUP  0.91  #QF  0.87
 53 ARG  QB     55 CYSS H       5.48            #peak   375 #SUP  0.91  #QF  0.87
  4 PHE  H       5 CYSS HA      5.17            #peak   395 #SUP  0.96  #QF  0.96
  4 PHE  H      42 ALA  QB      5.31            #peak   398 #SUP  0.97  #QF  0.97
  4 PHE  H       7 LEU  QD2     5.05            #peak   401 #SUP  0.97  #QF  0.97
  2 PRO  HA      4 PHE  H       4.40            #peak   402 #SUP  0.93  #QF  0.93
  4 PHE  H       4 PHE  QD      4.11            #peak   403 #SUP  0.99  #QF  0.99
  4 PHE  H       6 GLU  H       4.50            #peak   404 #SUP  0.87  #QF  0.87
  3 ARG  QD      4 PHE  H       4.08            #peak   405 #SUP  0.98  #QF  0.57
  2 PRO  HD2     4 PHE  H       6.00            #peak   412 #SUP  0.97  #QF  0.97
  3 ARG  QG      4 PHE  H       4.32            #peak   419 #SUP  0.92  #QF  0.92
  2 PRO  HB2     4 PHE  H       4.25            #peak   422 #SUP  0.87  #QF  0.87
  4 PHE  H       4 PHE  HB3     3.91            #peak   426 #SUP  0.99  #QF  0.99
  2 PRO  HB3     4 PHE  H       4.25            #peak   429 #SUP  1.00  #QF  0.90
  3 ARG  QB      4 PHE  H       4.34            #peak   429 #SUP  1.00  #QF  0.90
  1 ARG  QB     57 GLY  H       5.50            #peak   432 #SUP  0.75  #QF  0.75
 28 ASN  HD22   57 GLY  H       4.68            #peak   433 #SUP  0.87  #QF  0.87
 55 CYSS HB3    57 GLY  H       5.50            #peak   434 #SUP  0.60  #QF  0.60
 28 ASN  HD21   57 GLY  H       4.68            #peak   435 #SUP  0.88  #QF  0.88
 56 VAL  H      57 GLY  H       4.39            #peak   437 #SUP  0.86  #QF  0.86
 56 VAL  QG1    57 GLY  H       3.76            #peak   438 #SUP  0.87  #QF  0.87
 56 VAL  HA     57 GLY  H       3.28            #peak   439 #SUP  0.99  #QF  0.85
 56 VAL  HB     57 GLY  H       4.54            #peak   441 #SUP  0.96  #QF  0.96
 55 CYSS HA     57 GLY  H       5.50            #peak   444 #SUP  0.92  #QF  0.92
  4 PHE  QD     42 ALA  H       5.50            #peak   451 #SUP  1.00  #QF  0.87
  4 PHE  HB2    42 ALA  H       4.89            #peak   452 #SUP  0.87  #QF  0.87
 41 ASN  HB2    42 ALA  H       3.75            #peak   453 #SUP  0.90  #QF  0.90
  7 LEU  QD1    42 ALA  H       4.14            #peak   456 #SUP  1.00
 42 ALA  H      42 ALA  QB      3.41            #peak   458 #SUP  0.91  #QF  0.91
 41 ASN  H      42 ALA  H       5.10            #peak   459 #SUP  0.82  #QF  0.82
 41 ASN  HB3    42 ALA  H       3.75            #peak   460 #SUP  0.95  #QF  0.95
  4 PHE  HA     42 ALA  H       5.50            #peak   463 #SUP  0.72  #QF  0.72
  1 ARG  QB      1 ARG  HE      4.84            #peak   477 #SUP  1.00
 46 ARG  HE     47 THR  H       3.21            #peak   496 #SUP  0.92  #QF  0.92
 46 ARG  QB     46 ARG  HE      5.07            #peak   503 #SUP  1.00
  3 ARG  QB      3 ARG  HE      5.21            #peak   508 #SUP  0.97  #QF  0.41
  1 ARG  HE     57 GLY  HA2     5.50            #peak   515 #SUP  0.80  #QF  0.80
 44 ARG  HB3    44 ARG  HE      5.50            #peak   540 #SUP  0.99  #QF  0.99
 44 ARG  HB2    44 ARG  HE      5.50            #peak   545 #SUP  0.83  #QF  0.83
 53 ARG  QB     53 ARG  HE      5.46            #peak   589 #SUP  0.99  #QF  0.87
 50 GLU  HA     53 ARG  HE      5.50            #peak   601 #SUP  0.59  #QF  0.59
 15 PHE  H      15 PHE  QD      4.91            #peak   630 #SUP  0.97  #QF  0.97
 15 PHE  H      16 ALA  QB      4.87            #peak   636 #SUP  0.88  #QF  0.88
 15 PHE  QE     17 PHE  H       5.50            #peak   658 #SUP  0.40  #QF  0.40
 17 PHE  H      17 PHE  QD      4.63            #peak   659 #SUP  0.92  #QF  0.92
 17 PHE  H      18 VAL  QG2     4.29            #peak   661 #SUP  0.97  #QF  0.97
 16 ALA  QB     17 PHE  H       3.38            #peak   662 #SUP  0.91  #QF  0.91
 16 ALA  HA     17 PHE  H       3.35            #peak   664 #SUP  0.93  #QF  0.93
 17 PHE  H      17 PHE  HB3     3.71            #peak   665 #SUP  0.85  #QF  0.85
 17 PHE  H      18 VAL  H       4.55            #peak   666 #SUP  0.95  #QF  0.95
 17 PHE  H      18 VAL  QG1     4.40            #peak   668 #SUP  0.97  #QF  0.97
 16 ALA  H      17 PHE  H       4.67            #peak   675 #SUP  0.57  #QF  0.57
 19 PRO  HA     34 THR  H       5.50            #peak   679 #SUP  1.00
 34 THR  H      34 THR  HB      3.75            #peak   683 #SUP  0.85  #QF  0.85
 34 THR  H      35 TYR  HB2     5.50            #peak   684 #SUP  0.80  #QF  0.80
 11 ALA  QB     34 THR  H       5.50            #peak   685 #SUP  0.36  #QF  0.36
 33 PHE  H      34 THR  H       4.85            #peak   691 #SUP  0.88  #QF  0.88
 33 PHE  HB3    34 THR  H       4.00            #peak   692 #SUP  0.92  #QF  0.92
 33 PHE  QE     34 THR  H       4.87            #peak   693 #SUP  1.00
 34 THR  H      34 THR  QG2     4.23            #peak   694 #SUP  0.99  #QF  0.99
 33 PHE  QD     34 THR  H       4.48            #peak   695 #SUP  1.00
 22 TYR  QD     34 THR  H       5.38            #peak   697 #SUP  0.62  #QF  0.62
 33 PHE  HB2    34 THR  H       3.92            #peak   699 #SUP  0.92  #QF  0.92
 22 TYR  HB2    34 THR  H       5.50            #peak   700 #SUP  0.31  #QF  0.31
 40 GLY  H      41 ASN  H       4.97            #peak   708 #SUP  0.77  #QF  0.77
 10 SER  HB3    41 ASN  H       5.29            #peak   710 #SUP  0.92  #QF  0.92
 10 SER  HB2    41 ASN  H       5.29            #peak   713 #SUP  0.72  #QF  0.72
 53 ARG  H      56 VAL  HB      5.23            #peak   715 #SUP  0.85  #QF  0.85
 53 ARG  H      53 ARG  QB      3.83            #peak  7181 #SUP  0.98  #QF  0.96
 52 ASN  H      53 ARG  H       3.97            #peak   719 #SUP  0.82  #QF  0.82
 53 ARG  H      53 ARG  HG2     3.66            #peak   720 #SUP  0.66  #QF  0.66
 53 ARG  H      54 THR  H       3.83            #peak   721 #SUP  0.93  #QF  0.93
 50 GLU  HA     53 ARG  H       4.03            #peak  7231 #SUP  0.83  #QF  0.83
 52 ASN  QB     53 ARG  H       3.74            #peak   724 #SUP  0.92  #QF  0.92
 51 CYSS H      53 ARG  H       4.92            #peak   732 #SUP  0.87  #QF  0.87
 50 GLU  H      53 ARG  H       5.07            #peak   734 #SUP  0.84  #QF  0.84
 50 GLU  QB     53 ARG  H       5.39            #peak   735 #SUP  0.84  #QF  0.84
 21 TYR  HA     32 SER  H       5.24            #peak   746 #SUP  0.94  #QF  0.94
 32 SER  H      48 ILE  HB      5.50            #peak   753 #SUP  0.89  #QF  0.29
 32 SER  H      48 ILE  QD1     5.50            #peak   753 #SUP  0.89  #QF  0.29
 21 TYR  QE     32 SER  H       4.86            #peak   755 #SUP  0.96  #QF  0.96
 31 HIS  HB2    32 SER  H       4.42            #peak   756 #SUP  0.92  #QF  0.92
 32 SER  H      32 SER  HB2     4.10            #peak   757 #SUP  0.94  #QF  0.94
 32 SER  H      32 SER  HB3     4.10            #peak   759 #SUP  0.98  #QF  0.98
 31 HIS  HA     32 SER  H       3.44            #peak   760 #SUP  0.95  #QF  0.95
 31 HIS  HB3    32 SER  H       4.44            #peak   761 #SUP  0.91  #QF  0.91
 31 HIS  H      32 SER  H       4.62            #peak   762 #SUP  0.99  #QF  0.99
 21 TYR  QD     32 SER  H       4.83            #peak   764 #SUP  0.99  #QF  0.99
 22 TYR  H      32 SER  H       5.46            #peak   765 #SUP  0.87  #QF  0.87
 32 SER  H      33 PHE  QD      6.00            #peak   769 #SUP  0.86  #QF  0.86
 41 ASN  HA     43 ASN  H       4.79            #peak   773 #SUP  0.98  #QF  0.98
 50 GLU  H      53 ARG  HG2     5.47            #peak   775 #SUP  0.89  #QF  0.89
 48 ILE  QG2    50 GLU  H       4.76            #peak   776 #SUP  0.76  #QF  0.76
 47 THR  HB     50 GLU  H       4.88            #peak   777 #SUP  0.99  #QF  0.99
 50 GLU  H      51 CYSS HB3     5.39            #peak   779 #SUP  0.84  #QF  0.84
 47 THR  HA     50 GLU  H       4.72            #peak   781 #SUP  0.92  #QF  0.92
 49 ASP  QB     50 GLU  H       3.85            #peak   783 #SUP  0.60  #QF  0.60
 50 GLU  H      50 GLU  QB      3.67            #peak   784 #SUP  0.99  #QF  0.99
 48 ILE  HA     50 GLU  H       5.25            #peak   787 #SUP  1.00
 50 GLU  H      50 GLU  QG      4.10            #peak   792 #SUP  0.95  #QF  0.95
  7 LEU  QD1    43 ASN  H       4.33            #peak   793 #SUP  0.95  #QF  0.95
 42 ALA  QB     43 ASN  H       4.14            #peak   795 #SUP  0.91  #QF  0.91
 43 ASN  H      43 ASN  HB2     4.01            #peak   796 #SUP  0.77  #QF  0.77
 41 ASN  HB2    43 ASN  H       4.47            #peak   797 #SUP  0.67  #QF  0.67
 43 ASN  H      44 ARG  H       4.33            #peak   798 #SUP  0.98  #QF  0.98
 43 ASN  H      43 ASN  HB3     4.01            #peak   800 #SUP  0.88  #QF  0.88
 50 GLU  H      53 ARG  QB      5.36            #peak  8031 #SUP  0.98  #QF  0.98
 50 GLU  H      51 CYSS HA      5.50            #peak  8032 #SUP  0.95  #QF  0.88
  7 LEU  HB3    43 ASN  H       4.70            #peak   804 #SUP  0.83  #QF  0.83
  4 PHE  HA     43 ASN  H       5.50            #peak   805 #SUP  0.49  #QF  0.49
 46 ARG  H      50 GLU  H       5.50            #peak   807 #SUP  0.53  #QF  0.53
  5 CYSS HA     43 ASN  H       5.50            #peak   810 #SUP  0.92  #QF  0.80
  7 LEU  HA     43 ASN  H       5.50            #peak   810 #SUP  0.92  #QF  0.80
 41 ASN  HB3    43 ASN  H       4.47            #peak   816 #SUP  0.62  #QF  0.62
 42 ALA  H      43 ASN  H       3.91            #peak   823 #SUP  0.88  #QF  0.88
 20 SER  H      21 TYR  H       5.22            #peak   843 #SUP  0.94  #QF  0.94
 21 TYR  H      33 PHE  QD      5.10            #peak   845 #SUP  0.92  #QF  0.92
 20 SER  HB3    21 TYR  H       4.30            #peak   849 #SUP  0.94  #QF  0.94
 21 TYR  H      44 ARG  HG2     5.50            #peak   851 #SUP  0.68  #QF  0.68
 20 SER  HB2    21 TYR  H       4.30            #peak   852 #SUP  0.59  #QF  0.59
 21 TYR  H      33 PHE  QE      4.91            #peak   853 #SUP  0.99  #QF  0.99
 21 TYR  H      44 ARG  HA      4.47            #peak   855 #SUP  0.67  #QF  0.67
 21 TYR  H      21 TYR  QD      4.58            #peak   863 #SUP  0.99  #QF  0.99
 21 TYR  H      44 ARG  HG3     5.50            #peak   869 #SUP  0.99  #QF  0.99
 30 CYSS H      48 ILE  HG12    5.23            #peak   886 #SUP  0.90  #QF  0.90
 30 CYSS H      31 HIS  HB2     5.31            #peak   890 #SUP  0.44  #QF  0.44
 29 THR  QG2    30 CYSS H       4.03            #peak   892 #SUP  0.87  #QF  0.87
 29 THR  HB     30 CYSS H       3.70            #peak   895 #SUP  0.77  #QF  0.77
 30 CYSS H      48 ILE  QD1     4.56            #peak   897 #SUP  0.89  #QF  0.22
 24 ASN  H      30 CYSS H       5.50            #peak   899 #SUP  0.91  #QF  0.91
 21 TYR  QD     30 CYSS H       5.50            #peak   905 #SUP  0.81  #QF  0.81
 30 CYSS H      48 ILE  HG13    4.47            #peak   907 #SUP  0.53  #QF  0.53
 29 THR  H      30 CYSS H       4.93            #peak   908 #SUP  0.87  #QF  0.87
  2 PRO  HD2     5 CYSS H       5.20            #peak   918 #SUP  0.98  #QF  0.98
  5 CYSS H       7 LEU  QD1     5.50            #peak  9222 #SUP  0.71  #QF  0.71
  3 ARG  H       5 CYSS H       5.50            #peak   926 #SUP  0.56  #QF  0.56
  4 PHE  HB3     5 CYSS H       5.33            #peak  9282 #SUP  0.96  #QF  0.96
  3 ARG  QD      5 CYSS H       5.50            #peak   930 #SUP  0.98  #QF  0.46
  2 PRO  HG2     5 CYSS H       4.67            #peak  9311 #SUP  0.96  #QF  0.88
  2 PRO  HB3     5 CYSS H       5.12            #peak  9312 #SUP  1.00  #QF  0.96
  5 CYSS H       7 LEU  HG      5.34            #peak  9312 #SUP  1.00  #QF  0.96
  2 PRO  HG3     5 CYSS H       5.22            #peak   932 #SUP  0.91  #QF  0.91
  5 CYSS H       6 GLU  HB3     4.65            #peak  9351 #SUP  0.69  #QF  0.69
  5 CYSS H       6 GLU  QG      4.65            #peak  9352 #SUP  0.61  #QF  0.61
  2 PRO  HB2     5 CYSS H       5.12            #peak  9361 #SUP  0.87  #QF  0.87
  5 CYSS H       7 LEU  QD2     5.33            #peak   937 #SUP  0.96  #QF  0.96
  2 PRO  HA      5 CYSS H       5.05            #peak   944 #SUP  0.84  #QF  0.84
  5 CYSS H      54 THR  QG2     5.50            #peak   945 #SUP  0.63  #QF  0.63
 21 TYR  QE     31 HIS  H       5.50            #peak   949 #SUP  0.77  #QF  0.77
 21 TYR  HA     31 HIS  H       4.80            #peak   953 #SUP  0.59  #QF  0.59
 31 HIS  H      48 ILE  HB      5.50            #peak   954 #SUP  0.99  #QF  0.63
 31 HIS  H      48 ILE  QD1     5.50            #peak   954 #SUP  0.99  #QF  0.63
 23 TYR  HA     31 HIS  H       4.48            #peak   955 #SUP  0.96  #QF  0.96
 21 TYR  HB3    31 HIS  H       4.80            #peak   957 #SUP  0.97  #QF  0.77
 30 CYSS HB2    31 HIS  H       4.68            #peak   958 #SUP  1.00
 30 CYSS HB3    31 HIS  H       4.68            #peak   959 #SUP  1.00
 24 ASN  H      31 HIS  H       4.92            #peak   961 #SUP  0.96  #QF  0.96
 31 HIS  H      48 ILE  HG13    5.46            #peak   970 #SUP  0.84  #QF  0.84
 31 HIS  H      33 PHE  HB3     5.50            #peak   971 #SUP  0.64  #QF  0.64
  7 LEU  H      41 ASN  HB3     5.50            #peak  9732 #SUP  0.98  #QF  0.98
  5 CYSS H       7 LEU  H       4.60            #peak   977 #SUP  0.99  #QF  0.99
  7 LEU  H      42 ALA  QB      5.22            #peak   979 #SUP  0.93  #QF  0.93
  7 LEU  H       7 LEU  HG      4.28            #peak  9811 #SUP  0.99  #QF  0.99
  7 LEU  H       7 LEU  HB3     4.15            #peak  9812 #SUP  0.98  #QF  0.98
  5 CYSS HA      7 LEU  H       4.50            #peak   983 #SUP  0.76  #QF  0.76
  6 GLU  QG      7 LEU  H       4.68            #peak   986 #SUP  1.00  #QF  0.93
  7 LEU  H       7 LEU  HB2     4.09            #peak   987 #SUP  0.90  #QF  0.90
  7 LEU  H       7 LEU  QD1     4.14            #peak   988 #SUP  0.99  #QF  0.99
  7 LEU  H      43 ASN  HD22    5.50            #peak   989 #SUP  0.87  #QF  0.87
  7 LEU  H      43 ASN  HB2     5.50            #peak  9901 #SUP  0.99  #QF  0.92
  7 LEU  H      41 ASN  HB2     5.50            #peak  9902 #SUP  1.00  #QF  0.96
  7 LEU  H       8 ALA  H       4.70            #peak   991 #SUP  0.89  #QF  0.89
  7 LEU  H      43 ASN  H       4.69            #peak   992 #SUP  0.91  #QF  0.91
 26 TYR  H      27 SER  HB2     5.42            #peak   993 #SUP  0.57  #QF  0.57
 26 TYR  H      26 TYR  HB3     3.63            #peak   994 #SUP  0.43  #QF  0.43
 25 GLN  H      26 TYR  H       4.16            #peak   998 #SUP  0.67  #QF  0.67
 26 TYR  H      26 TYR  QE      5.15            #peak   999 #SUP  0.68  #QF  0.68
 22 TYR  H      31 HIS  HA      5.27            #peak  1000 #SUP  0.98  #QF  0.98
 22 TYR  H      33 PHE  HB3     5.17            #peak  1005 #SUP  0.95  #QF  0.95
  4 PHE  HA      7 LEU  H       5.03            #peak  1008 #SUP  0.65  #QF  0.65
 26 TYR  H      26 TYR  QD      4.28            #peak  1009 #SUP  0.66  #QF  0.66
 26 TYR  H      27 SER  H       3.65            #peak  1013 #SUP  0.70  #QF  0.70
 25 GLN  HG2    26 TYR  H       4.23            #peak  1014 #SUP  0.82  #QF  0.62
 22 TYR  H      23 TYR  H       5.41            #peak  1017 #SUP  0.69  #QF  0.69
 22 TYR  H      30 CYSS HA      5.01            #peak  1018 #SUP  0.97  #QF  0.97
 22 TYR  H      32 SER  HB2     5.50            #peak  1019 #SUP  0.95  #QF  0.95
 22 TYR  H      22 TYR  QD      4.36            #peak  1021 #SUP  0.90  #QF  0.90
 21 TYR  HB2    22 TYR  H       4.57            #peak  1025 #SUP  0.99  #QF  0.99
 22 TYR  H      32 SER  HA      4.35            #peak  1026 #SUP  0.90  #QF  0.90
 22 TYR  H      31 HIS  H       4.15            #peak  1027 #SUP  1.00
 22 TYR  H      32 SER  HB3     5.50            #peak  1034 #SUP  0.87  #QF  0.87
 21 TYR  QD     22 TYR  H       4.55            #peak  1035 #SUP  0.99  #QF  0.99
 21 TYR  HB3    22 TYR  H       4.18            #peak  1036 #SUP  0.96  #QF  0.96
 22 TYR  H      31 HIS  HB3     4.98            #peak  1037 #SUP  0.86  #QF  0.86
 22 TYR  H      33 PHE  QD      4.43            #peak  1038 #SUP  0.97  #QF  0.97
 22 TYR  H      33 PHE  QE      4.98            #peak  1039 #SUP  0.90  #QF  0.90
 22 TYR  H      23 TYR  HA      5.45            #peak  1046 #SUP  0.91  #QF  0.91
 49 ASP  H      52 ASN  QB      5.32            #peak  1065 #SUP  0.96  #QF  0.96
 26 TYR  HB2    28 ASN  H       4.96            #peak  1067 #SUP  0.52  #QF  0.52
 48 ILE  HG12   49 ASP  H       5.50            #peak  1070 #SUP  1.00
 47 THR  QG2    49 ASP  H       4.34            #peak  1076 #SUP  0.98  #QF  0.98
 48 ILE  H      49 ASP  H       3.81            #peak  1079 #SUP  0.95  #QF  0.95
 48 ILE  QG2    49 ASP  H       3.46            #peak  1081 #SUP  0.96  #QF  0.96
 49 ASP  H      49 ASP  QB      3.41            #peak  1082 #SUP  0.87  #QF  0.87
 47 THR  HB     49 ASP  H       4.57            #peak  1083 #SUP  0.99  #QF  0.99
 49 ASP  H      50 GLU  H       3.99            #peak  1085 #SUP  0.98  #QF  0.98
 49 ASP  H      52 ASN  H       5.32            #peak  1089 #SUP  0.88  #QF  0.88
 48 ILE  HG13   49 ASP  H       5.27            #peak  1091 #SUP  0.97  #QF  0.97
 49 ASP  H      51 CYSS H       4.94            #peak  1092 #SUP  0.97  #QF  0.97
 56 VAL  H      56 VAL  QG1     3.94            #peak  1100 #SUP  0.92  #QF  0.92
  2 PRO  HD2    56 VAL  H       5.50            #peak  1102 #SUP  0.87  #QF  0.81
 52 ASN  H      56 VAL  H       5.49            #peak  1104 #SUP  0.94  #QF  0.94
 53 ARG  H      56 VAL  H       5.50            #peak  1106 #SUP  0.90  #QF  0.90
 51 CYSS HA     56 VAL  H       5.50            #peak  1109 #SUP  0.80  #QF  0.80
 55 CYSS HB3    56 VAL  H       4.55            #peak  1111 #SUP  0.96  #QF  0.96
 55 CYSS HB2    56 VAL  H       4.54            #peak  1112 #SUP  0.97  #QF  0.85
 52 ASN  QB     56 VAL  H       5.05            #peak  1113 #SUP  0.87  #QF  0.87
 56 VAL  H      56 VAL  QG2     3.68            #peak  1114 #SUP  0.84  #QF  0.84
 55 CYSS H      56 VAL  H       3.69            #peak  1115 #SUP  0.90  #QF  0.90
 52 ASN  HA     56 VAL  H       4.04            #peak  1117 #SUP  0.90  #QF  0.90
 56 VAL  H      56 VAL  HB      3.70            #peak  1118 #SUP  0.95  #QF  0.95
 25 GLN  H      28 ASN  H       5.27            #peak  1130 #SUP  1.00
 26 TYR  H      28 ASN  H       4.27            #peak  1133 #SUP  0.93  #QF  0.93
 28 ASN  H      29 THR  QG2     5.06            #peak  1138 #SUP  0.98  #QF  0.98
 27 SER  H      28 ASN  H       3.54            #peak  1142 #SUP  0.96  #QF  0.96
 25 GLN  HB2    28 ASN  H       5.50            #peak  1145 #SUP  0.95  #QF  0.95
 28 ASN  H      29 THR  H       3.69            #peak  1148 #SUP  0.92  #QF  0.92
 25 GLN  HB3    28 ASN  H       5.50            #peak  1150 #SUP  0.88  #QF  0.88
 26 TYR  HA     28 ASN  H       4.57            #peak  1151 #SUP  0.73  #QF  0.73
 28 ASN  H      56 VAL  QG1     5.45            #peak  1154 #SUP  0.72  #QF  0.72
 25 GLN  HA     28 ASN  H       4.38            #peak  1155 #SUP  0.90  #QF  0.90
 27 SER  HB2    28 ASN  H       4.75            #peak  1159 #SUP  0.75  #QF  0.75
 52 ASN  H      54 THR  QG2     5.50            #peak  1166 #SUP  1.00  #QF  0.99
 28 ASN  H      29 THR  HA      5.45            #peak  1168 #SUP  0.56  #QF  0.56
 52 ASN  H      52 ASN  HD21    4.86            #peak  1172 #SUP  0.96  #QF  0.96
 52 ASN  H      56 VAL  HB      5.00            #peak  1173 #SUP  0.94  #QF  0.94
 52 ASN  H      52 ASN  HD22    4.86            #peak  1174 #SUP  0.78  #QF  0.78
 48 ILE  HG12   52 ASN  H       5.19            #peak  1175 #SUP  0.99  #QF  0.99
 51 CYSS HB3    52 ASN  H       4.07            #peak  1177 #SUP  0.96  #QF  0.96
 48 ILE  QD1    52 ASN  H       5.50            #peak  1178 #SUP  1.00  #QF  0.99
 51 CYSS H      52 ASN  H       3.85            #peak  1179 #SUP  0.99  #QF  0.99
 52 ASN  H      53 ARG  QB      4.86            #peak 11811 #SUP  1.00
 52 ASN  H      52 ASN  QB      3.52            #peak  1182 #SUP  0.89  #QF  0.89
 20 SER  H      33 PHE  QD      5.27            #peak  1183 #SUP  0.97  #QF  0.97
 50 GLU  HA     52 ASN  H       5.50            #peak 11841 #SUP  1.00
 52 ASN  H      53 ARG  HA      5.18            #peak 11842 #SUP  0.90  #QF  0.90
 50 GLU  QB     52 ASN  H       4.73            #peak  1185 #SUP  0.94  #QF  0.94
 48 ILE  HG13   52 ASN  H       4.61            #peak  1186 #SUP  1.00  #QF  0.99
 52 ASN  H      54 THR  H       4.75            #peak  1188 #SUP  0.99  #QF  0.98
 50 GLU  H      52 ASN  H       4.77            #peak  1190 #SUP  0.99  #QF  0.99
 52 ASN  H      55 CYSS H       5.50            #peak  1191 #SUP  0.91  #QF  0.91
 48 ILE  HA     51 CYSS H       4.33            #peak  1198 #SUP  0.81  #QF  0.81
 20 SER  H      35 TYR  QD      5.50            #peak  1203 #SUP  0.86  #QF  0.86
 20 SER  H      35 TYR  HA      5.00            #peak  1204 #SUP  0.99  #QF  0.99
 52 ASN  H      53 ARG  HG2     5.24            #peak  1205 #SUP  0.95  #QF  0.95
 48 ILE  H      51 CYSS H       5.50            #peak  1209 #SUP  0.85  #QF  0.85
 20 SER  H      34 THR  HB      5.50            #peak 12102 #SUP  0.98  #QF  0.40
 47 THR  QG2    51 CYSS H       5.50            #peak 12132 #SUP  0.78  #QF  0.78
 47 THR  HA     51 CYSS H       5.34            #peak  1215 #SUP  0.88  #QF  0.88
 20 SER  H      34 THR  QG2     4.84            #peak  1217 #SUP  0.97  #QF  0.97
 19 PRO  HD2    20 SER  H       5.50            #peak 12202 #SUP  1.00  #QF  0.98
 19 PRO  HD3    20 SER  H       5.50            #peak 12202 #SUP  1.00  #QF  0.98
 20 SER  H      34 THR  HA      4.86            #peak 12242 #SUP  0.99  #QF  0.99
 49 ASP  HA     51 CYSS H       5.50            #peak 12251 #SUP  0.92  #QF  0.92
 51 CYSS H      52 ASN  HA      5.50            #peak 12252 #SUP  0.91  #QF  0.91
 50 GLU  QG     51 CYSS H       4.22            #peak  1226 #SUP  0.84  #QF  0.84
 19 PRO  HB2    20 SER  H       4.47            #peak  1229 #SUP  0.76  #QF  0.76
 19 PRO  HA     20 SER  H       3.31            #peak  1230 #SUP  0.96  #QF  0.96
 50 GLU  QB     51 CYSS H       3.99            #peak  1235 #SUP  0.87  #QF  0.87
 49 ASP  QB     51 CYSS H       4.98            #peak 12361 #SUP  0.84  #QF  0.84
 19 PRO  HB3    20 SER  H       4.47            #peak  1237 #SUP  0.98  #QF  0.98
 50 GLU  H      51 CYSS H       3.93            #peak  1239 #SUP  0.90  #QF  0.90
 48 ILE  QG2    51 CYSS H       5.23            #peak 12421 #SUP  0.82  #QF  0.82
 48 ILE  HB     51 CYSS H       5.50            #peak 12422 #SUP  0.95  #QF  0.71
 47 THR  H      51 CYSS H       4.79            #peak  1246 #SUP  0.72  #QF  0.72
 20 SER  H      35 TYR  HB2     5.46            #peak  1247 #SUP  0.99  #QF  0.99
 48 ILE  HG13   51 CYSS H       5.50            #peak 12502 #SUP  0.79  #QF  0.79
 51 CYSS H      53 ARG  HG2     5.50            #peak  1251 #SUP  0.28  #QF  0.28
 48 ILE  HG12   51 CYSS H       5.50            #peak  1252 #SUP  0.87  #QF  0.87
 33 PHE  H      34 THR  QG2     5.50            #peak  1270 #SUP  0.91  #QF  0.91
 33 PHE  H      33 PHE  QE      4.60            #peak  1275 #SUP  0.95  #QF  0.95
 42 ALA  QB     44 ARG  H       4.78            #peak  1276 #SUP  0.82  #QF  0.82
 43 ASN  HB2    44 ARG  H       4.74            #peak  1283 #SUP  0.94  #QF  0.94
  7 LEU  HB2    44 ARG  H       5.25            #peak  1286 #SUP  0.57  #QF  0.57
 22 TYR  H      33 PHE  H       4.80            #peak  1293 #SUP  0.94  #QF  0.94
 19 PRO  HA     33 PHE  H       5.05            #peak  1295 #SUP  0.98  #QF  0.98
 32 SER  HB2    33 PHE  H       4.64            #peak  1296 #SUP  0.98  #QF  0.98
 32 SER  HB3    33 PHE  H       4.64            #peak  1297 #SUP  0.96  #QF  0.96
 42 ALA  HA     44 ARG  H       4.70            #peak  1299 #SUP  0.86  #QF  0.86
 21 TYR  HB2    33 PHE  H       5.50            #peak  1300 #SUP  0.79  #QF  0.79
 35 TYR  QD     44 ARG  H       5.50            #peak  1302 #SUP  0.56  #QF  0.56
 32 SER  HA     33 PHE  H       3.42            #peak  1305 #SUP  0.91  #QF  0.91
 33 PHE  H      34 THR  HA      5.50            #peak  1306 #SUP  0.91  #QF  0.91
 42 ALA  H      44 ARG  H       5.30            #peak  1310 #SUP  0.90  #QF  0.90
 21 TYR  HA     33 PHE  H       4.23            #peak  1311 #SUP  0.91  #QF  0.91
 21 TYR  H      33 PHE  H       4.74            #peak  1316 #SUP  0.98  #QF  0.98
 33 PHE  H      33 PHE  QD      4.16            #peak  1317 #SUP  0.99  #QF  0.99
 21 TYR  QD     33 PHE  H       4.91            #peak  1318 #SUP  0.99  #QF  0.99
 41 ASN  HA     44 ARG  H       5.50            #peak  1320 #SUP  0.63  #QF  0.63
 21 TYR  HB3    33 PHE  H       5.50            #peak  1321 #SUP  0.98  #QF  0.98
 22 TYR  QD     33 PHE  H       5.50            #peak  1322 #SUP  0.64  #QF  0.64
 35 TYR  QE     44 ARG  H       4.88            #peak  1323 #SUP  0.61  #QF  0.61
 43 ASN  HB3    44 ARG  H       4.74            #peak  1325 #SUP  0.56  #QF  0.56
 20 SER  H      33 PHE  H       4.05            #peak  1326 #SUP  0.74  #QF  0.74
 46 ARG  H      51 CYSS H       5.50            #peak  1336 #SUP  0.65  #QF  0.65
 45 PHE  H      46 ARG  H       5.02            #peak  1348 #SUP  0.99  #QF  0.99
 46 ARG  H      46 ARG  HG2     4.25            #peak  1351 #SUP  0.89  #QF  0.89
 46 ARG  H      46 ARG  QB      3.52            #peak  1352 #SUP  0.99  #QF  0.99
 46 ARG  H      46 ARG  HG3     4.25            #peak  1354 #SUP  0.99  #QF  0.99
 46 ARG  H      47 THR  H       3.81            #peak  1355 #SUP  0.99  #QF  0.99
 46 ARG  H      47 THR  QG2     4.76            #peak  1357 #SUP  0.98  #QF  0.98
 46 ARG  H      47 THR  HA      4.75            #peak  1361 #SUP  0.97  #QF  0.97
 21 TYR  HB3    46 ARG  H       5.50            #peak  1362 #SUP  0.98  #QF  0.98
 46 ARG  H      50 GLU  QB      4.72            #peak  1364 #SUP  0.95  #QF  0.95
 46 ARG  H      50 GLU  QG      5.28            #peak  1365 #SUP  0.98  #QF  0.98
  1 ARG  H       1 ARG  HD3     5.08            #peak  1386 #SUP  0.99  #QF  0.99
  1 ARG  H       1 ARG  QB      3.48            #peak  1390 #SUP  0.99  #QF  0.99
  1 ARG  H       1 ARG  QG      3.74            #peak  1392 #SUP  0.98  #QF  0.98
  1 ARG  H       2 PRO  HD3     4.76            #peak  1393 #SUP  0.99  #QF  0.99
  1 ARG  H       1 ARG  HD2     5.08            #peak  1396 #SUP  0.99  #QF  0.99
  2 PRO  HD3     3 ARG  H       5.50            #peak  1483 #SUP  0.99  #QF  0.99
  3 ARG  H       6 GLU  H       5.50            #peak  1484 #SUP  1.00
  2 PRO  HA      3 ARG  H       3.36            #peak  1487 #SUP  0.98  #QF  0.98
  3 ARG  H       4 PHE  QD      5.50            #peak  1488 #SUP  1.00
  3 ARG  H       3 ARG  QB      3.24            #peak  1489 #SUP  1.00  #QF  0.89
  3 ARG  H       3 ARG  QD      4.52            #peak  1491 #SUP  0.99  #QF  0.99
  3 ARG  H       4 PHE  H       3.89            #peak  1492 #SUP  1.00
  3 ARG  H       3 ARG  QG      3.70            #peak  1493 #SUP  0.95  #QF  0.95
  3 ARG  H       4 PHE  HA      5.46            #peak  1497 #SUP  0.98  #QF  0.98
  3 ARG  H       4 PHE  HB3     5.50            #peak  1498 #SUP  0.92  #QF  0.92
 25 GLN  H      28 ASN  HA      5.32            #peak  1512 #SUP  0.95  #QF  0.95
 17 PHE  HB2    18 VAL  H       4.82            #peak  1518 #SUP  0.56  #QF  0.56
 25 GLN  H      25 GLN  HE22    5.00            #peak  1519 #SUP  1.00  #QF  0.92
 23 TYR  HA     25 GLN  H       5.50            #peak  1521 #SUP  0.54  #QF  0.54
 25 GLN  H      25 GLN  HB2     4.05            #peak  1523 #SUP  0.98  #QF  0.98
 25 GLN  H      25 GLN  HG2     4.18            #peak  1524 #SUP  1.00  #QF  0.97
 25 GLN  H      25 GLN  HB3     4.05            #peak  1526 #SUP  0.96  #QF  0.96
 25 GLN  H      25 GLN  HE21    5.00            #peak  1527 #SUP  0.99  #QF  0.99
 24 ASN  H      25 GLN  H       4.84            #peak  1531 #SUP  0.98  #QF  0.82
 24 ASN  HB3    25 GLN  H       4.76            #peak  1534 #SUP  0.80  #QF  0.80
 25 GLN  H      27 SER  H       5.00            #peak  1535 #SUP  0.97  #QF  0.97
 22 TYR  QE     25 GLN  H       5.50            #peak  1536 #SUP  0.96  #QF  0.96
 18 VAL  H      34 THR  HA      4.90            #peak  1537 #SUP  0.79  #QF  0.79
 18 VAL  H      34 THR  HB      5.43            #peak  1543 #SUP  0.98  #QF  0.98
 25 GLN  H      26 TYR  HB2     5.06            #peak  1544 #SUP  0.92  #QF  0.92
 16 ALA  QB     18 VAL  H       5.17            #peak  1546 #SUP  0.99  #QF  0.99
 18 VAL  H      35 TYR  HB2     5.50            #peak  1549 #SUP  0.89  #QF  0.89
 18 VAL  H      35 TYR  H       4.63            #peak  1550 #SUP  0.97  #QF  0.97
 18 VAL  H      18 VAL  QG2     3.82            #peak  1551 #SUP  0.99  #QF  0.99
 18 VAL  H      18 VAL  QG1     3.68            #peak  1554 #SUP  0.99  #QF  0.99
 17 PHE  QD     18 VAL  H       5.25            #peak  1555 #SUP  0.99  #QF  0.99
 17 PHE  HB3    18 VAL  H       4.91            #peak  1558 #SUP  0.91  #QF  0.80
 18 VAL  H      35 TYR  HB3     5.24            #peak  1558 #SUP  0.91  #QF  0.80
 18 VAL  H      19 PRO  HD2     5.33            #peak  1561 #SUP  0.99  #QF  0.97
 23 TYR  H      33 PHE  QD      5.50            #peak  1587 #SUP  0.96  #QF  0.96
 22 TYR  QD     23 TYR  H       4.85            #peak  1593 #SUP  0.84  #QF  0.84
 47 THR  H      48 ILE  H       5.00            #peak  1595 #SUP  1.00
  5 CYSS HA     23 TYR  H       6.00            #peak  1596 #SUP  0.29  #QF  0.29
 48 ILE  H      48 ILE  HG13    5.31            #peak  1598 #SUP  0.89  #QF  0.89
 23 TYR  H      23 TYR  HB3     4.18            #peak  1601 #SUP  0.98  #QF  0.98
 23 TYR  H      23 TYR  QD      5.39            #peak  1602 #SUP  0.88  #QF  0.88
 23 TYR  H      23 TYR  HB2     4.18            #peak  1604 #SUP  0.93  #QF  0.93
 23 TYR  H      43 ASN  HD21    4.69            #peak  1606 #SUP  0.87  #QF  0.87
 48 ILE  H      50 GLU  H       5.23            #peak  1607 #SUP  0.99  #QF  0.99
 23 TYR  H      43 ASN  HD22    4.69            #peak  1608 #SUP  0.88  #QF  0.88
 22 TYR  HB3    23 TYR  H       4.35            #peak  1609 #SUP  0.78  #QF  0.78
 23 TYR  H      31 HIS  H       5.50            #peak  1612 #SUP  0.85  #QF  0.85
 21 TYR  QE     48 ILE  H       4.60            #peak  1615 #SUP  0.99  #QF  0.99
  9 PRO  HD3    23 TYR  H       5.50            #peak  1618 #SUP  0.77  #QF  0.77
 48 ILE  H      51 CYSS HB3     5.30            #peak  1619 #SUP  0.77  #QF  0.77
 21 TYR  QD     48 ILE  H       5.05            #peak  1623 #SUP  0.99  #QF  0.99
 47 THR  QG2    48 ILE  H       4.23            #peak  1629 #SUP  0.64  #QF  0.64
 23 TYR  H      30 CYSS HA      5.50            #peak  1633 #SUP  0.95  #QF  0.95
 48 ILE  H      48 ILE  HG12    4.92            #peak  1634 #SUP  0.97  #QF  0.97
 47 THR  HB     48 ILE  H       4.21            #peak  1635 #SUP  0.97  #QF  0.97
 23 TYR  H      43 ASN  HA      5.29            #peak  1638 #SUP  0.70  #QF  0.70
 21 TYR  HB3    48 ILE  H       5.30            #peak  1641 #SUP  1.00  #QF  0.95
 48 ILE  H      49 ASP  QB      5.50            #peak  1641 #SUP  1.00  #QF  0.95
 48 ILE  H      48 ILE  QG2     3.41            #peak  1650 #SUP  0.86  #QF  0.69
 22 TYR  QE     23 TYR  H       5.50            #peak  1656 #SUP  0.72  #QF  0.72
 22 TYR  HA     45 PHE  H       5.50            #peak  1661 #SUP  0.49  #QF  0.49
 44 ARG  HG3    45 PHE  H       4.92            #peak  1664 #SUP  0.96  #QF  0.96
 20 SER  HB2    45 PHE  H       5.22            #peak  1665 #SUP  0.79  #QF  0.79
 21 TYR  QD     45 PHE  H       5.50            #peak  1666 #SUP  0.95  #QF  0.93
 44 ARG  HE     45 PHE  H       5.50            #peak  1666 #SUP  0.95  #QF  0.93
 44 ARG  HG2    45 PHE  H       4.92            #peak  1667 #SUP  0.83  #QF  0.83
 21 TYR  H      45 PHE  H       4.33            #peak  1668 #SUP  0.88  #QF  0.70
 20 SER  HB3    45 PHE  H       5.22            #peak  1670 #SUP  0.92  #QF  0.92
 21 TYR  HB3    45 PHE  H       4.58            #peak  1671 #SUP  0.98  #QF  0.98
 44 ARG  H      45 PHE  H       4.69            #peak  1673 #SUP  0.95  #QF  0.95
 44 ARG  HD2    45 PHE  H       5.40            #peak  1674 #SUP  0.94  #QF  0.94
 44 ARG  HB3    45 PHE  H       5.24            #peak  1679 #SUP  0.98  #QF  0.98
 33 PHE  QE     45 PHE  H       4.52            #peak  1680 #SUP  0.90  #QF  0.90
 44 ARG  HB2    45 PHE  H       5.24            #peak  1686 #SUP  0.64  #QF  0.64
 21 TYR  HB2    45 PHE  H       5.37            #peak  1687 #SUP  0.93  #QF  0.93
 44 ARG  HD3    45 PHE  H       5.40            #peak  1688 #SUP  0.59  #QF  0.59
  8 ALA  H       9 PRO  HD3     4.99            #peak  1704 #SUP  0.99  #QF  0.99
  7 LEU  QD1     8 ALA  H       4.66            #peak  1709 #SUP  0.95  #QF  0.95
  8 ALA  H       8 ALA  QB      3.37            #peak  1710 #SUP  0.99  #QF  0.99
  7 LEU  QD2     8 ALA  H       4.15            #peak 17111 #SUP  0.83  #QF  0.83
  8 ALA  H       9 PRO  HD2     5.39            #peak  1712 #SUP  0.91  #QF  0.91
  7 LEU  HB2     8 ALA  H       4.74            #peak 17132 #SUP  0.81  #QF  0.81
  7 LEU  HB3     8 ALA  H       4.23            #peak  1714 #SUP  0.84  #QF  0.84
  8 ALA  H      43 ASN  H       5.19            #peak  1716 #SUP  0.88  #QF  0.88
 15 PHE  QE     16 ALA  H       5.49            #peak  1740 #SUP  0.93  #QF  0.93
 15 PHE  H      16 ALA  H       4.35            #peak  1742 #SUP  0.98  #QF  0.98
 16 ALA  H      16 ALA  QB      3.79            #peak  1743 #SUP  0.97  #QF  0.97
 15 PHE  QD     16 ALA  H       5.50            #peak  1756 #SUP  0.96  #QF  0.96
 24 ASN  H      29 THR  QG2     5.50            #peak  1759 #SUP  0.84  #QF  0.84
 24 ASN  H      24 ASN  HB2     4.18            #peak  1765 #SUP  0.98  #QF  0.98
 24 ASN  H      28 ASN  HA      5.50            #peak  1768 #SUP  0.72  #QF  0.72
 22 TYR  QE     24 ASN  H       5.50            #peak  1771 #SUP  0.96  #QF  0.96
 24 ASN  H      27 SER  HB3     5.50            #peak  1773 #SUP  0.88  #QF  0.77
 23 TYR  QD     24 ASN  H       4.93            #peak  1774 #SUP  0.93  #QF  0.93
 24 ASN  H      29 THR  H       4.55            #peak  1776 #SUP  1.00
 23 TYR  HB3    24 ASN  H       5.00            #peak  1778 #SUP  1.00
 24 ASN  H      25 GLN  HA      5.50            #peak  1779 #SUP  0.90  #QF  0.90
 24 ASN  H      24 ASN  HB3     4.18            #peak  1785 #SUP  0.79  #QF  0.79
 24 ASN  H      30 CYSS HA      4.36            #peak  1787 #SUP  0.70  #QF  0.70
 23 TYR  HB2    24 ASN  H       5.00            #peak  1790 #SUP  0.95  #QF  0.95
 24 ASN  H      30 CYSS HB3     5.50            #peak  1792 #SUP  0.42  #QF  0.42
 24 ASN  H      31 HIS  HB2     5.50            #peak  1794 #SUP  0.48  #QF  0.48
 24 ASN  H      30 CYSS HB2     5.50            #peak  1795 #SUP  0.92  #QF  0.92
 35 TYR  H      35 TYR  QD      5.50            #peak  1801 #SUP  1.00  #QF  0.99
 19 PRO  HD3    35 TYR  H       5.26            #peak  1804 #SUP  0.93  #QF  0.93
 35 TYR  H      35 TYR  HB2     4.19            #peak  1805 #SUP  0.99  #QF  0.99
 35 TYR  H      35 TYR  HB3     4.20            #peak  1810 #SUP  0.96  #QF  0.96
 34 THR  QG2    35 TYR  H       3.88            #peak  1812 #SUP  0.96  #QF  0.96
 20 SER  HA     35 TYR  H       5.50            #peak  1814 #SUP  0.98  #QF  0.98
 18 VAL  HB     35 TYR  H       4.99            #peak  1815 #SUP  1.00
 20 SER  H      35 TYR  H       4.59            #peak  1817 #SUP  1.00
 34 THR  HB     35 TYR  H       4.46            #peak  1823 #SUP  0.94  #QF  0.94
 34 THR  H      35 TYR  H       4.73            #peak  1824 #SUP  0.71  #QF  0.71
 11 ALA  QB     35 TYR  H       5.50            #peak  1827 #SUP  0.88  #QF  0.88
 17 PHE  QD     35 TYR  H       5.50            #peak  1828 #SUP  0.60  #QF  0.60
 18 VAL  QG2    35 TYR  H       4.65            #peak  1829 #SUP  0.96  #QF  0.96
 17 PHE  QE     35 TYR  H       5.50            #peak  1831 #SUP  0.63  #QF  0.63
 10 SER  HA     11 ALA  H       3.35            #peak  1833 #SUP  0.97  #QF  0.97
  9 PRO  HA     11 ALA  H       5.48            #peak  1834 #SUP  0.80  #QF  0.80
 11 ALA  H      35 TYR  QD      5.50            #peak  1836 #SUP  0.97  #QF  0.92
 10 SER  H      11 ALA  H       5.09            #peak  1844 #SUP  0.97  #QF  0.97
 11 ALA  H      11 ALA  QB      3.58            #peak  1847 #SUP  0.99  #QF  0.99
 11 ALA  H      12 GLY  QA      5.24            #peak  1848 #SUP  0.92  #QF  0.92
 48 ILE  HA     52 ASN  H       4.49            #peak  1852 #SUP  0.86  #QF  0.86
 51 CYSS H      54 THR  QG2     5.50            #peak  1853 #SUP  0.62  #QF  0.62
  2 PRO  HG3     4 PHE  H       4.99            #peak  1854 #SUP  0.94  #QF  0.94
 10 SER  HB3    12 GLY  H       5.50            #peak  1855 #SUP  0.98  #QF  0.98
 45 PHE  HB3    50 GLU  QB      5.38            #peak   915 #SUP  0.31  #QF  0.31
 45 PHE  HB3    51 CYSS HB2     5.42            #peak   919 #SUP  0.89  #QF  0.78
 45 PHE  HB3    47 THR  H       4.40            #peak    12 #SUP  0.77  #QF  0.77
 45 PHE  HB2    47 THR  H       5.19            #peak    24 #SUP  0.91  #QF  0.33
 45 PHE  HB3    50 GLU  H       5.50            #peak  7852 #SUP  0.87  #QF  0.87
 45 PHE  HB3    51 CYSS H       4.75            #peak  1228 #SUP  0.57  #QF  0.57
 45 PHE  HB2    51 CYSS H       5.01            #peak 12361 #SUP  0.76  #QF  0.76
 45 PHE  HB3    46 ARG  H       4.19            #peak  1350 #SUP  0.80  #QF  0.80
 45 PHE  HB2    46 ARG  H       4.59            #peak  1362 #SUP  0.99  #QF  0.29
 33 PHE  HZ     44 ARG  HE      5.50            #peak  1379 #SUP  0.98  #QF  0.96
 33 PHE  HZ     35 TYR  HB2     5.50            #peak  1465 #SUP  0.95  #QF  0.91
 21 TYR  H      33 PHE  HZ      5.19            #peak   872 #SUP  0.94  #QF  0.94
 20 SER  H      33 PHE  HZ      5.50            #peak  1240 #SUP  0.90  #QF  0.90
 31 HIS  HD2    48 ILE  QD1     5.50            #peak    67 #SUP  0.81  #QF  0.42
 21 TYR  QE     31 HIS  HD2     4.68            #peak  1421 #SUP  0.76  #QF  0.76
 21 TYR  QD     31 HIS  HD2     5.48            #peak  1471 #SUP  0.44  #QF  0.44
 31 HIS  HD2    32 SER  H       5.17            #peak   766 #SUP  0.93  #QF  0.52
 30 CYSS H      31 HIS  HD2     5.50            #peak   910 #SUP  0.63  #QF  0.63
 31 HIS  H      31 HIS  HD2     4.97            #peak   948 #SUP  0.81  #QF  0.81
  1 ARG  H       1 ARG  QD      4.47            #peak  1396
  1 ARG  H      57 GLY  QA      4.96            #peak  1821
  1 ARG  HA      1 ARG  QD      5.34            #peak   787
  1 ARG  QG     25 GLN  QB      4.45            #peak   381
  1 ARG  QD     25 GLN  HA      5.34            #peak   813
  1 ARG  QD     25 GLN  QB      5.18            #peak   809
  1 ARG  QD     28 ASN  QD2     5.18            #peak  1567
  1 ARG  QD     55 CYSS HA      5.34            #peak   816
  1 ARG  QD     55 CYSS HB3     5.34            #peak   775
  1 ARG  QD     57 GLY  H       4.73            #peak  1968
  1 ARG  QD     57 GLY  QA      5.15            #peak   807
  2 PRO  QB      3 ARG  H       3.94            #peak  1490
  2 PRO  QB      4 PHE  H       3.66            #peak   429
  2 PRO  QB      4 PHE  QD      5.34            #peak  1480
  2 PRO  QB      4 PHE  QE      5.27            #peak  1655
  2 PRO  QB      5 CYSS H       4.50            #peak  9312
  2 PRO  QB      5 CYSS QB      4.71            #peak   560
  2 PRO  HG2     5 CYSS QB      5.31            #peak   527
  2 PRO  HG3     5 CYSS QB      4.98            #peak   431
  4 PHE  H       5 CYSS QB      5.09            #peak   399
  4 PHE  QD      5 CYSS QB      5.34            #peak  1495
  4 PHE  HZ      5 CYSS QB      5.34            #peak  1681
  5 CYSS HA     23 TYR  QB      5.20            #peak  1159
  5 CYSS HA     43 ASN  QB      5.11            #peak  1163
  5 CYSS HA     43 ASN  QD2     5.33            #peak    94
  5 CYSS QB      6 GLU  H       4.48            #peak   218
  5 CYSS QB      7 LEU  H       5.34            #peak  9902
  5 CYSS QB     23 TYR  QD      5.34            #peak  1617
  5 CYSS QB     54 THR  QG2     5.34            #peak   406
  6 GLU  H      25 GLN  QE2     5.34            #peak  1730
  6 GLU  HA     25 GLN  QE2     4.33            #peak   239
  6 GLU  HB2    25 GLN  QE2     3.98            #peak   255
  7 LEU  HB2    41 ASN  QB      5.29            #peak   791
  7 LEU  HG     41 ASN  QB      5.34            #peak   820
  7 LEU  QD1    41 ASN  QB      4.24            #peak   247
  7 LEU  QD2    41 ASN  QB      4.49            #peak   199
  8 ALA  H      43 ASN  QB      4.86            #peak  2076
  8 ALA  QB      9 PRO  QB      5.34            #peak   349
  9 PRO  HA     43 ASN  QD2     5.34            #peak    89
  9 PRO  HD2    43 ASN  QD2     5.27            #peak  1872
  9 PRO  HD3    43 ASN  QD2     4.99            #peak  1951
 10 SER  H      41 ASN  QB      5.34            #peak   333
 10 SER  QB     11 ALA  H       4.28            #peak  1839
 10 SER  QB     41 ASN  H       4.60            #peak   713
 12 GLY  H      39 GLY  QA      5.81            #peak  1856
 12 GLY  H      40 GLY  QA      5.34            #peak    83
 18 VAL  HA     19 PRO  QB      5.22            #peak   597
 19 PRO  QB     20 SER  H       3.84            #peak  1229
 19 PRO  QB     34 THR  QG2     5.20            #peak   171
 19 PRO  QB     35 TYR  H       5.22            #peak  1818
 20 SER  H      32 SER  QB      5.34            #peak 12102
 20 SER  QB     33 PHE  QE      5.34            #peak   802
 20 SER  QB     33 PHE  HZ      5.34            #peak  1462
 20 SER  QB     34 THR  HA      5.00            #peak  1107
 20 SER  QB     35 TYR  H       5.34            #peak  1821
 20 SER  QB     44 ARG  QG      4.83            #peak   973
 20 SER  QB     45 PHE  H       4.56            #peak  1665
 21 TYR  H      44 ARG  QG      4.83            #peak   851
 21 TYR  H      44 ARG  QD      5.34            #peak   842
 21 TYR  HB2    44 ARG  QG      5.34            #peak   271
 21 TYR  QD     30 CYSS QB      5.33            #peak  1377
 21 TYR  QD     32 SER  QB      4.56            #peak  1378
 21 TYR  QE     32 SER  QB      4.22            #peak  1414
 22 TYR  H      30 CYSS QB      5.34            #peak  1001
 22 TYR  H      43 ASN  QD2     5.34            #peak  1020
 22 TYR  HA     43 ASN  QD2     5.34            #peak    99
 22 TYR  HB2    43 ASN  QD2     4.87            #peak   106
 22 TYR  QD     23 TYR  QB      5.34            #peak  1436
 22 TYR  QD     25 GLN  QE2     5.34            #peak  1432
 22 TYR  QE     24 ASN  QB      5.28            #peak   625
 23 TYR  H      23 TYR  QB      3.61            #peak  1604
 23 TYR  H      43 ASN  QD2     3.90            #peak  1606
 23 TYR  HA     43 ASN  QD2     5.34            #peak  1959
 23 TYR  QB     24 ASN  H       4.37            #peak  1790
 23 TYR  QB     25 GLN  H       5.32            #peak  1533
 23 TYR  QB     43 ASN  QD2     4.51            #peak   920
 23 TYR  QB     51 CYSS HB2     4.27            #peak   777
 23 TYR  QB     55 CYSS HB2     5.30            #peak   767
 23 TYR  QB     55 CYSS HB3     5.34            #peak   775
 23 TYR  QD     25 GLN  QB      5.34            #peak  1626
 23 TYR  QE     25 GLN  QE2     5.14            #peak  1389
 24 ASN  H      30 CYSS QB      4.85            #peak  1795
 24 ASN  HA     25 GLN  QE2     5.26            #peak  1602
 24 ASN  QB     25 GLN  H       4.11            #peak  1534
 24 ASN  QB     25 GLN  QE2     4.72            #peak  1604
 24 ASN  QB     26 TYR  H       4.88            #peak   995
 24 ASN  QB     26 TYR  HA      5.30            #peak   888
 24 ASN  QB     26 TYR  HB2     5.34            #peak   869
 24 ASN  QB     27 SER  H       4.86            #peak   163
 24 ASN  QB     27 SER  HB2     4.95            #peak   632
 24 ASN  QB     28 ASN  H       5.34            #peak  1140
 24 ASN  QB     29 THR  H       4.18            #peak    40
 24 ASN  QB     29 THR  QG2     4.40            #peak   626
 24 ASN  QB     31 HIS  H       5.34            #peak   962
 24 ASN  QB     31 HIS  HB3     5.34            #peak   869
 25 GLN  H      25 GLN  QB      3.51            #peak  1523
 25 GLN  H      25 GLN  QE2     4.27            #peak  1519
 25 GLN  HA     25 GLN  QE2     5.28            #peak   237
 25 GLN  QB     25 GLN  QE2     4.09            #peak   240
 25 GLN  QB     27 SER  H       5.34            #peak   164
 25 GLN  QB     28 ASN  H       4.76            #peak  1145
 25 GLN  QE2    26 TYR  H       4.11            #peak  1004
 25 GLN  QE2    26 TYR  QE      4.52            #peak  1623
 25 GLN  QE2    27 SER  H       5.34            #peak   257
 27 SER  H      28 ASN  QB      4.78            #peak   176
 27 SER  HA     28 ASN  QB      5.25            #peak  1278
 27 SER  HB3    28 ASN  QB      5.34            #peak   926
 28 ASN  H      28 ASN  QD2     5.05            #peak  1143
 28 ASN  HA     28 ASN  QD2     4.75            #peak   274
 28 ASN  QB     29 THR  H       4.33            #peak    54
 28 ASN  QB     57 GLY  H       5.34            #peak   394
 28 ASN  QD2    56 VAL  HA      4.78            #peak   285
 28 ASN  QD2    56 VAL  QG1     4.09            #peak   192
 28 ASN  QD2    57 GLY  H       4.07            #peak   435
 30 CYSS H      30 CYSS QB      3.68            #peak   893
 30 CYSS QB     31 HIS  H       3.98            #peak   958
 30 CYSS QB     48 ILE  H       5.31            #peak  1643
 30 CYSS QB     48 ILE  QD1     4.45            #peak    54
 30 CYSS QB     52 ASN  H       5.34            #peak  1207
 32 SER  H      32 SER  QB      3.56            #peak   757
 32 SER  QB     33 PHE  H       3.85            #peak  1297
 33 PHE  QD     43 ASN  QD2     5.34            #peak   102
 33 PHE  QE     43 ASN  QD2     4.98            #peak  1876
 33 PHE  HZ     44 ARG  QB      5.34            #peak  1461
 33 PHE  HZ     44 ARG  QG      5.34            #peak  1476
 39 GLY  H      40 GLY  QA      5.32            #peak  1065
 39 GLY  QA     40 GLY  QA      4.99            #peak  1071
 40 GLY  QA     41 ASN  QB      5.18            #peak  1159
 41 ASN  QB     42 ALA  QB      5.34            #peak    69
 41 ASN  QB     43 ASN  H       3.90            #peak   797
 41 ASN  QB     44 ARG  H       4.59            #peak   784
 42 ALA  QB     44 ARG  QB      5.34            #peak   357
 43 ASN  H      44 ARG  QB      5.20            #peak   745
 43 ASN  QD2    44 ARG  H       5.34            #peak    96
 44 ARG  H      44 ARG  QG      4.67            #peak  1319
 44 ARG  H      44 ARG  QD      5.17            #peak  1292
 46 ARG  H      46 ARG  QG      3.70            #peak  1354
 46 ARG  H      46 ARG  QD      4.11            #peak  1350
 46 ARG  QG     47 THR  QG2     4.54            #peak   306
 46 ARG  QG     50 GLU  QB      4.73            #peak   648
 46 ARG  QD     47 THR  H       4.31            #peak    12
 46 ARG  QD     50 GLU  H       5.34            #peak  7851
 46 ARG  QD     50 GLU  HA      5.34            #peak   926
 46 ARG  QD     50 GLU  QB      5.23            #peak   915
 46 ARG  QD     50 GLU  QG      4.53            #peak   922
 46 ARG  QD     51 CYSS H       4.65            #peak  1228
 48 ILE  QG2    52 ASN  QD2     4.16            #peak   118
 48 ILE  HG12   52 ASN  QD2     4.85            #peak    96
 49 ASP  H      52 ASN  QD2     5.33            #peak  1072
 49 ASP  HA     52 ASN  QD2     4.17            #peak   113
 49 ASP  QB     52 ASN  QD2     5.34            #peak  1614
 52 ASN  H      52 ASN  QD2     4.16            #peak  1174
 52 ASN  QD2    53 ARG  H       4.37            #peak   717
 52 ASN  QD2    53 ARG  QB      5.34            #peak  1642
 52 ASN  QD2    53 ARG  HG2     5.34            #peak   442
 52 ASN  QD2    56 VAL  QG1     5.34            #peak   173
 56 VAL  H      57 GLY  QA      5.34            #peak  1102
 56 VAL  QG1    57 GLY  QA      4.34            #peak   181
 24 ASN  O      29 THR  H       2.50 1 #2.2
 24 ASN  O      29 THR  N       3.40 1 #3.0
 29 THR  O      24 ASN  H       2.00 1 
 29 THR  O      24 ASN  N       3.00 1 
 22 TYR  O      31 HIS  H       2.00 1 
 22 TYR  O      31 HIS  N       3.00 1 
 31 HIS  O      22 TYR  H       2.00 1 
 31 HIS  O      22 TYR  N       3.00 1 
 20 SER  O      33 PHE  H       2.00 1 
 20 SER  O      33 PHE  N       3.00 1 
 33 PHE  O      20 SER  H       2.20 1 #2.0 
 33 PHE  O      20 SER  N       3.00 1 
 14 CYSS  SG      38 CYSS  SG      2.30 
  5 CYSS  SG      55 CYSS  SG      2.30 
 30 CYSS  SG      51 CYSS  SG      2.30 

#cal9 refine3 refine6
#15 PHE QD   11 ALA QB   6.00
#15 PHE QD   53 ARG HG3  0.00
33 PHE QD   11 ALA QB   6.00
#33 PHE QD   53 ARG HG3  0.00

# peak 488 1553 1836 1553 1552 change to ambigious
 11 ALA  QB     33 PHE  QE      5.03
 11 ALA  QB     35 TYR  QD      0.00

 11 ALA  HA     33 PHE  QE      5.50
 11 ALA  HA     35 TYR  QD      0.00

 11 ALA  H      33 PHE  QE      5.35
 11 ALA  H      35 TYR  QD      0.00

 33 PHE  QE     35 TYR  HA      5.50
 35 TYR  QD     35 TYR  HA      0.00

 20 SER  HB3    33 PHE  QE      5.50
 20 SER  HB3    35 TYR  QD      0.00

 33 PHE  QE     34 THR  QG2     5.50 #4.73
 35 TYR  QD     34 THR  QG2     0.00

 33 PHE  QE     35 TYR  H       5.50
 35 TYR  QD     35 TYR  H       0.00


#cal10
42 ALA QB    4 PHE QE   6.00 #peak 1658
42 ALA QB    4 PHE HZ   0.00
42 ALA QB    7 LEU H    0.00
42 ALA QB    4 PHE QD   6.00 #peak 1483

#it should be 2 PRO HB2, but not stereo assigned
#therefore set einfach 2 PRO QB
 2 PRO QB    4 PHE QE   6.00
 2 PRO QB    4 PHE HZ   0.00
 2 PRO QB    7 LEU H    0.00
 2 PRO QB    4 PHE QD   6.00

#cal12
 7 LEU QD2   4 PHE QD   7.00
 7 LEU QD2  33 PHE HZ   0.00 
 
 7 LEU QD2  23 TYR QD   7.00
 7 LEU QD2  17 PHE QE   0.00
 7 LEU QD2   4 PHE H    0.00
 
 7 LEU QD2   4 PHE HZ   7.00
 7 LEU QD2   4 PHE QE   0.00
 7 LEU QD2   7 LEU H    0.00

#cal13 these constraints used in cal13
# 9 PRO HB2  51 CYSS H   7.00
# 9 PRO HB2  22 TYR QD   0.00
# 9 PRO HB2  33 PHE QD   7.00
# 9 PRO HB2  33 PHE QE   7.00
 
# 9 PRO HB3  51 CYSS H   7.00
# 9 PRO HB3  22 TYR QD   0.00
# 9 PRO HB3  33 PHE QD   7.00
# 9 PRO HB3  33 PHE QE   7.00

# 9 PRO QG   51 CYSS H   7.00
# 9 PRO QG   22 TYR QD   0.00
   
#cal14
25 GLN HE21  6 GLU HB3  6.00
25 GLN HE21 56 VAL HB   0.00
#25 GLN HE21  6 GLU QG   0.00

25 GLN HE22  6 GLU HB3  6.00
25 GLN HE22 56 VAL HB   0.00
#25 GLN HE22  6 GLU QG   0.00

25 GLN HE21  6 GLU HB2  6.00
25 GLN HE22  6 GLU HB2  6.00

#cal15
#43 ASN HD22  7 LEU HB3  6.00
#43 ASN HD22 46 ARG HG3  0.00

#cal16
#43 ASN HD22  7 LEU HB3  6.00
#43 ASN HD22 46 ARG HG3  0.00

#cal17
54 THR QG2    4 PHE QE   6.00 
54 THR QG2    4 PHE HZ   0.00
#54 THR QG2    7 LEU H    0.00
54 THR QG2    4 PHE QD   6.00 

#cal19
# 9 PRO HB2  51 CYSS H   7.00
 9 PRO HB2  22 TYR QD   6.00
 9 PRO HB2  33 PHE QD   6.00
 9 PRO HB2  33 PHE QE   6.00
 
# 9 PRO HB3  51 CYSS H   7.00
 9 PRO HB3  22 TYR QD   6.00
# 9 PRO HB3  33 PHE QD   6.00 #21
 9 PRO HB3  33 PHE QE   6.00

# 9 PRO QG   51 CYSS H   7.00
 9 PRO QG   22 TYR QD   6.00

#cal23
#17 PHE QD  34 THR QG2  6.00
#33 PHE QD  34 THR QG2  0.00

25 GLN HE21  23 TYR QD 6.00
25 GLN HE21  17 PHE QE 0.00

#cal24 
12 GLY H  12 GLY QA   6.00
12 GLY H  39 GLY HA2  0.00

12 GLY H  39 GLY HA3  6.00

10 SER H  40 GLY HA2  6.00

#cal26
17 PHE QD  34 THR QG2  6.00
33 PHE QD  34 THR QG2  6.00
17 PHE QD  34 THR HA  6.00
33 PHE QD  34 THR HA  6.00

#1468 
11 ALA  H      39 GLY  HA3   6.00
11 ALA  H      13 SER  HA    0.00
11 ALA  H      36 SER  HA    0.00
11 ALA  H      37 GLY  QA    0.00
11 ALA  H      38 CYSS HA    0.00

11 ALA  H      40 GLY  HA2   6.00
11 ALA  H      13 SER  HA    0.00
11 ALA  H      36 SER  HA    0.00
11 ALA  H      37 GLY  QA    0.00
11 ALA  H      38 CYSS HA    0.00

11 ALA  H      40 GLY  HA3   6.00
11 ALA  H      13 SER  HA    0.00
11 ALA  H      36 SER  HA    0.00
11 ALA  H      37 GLY  QA    0.00
11 ALA  H      38 CYSS HA    0.00

11 ALA  H      39 GLY  HA2   6.00 
11 ALA  H      13 SER  HA    0.00
11 ALA  H      36 SER  HA    0.00
11 ALA  H      37 GLY  QA    0.00
11 ALA  H      38 CYSS HA    0.00


11 ALA  HA      39 GLY  HA2   6.00
11 ALA  HA      13 SER  HA    0.00
11 ALA  HA      36 SER  HA    0.00
11 ALA  HA      37 GLY  QA    0.00
11 ALA  HA      38 CYSS HA    0.00
35 TYR  HA      39 GLY  HA2   0.00
35 TYR  HA      13 SER  HA    0.00
35 TYR  HA      36 SER  HA    0.00
35 TYR  HA      37 GLY  QA    0.00
35 TYR  HA      38 CYSS HA    0.00

11 ALA  HA      40 GLY  HA3   6.00
11 ALA  HA      13 SER  HA    0.00
11 ALA  HA      36 SER  HA    0.00
11 ALA  HA      37 GLY  QA    0.00
11 ALA  HA      38 CYSS HA    0.00
35 TYR  HA      40 GLY  HA3   0.00
35 TYR  HA      13 SER  HA    0.00
35 TYR  HA      36 SER  HA    0.00
35 TYR  HA      37 GLY  QA    0.00
35 TYR  HA      38 CYSS HA    0.00

12 GLY  H       40 GLY  H    6.00
12 GLY  H       13 SER  H    0.00
12 GLY  H       36 SER  H    0.00
12 GLY  H       37 GLY  H    0.00
12 GLY  H       38 CYSS H    0.00
12 GLY  H       14 CYSS H    0.00

12 GLY  H      40 GLY  HA2   6.00
12 GLY  H      13 SER  HA    0.00
12 GLY  H      36 SER  HA    0.00
12 GLY  H      37 GLY  QA    0.00
12 GLY  H      38 CYSS HA    0.00

12 GLY  H      40 GLY  HA3   6.00
12 GLY  H      13 SER  HA    0.00
12 GLY  H      36 SER  HA    0.00
12 GLY  H      37 GLY  QA    0.00
12 GLY  H      38 CYSS HA    0.00



10 SER  HA      40 GLY  H    6.00
10 SER  HA      13 SER  H    0.00
10 SER  HA      36 SER  H    0.00
10 SER  HA      37 GLY  H    0.00
10 SER  HA      38 CYSS H    0.00
10 SER  HA      14 CYSS H    0.00

10 SER  H      40 GLY  HA2   6.00
10 SER  H      13 SER  HA    0.00
10 SER  H      36 SER  HA    0.00
10 SER  H      37 GLY  QA    0.00
10 SER  H      38 CYSS HA    0.00

10 SER  H      40 GLY  HA3   6.00
10 SER  H      13 SER  HA    0.00
10 SER  H      36 SER  HA    0.00
10 SER  H      37 GLY  QA    0.00
10 SER  H      38 CYSS HA    0.00


10 SER  HB3      39 GLY  HA3   6.00
10 SER  HB3      13 SER  HA    0.00
10 SER  HB3      36 SER  HA    0.00
10 SER  HB3      37 GLY  QA    0.00
10 SER  HB3      38 CYSS HA    0.00

10 SER  HB3      40 GLY  H    6.00
10 SER  HB3      13 SER  H    0.00
10 SER  HB3      36 SER  H    0.00
10 SER  HB3      37 GLY  H    0.00
10 SER  HB3      38 CYSS H    0.00
10 SER  HB3      14 CYSS H    0.00











48 ILE O   52 ASN H  2.40 1
48 ILE O   52 ASN N  3.40 1
49 ASP O   53 ARG H  2.40 1
49 ASP O   53 ARG N  3.40 1 #3.0
50 GLU O   54 THR H  2.40 1 #2.0
50 GLU O   54 THR N  3.40 1
51 CYSS O  55 CYSS H 2.40 1
51 CYSS O  55 CYSS N 3.40 1

 24 ASN  O      29 THR  H       1.80 1 
 24 ASN  O      29 THR  N       2.70 1 
 29 THR  O      24 ASN  H       1.80 1 
 29 THR  O      24 ASN  N       2.70 1 
 22 TYR  O      31 HIS  H       1.80 1 
 22 TYR  O      31 HIS  N       2.70 1 
 31 HIS  O      22 TYR  H       1.80 1 
 31 HIS  O      22 TYR  N       2.70 1 
 20 SER  O      33 PHE  H       1.80 1 
 20 SER  O      33 PHE  N       2.70 1 
 33 PHE  O      20 SER  H       1.80 1 
 33 PHE  O      20 SER  N       2.70 1 
 14 CYSS  SG      38 CYSS  SG      1.80 
  5 CYSS  SG      55 CYSS  SG      1.80 
 30 CYSS  SG      51 CYSS  SG      1.80 

48 ILE O   52 ASN H  1.80 1
48 ILE O   52 ASN N  2.70 1
49 ASP O   53 ARG H  1.80 1
49 ASP O   53 ARG N  2.70 1
50 GLU O   54 THR H  1.80 1
50 GLU O   54 THR N  2.70 1
51 CYSS O  55 CYSS H 1.80 1
51 CYSS O  55 CYSS N 2.70 1

#  2 PRO PHI    -88.323   -28.323
   2 PRO PSI    111.872   171.872
   3 ARG PHI   -85.207   -25.207 
   3 ARG PSI   -66.200    -6.200 
   4 PHE PHI   -99.328   -39.328 
   4 PHE PSI   -58.872     1.128 
   5 CYSS PHI   -99.751   -39.751
   5 CYSS PSI   -62.467    -2.467
   8 ALA PHI   -98.659   -38.659 
   8 ALA PSI   105.618   165.618 
  11 ALA PHI   -97.542   -37.542 
  11 ALA PSI   -63.000    -3.000 
  12 GLY PHI   -99.477   -39.477 
  12 GLY PSI   -53.095     6.905 
  15 PHE PHI  -149.613   -89.613 
  15 PHE PSI   108.235   168.235 
  16 ALA PHI  -147.748   -87.748 
  16 ALA PSI   137.954   197.954 
  17 PHE PHI  -131.527   -71.527 
  17 PHE PSI    98.516   158.516 
  18 VAL PHI  -136.517   -76.517 
  18 VAL PSI    92.774   152.774 
# 19 PRO PHI    -94.906   -34.906
  19 PRO PSI    111.426   171.426
  20 SER PHI  -157.060   -97.060 
  20 SER PSI   124.154   184.154 
  21 TYR PHI  -170.585  -110.585 
  21 TYR PSI   123.489   183.489 
  22 TYR PHI  -159.522   -99.522 
  22 TYR PSI   115.874   175.874 
  23 TYR PHI  -136.429   -76.429 
  23 TYR PSI    89.068   149.068 
  25 GLN PHI   -92.616   -32.616 
  25 GLN PSI   -57.569   2.431   
  26 TYR PHI  -102.508   -42.508 
  26 TYR PSI   -64.796    -4.796 
  27 SER PHI  -118.666   -58.666 
  27 SER PSI   -45.849    14.151 
  29 THR PHI  -161.081  -101.081 
  29 THR PSI   135.530   195.530 
  30 CYSS PHI  -156.638   -96.638
  30 CYSS PSI   110.385   170.385
  31 HIS PHI  -163.258  -103.258 
  31 HIS PSI   119.088   179.088 
  32 SER PHI  -123.784   -63.784 
  32 SER PSI   112.492   172.492 
  33 PHE PHI  -148.619   -88.619 
  33 PHE PSI    99.643   179.643 #109.643   169.643
  34 THR PHI  -125.728   -65.728 
  34 THR PSI    91.250   151.250 
  35 TYR PHI  -145.251   -85.251 
  35 TYR PSI   104.209   184.209 
  42 ALA PHI  -116.612   -56.612 
  42 ALA PSI   -44.894    15.106 
  44 ARG PHI  -133.426   -73.426 
  44 ARG PSI    98.173   158.173 
  45 PHE PHI  -145.086   -85.086 
  45 PHE PSI   129.921   189.921 
  46 ARG PHI  -115.315   -55.315 
  46 ARG PSI   -50.681     9.319 
  47 THR PHI  -162.188  -102.188 
  47 THR PSI   131.012   191.012 
  48 ILE PHI   -92.530   -32.530 
  48 ILE PSI   -70.982   -10.982 
  49 ASP PHI   -91.637   -31.637 
  49 ASP PSI   -68.513    -8.513 
  50 GLU PHI   -94.613   -34.613 
  50 GLU PSI   -71.117   -11.117 
  51 CYSS PHI   -97.732   -37.732
  51 CYSS PSI   -70.970   -10.970
  52 ASN PHI   -89.022   -29.022 
  52 ASN PSI   -69.150   -9.150  
  53 ARG PHI   -92.978   -32.978 
  53 ARG PSI   -71.209   -11.209 
  54 THR PHI   -97.309   -37.309 
  54 THR PSI   -73.829   -13.829 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           H        ARG   1  12.488  -6.582   2.146
    2    HA   ARG   1           HA       ARG   1  10.649  -4.359   2.858
    3    HB2  ARG   1           HB2      ARG   1   9.255  -5.313   0.921
    4    HB3  ARG   1           HB3      ARG   1  10.611  -4.286   0.536
    5    HG2  ARG   1           HG2      ARG   1  10.923  -7.285   0.439
    6    HG3  ARG   1           HG3      ARG   1  10.172  -6.412  -0.878
    7    HD2  ARG   1           HD2      ARG   1  12.893  -5.472   0.112
    8    HD3  ARG   1           HD3      ARG   1  12.797  -6.897  -0.876
    9    HE   ARG   1           HE       ARG   1  12.648  -4.183  -1.694
   10   HH11  ARG   1          HH11      ARG   1  11.412  -7.391  -2.469
   11   HH12  ARG   1          HH12      ARG   1  11.367  -7.192  -4.170
   12   HH21  ARG   1          HH21      ARG   1  12.890  -3.909  -3.970
   13   HH22  ARG   1          HH22      ARG   1  12.256  -5.070  -5.066
   14    HA   PRO   2           HA       PRO   2   9.128  -7.722   5.386
   15    HB2  PRO   2           HB2      PRO   2   6.925  -6.488   6.442
   16    HB3  PRO   2           HB3      PRO   2   8.566  -6.104   7.002
   17    HG2  PRO   2           HG2      PRO   2   6.978  -4.613   4.966
   18    HG3  PRO   2           HG3      PRO   2   7.871  -3.952   6.379
   19    HD2  PRO   2           HD2      PRO   2   9.071  -3.946   3.947
   20    HD3  PRO   2           HD3      PRO   2   9.991  -4.418   5.391
   21    H    ARG   3           H        ARG   3   7.540  -9.332   4.896
   22    HA   ARG   3           HA       ARG   3   6.365  -9.277   2.342
   23    HB2  ARG   3           HB2      ARG   3   5.496 -11.423   2.794
   24    HB3  ARG   3           HB3      ARG   3   7.049 -11.300   3.596
   25    HG2  ARG   3           HG2      ARG   3   5.899 -12.288   5.284
   26    HG3  ARG   3           HG3      ARG   3   5.515 -10.620   5.712
   27    HD2  ARG   3           HD2      ARG   3   3.334 -10.811   4.594
   28    HD3  ARG   3           HD3      ARG   3   3.748 -12.405   3.977
   29    HE   ARG   3           HE       ARG   3   2.863 -11.683   6.663
   30   HH11  ARG   3          HH11      ARG   3   4.440 -14.282   4.747
   31   HH12  ARG   3          HH12      ARG   3   3.739 -15.527   5.732
   32   HH21  ARG   3          HH21      ARG   3   2.062 -13.369   7.967
   33   HH22  ARG   3          HH22      ARG   3   2.219 -15.004   7.439
   34    H    PHE   4           H        PHE   4   5.113  -7.731   5.168
   35    HA   PHE   4           HA       PHE   4   2.341  -8.071   4.450
   36    HB2  PHE   4           HB2      PHE   4   1.833  -6.698   6.183
   37    HB3  PHE   4           HB3      PHE   4   3.360  -7.327   6.726
   38    HD1  PHE   4           HD2      PHE   4   1.727  -4.433   5.036
   39    HD2  PHE   4           HD1      PHE   4   5.113  -5.763   7.309
   40    HE1  PHE   4           HE2      PHE   4   2.342  -2.087   5.451
   41    HE2  PHE   4           HE1      PHE   4   5.843  -3.397   7.587
   42    HZ   PHE   4           HZ       PHE   4   4.452  -1.563   6.714
   43    H    CYS   5           H        CYS   5   4.982  -6.004   3.263
   44    HA   CYS   5           HA       CYS   5   3.243  -4.065   2.011
   45    HB2  CYS   5           HB2      CYS   5   6.188  -4.694   2.083
   46    HB3  CYS   5           HB3      CYS   5   5.554  -3.620   0.839
   47    H    GLU   6           H        GLU   6   4.001  -7.270   1.129
   48    HA   GLU   6           HA       GLU   6   3.720  -6.585  -1.788
   49    HB2  GLU   6           HB2      GLU   6   4.649  -8.661  -2.297
   50    HB3  GLU   6           HB3      GLU   6   5.611  -7.935  -0.986
   51    HG2  GLU   6           HG2      GLU   6   4.920  -9.394   0.609
   52    HG3  GLU   6           HG3      GLU   6   3.469  -9.931  -0.257
   53    H    LEU   7           H        LEU   7   1.517  -6.962   0.547
   54    HA   LEU   7           HA       LEU   7  -0.028  -9.157  -0.528
   55    HB2  LEU   7           HB2      LEU   7  -0.740  -7.029   1.492
   56    HB3  LEU   7           HB3      LEU   7  -1.620  -8.548   1.202
   57    HG   LEU   7           HG       LEU   7   1.184  -8.217   2.336
   58   HD11  LEU   7          HD11      LEU   7  -1.293  -9.370   3.638
   59   HD12  LEU   7          HD12      LEU   7  -0.801  -7.675   3.794
   60   HD13  LEU   7          HD13      LEU   7   0.258  -8.961   4.405
   61   HD21  LEU   7          HD21      LEU   7  -0.291 -10.829   2.009
   62   HD22  LEU   7          HD22      LEU   7   1.332 -10.535   2.730
   63   HD23  LEU   7          HD23      LEU   7   1.088 -10.287   1.010
   64    H    ALA   8           H        ALA   8  -2.261  -8.829  -1.024
   65    HA   ALA   8           HA       ALA   8  -2.577  -6.827  -3.187
   66    HB1  ALA   8           HB1      ALA   8  -3.991  -9.429  -2.567
   67    HB2  ALA   8           HB2      ALA   8  -4.470  -8.312  -3.845
   68    HB3  ALA   8           HB3      ALA   8  -2.873  -9.084  -3.912
   69    HA   PRO   9           HA       PRO   9  -5.081  -4.945   0.076
   70    HB2  PRO   9           HB2      PRO   9  -5.601  -2.539  -1.078
   71    HB3  PRO   9           HB3      PRO   9  -4.054  -2.954  -0.294
   72    HG2  PRO   9           HG2      PRO   9  -4.748  -3.022  -3.247
   73    HG3  PRO   9           HG3      PRO   9  -3.268  -2.390  -2.462
   74    HD2  PRO   9           HD2      PRO   9  -3.437  -4.868  -3.597
   75    HD3  PRO   9           HD3      PRO   9  -2.367  -4.516  -2.211
   76    H    SER  10           H        SER  10  -6.802  -6.397  -0.153
   77    HA   SER  10           HA       SER  10  -8.603  -6.589  -2.266
   78    HB2  SER  10           HB2      SER  10  -8.116  -8.344  -0.604
   79    HB3  SER  10           HB3      SER  10  -9.022  -7.434   0.618
   80    HG   SER  10           HG       SER  10 -10.128  -9.172  -0.691
   81    H    ALA  11           H        ALA  11  -8.919  -4.173  -2.502
   82    HA   ALA  11           HA       ALA  11 -10.705  -2.746  -0.772
   83    HB1  ALA  11           HB1      ALA  11  -9.980  -2.266  -3.697
   84    HB2  ALA  11           HB2      ALA  11 -10.705  -1.081  -2.588
   85    HB3  ALA  11           HB3      ALA  11  -9.060  -1.677  -2.292
   86    H    GLY  12           H        GLY  12 -11.330  -5.087  -3.345
   87    HA2  GLY  12           HA2      GLY  12 -13.963  -4.209  -4.041
   88    HA3  GLY  12           HA3      GLY  12 -13.252  -5.803  -4.336
   89    H    SER  13           H        SER  13 -12.892  -5.578  -1.122
   90    HA   SER  13           HA       SER  13 -14.848  -7.449  -0.443
   91    HB2  SER  13           HB2      SER  13 -13.466  -5.423   1.342
   92    HB3  SER  13           HB3      SER  13 -14.293  -6.892   1.892
   93    HG   SER  13           HG       SER  13 -11.928  -6.715   0.305
   94    H    CYS  14           H        CYS  14 -15.108  -3.821  -0.139
   95    HA   CYS  14           HA       CYS  14 -18.029  -4.087  -0.001
   96    HB2  CYS  14           HB2      CYS  14 -16.459  -2.481   2.056
   97    HB3  CYS  14           HB3      CYS  14 -18.203  -2.507   1.850
   98    H    PHE  15           H        PHE  15 -18.986  -1.744  -0.150
   99    HA   PHE  15           HA       PHE  15 -17.513  -0.461  -2.338
  100    HB2  PHE  15           HB2      PHE  15 -19.994  -0.919  -2.370
  101    HB3  PHE  15           HB3      PHE  15 -20.180   0.333  -1.148
  102    HD1  PHE  15           HD1      PHE  15 -19.225   2.738  -1.732
  103    HD2  PHE  15           HD2      PHE  15 -19.923  -0.378  -4.642
  104    HE1  PHE  15           HE1      PHE  15 -19.118   4.405  -3.552
  105    HE2  PHE  15           HE2      PHE  15 -19.934   1.326  -6.442
  106    HZ   PHE  15           HZ       PHE  15 -19.544   3.709  -5.901
  107    H    ALA  16           H        ALA  16 -15.844   0.911  -1.648
  108    HA   ALA  16           HA       ALA  16 -16.664   3.115   0.026
  109    HB1  ALA  16           HB1      ALA  16 -14.569   1.133   0.921
  110    HB2  ALA  16           HB2      ALA  16 -14.621   2.798   1.541
  111    HB3  ALA  16           HB3      ALA  16 -15.984   1.693   1.815
  112    H    PHE  17           H        PHE  17 -15.081   4.823   0.103
  113    HA   PHE  17           HA       PHE  17 -13.123   4.728  -2.111
  114    HB2  PHE  17           HB2      PHE  17 -15.442   5.862  -2.597
  115    HB3  PHE  17           HB3      PHE  17 -14.758   7.224  -1.730
  116    HD1  PHE  17           HD2      PHE  17 -11.758   6.613  -2.835
  117    HD2  PHE  17           HD1      PHE  17 -15.650   7.048  -4.678
  118    HE1  PHE  17           HE2      PHE  17 -10.696   7.140  -4.963
  119    HE2  PHE  17           HE1      PHE  17 -14.539   7.628  -6.814
  120    HZ   PHE  17           HZ       PHE  17 -12.051   7.596  -6.970
  121    H    VAL  18           H        VAL  18 -11.328   4.699  -0.853
  122    HA   VAL  18           HA       VAL  18 -10.739   7.076   0.723
  123    HB   VAL  18           HB       VAL  18  -9.594   5.574   2.465
  124   HG11  VAL  18          HG11      VAL  18 -11.475   7.145   2.864
  125   HG12  VAL  18          HG12      VAL  18 -12.627   5.850   2.497
  126   HG13  VAL  18          HG13      VAL  18 -11.542   5.718   3.897
  127   HG21  VAL  18          HG21      VAL  18 -10.816   3.519   3.078
  128   HG22  VAL  18          HG22      VAL  18 -11.804   3.646   1.610
  129   HG23  VAL  18          HG23      VAL  18 -10.055   3.354   1.494
  130    HA   PRO  19           HA       PRO  19  -7.532   5.929  -2.303
  131    HB2  PRO  19           HB2      PRO  19  -6.312   8.368  -2.572
  132    HB3  PRO  19           HB3      PRO  19  -7.850   7.943  -3.391
  133    HG2  PRO  19           HG2      PRO  19  -7.479   9.495  -0.814
  134    HG3  PRO  19           HG3      PRO  19  -8.516   9.898  -2.208
  135    HD2  PRO  19           HD2      PRO  19  -9.500   8.656   0.013
  136    HD3  PRO  19           HD3      PRO  19 -10.106   8.243  -1.624
  137    H    SER  20           H        SER  20  -5.791   4.840  -1.532
  138    HA   SER  20           HA       SER  20  -4.165   6.008   0.632
  139    HB2  SER  20           HB2      SER  20  -5.066   3.117   0.501
  140    HB3  SER  20           HB3      SER  20  -3.996   3.836   1.678
  141    HG   SER  20           HG       SER  20  -5.729   5.320   2.167
  142    H    TYR  21           H        TYR  21  -2.075   4.259   0.779
  143    HA   TYR  21           HA       TYR  21  -0.817   4.564  -1.926
  144    HB2  TYR  21           HB2      TYR  21   0.088   5.000   0.869
  145    HB3  TYR  21           HB3      TYR  21   1.271   4.346  -0.233
  146    HD1  TYR  21           HD2      TYR  21   2.002   5.712  -2.304
  147    HD2  TYR  21           HD1      TYR  21  -0.588   7.259   0.806
  148    HE1  TYR  21           HE2      TYR  21   2.362   7.984  -3.129
  149    HE2  TYR  21           HE1      TYR  21  -0.143   9.555   0.014
  150    HH   TYR  21           HH       TYR  21   1.931  10.296  -2.799
  151    H    TYR  22           H        TYR  22   0.088   2.918  -2.925
  152    HA   TYR  22           HA       TYR  22   0.037   0.199  -1.831
  153    HB2  TYR  22           HB2      TYR  22  -1.021   1.124  -4.123
  154    HB3  TYR  22           HB3      TYR  22   0.630   1.207  -4.659
  155    HD1  TYR  22           HD1      TYR  22   1.938  -0.896  -5.052
  156    HD2  TYR  22           HD2      TYR  22  -2.224  -0.918  -3.944
  157    HE1  TYR  22           HE1      TYR  22   1.770  -3.242  -5.796
  158    HE2  TYR  22           HE2      TYR  22  -2.416  -3.254  -4.755
  159    HH   TYR  22           HH       TYR  22  -1.250  -5.165  -5.502
  160    H    TYR  23           H        TYR  23   1.984  -1.065  -2.214
  161    HA   TYR  23           HA       TYR  23   4.542   0.507  -2.418
  162    HB2  TYR  23           HB2      TYR  23   4.369  -0.468  -0.243
  163    HB3  TYR  23           HB3      TYR  23   3.864  -2.021  -0.891
  164    HD1  TYR  23           HD1      TYR  23   6.773   0.354  -0.827
  165    HD2  TYR  23           HD2      TYR  23   5.471  -3.676  -1.620
  166    HE1  TYR  23           HE1      TYR  23   9.129  -0.386  -1.062
  167    HE2  TYR  23           HE2      TYR  23   7.809  -4.424  -1.680
  168    HH   TYR  23           HH       TYR  23  10.464  -2.462  -0.802
  169    H    ASN  24           H        ASN  24   5.845  -0.018  -4.162
  170    HA   ASN  24           HA       ASN  24   5.117  -2.442  -5.746
  171    HB2  ASN  24           HB2      ASN  24   5.992   0.299  -6.722
  172    HB3  ASN  24           HB3      ASN  24   5.865  -1.138  -7.725
  173   HD21  ASN  24          HD21      ASN  24   3.739  -1.963  -8.278
  174   HD22  ASN  24          HD22      ASN  24   2.308  -0.980  -8.020
  175    H    GLN  25           H        GLN  25   6.711  -3.706  -4.618
  176    HA   GLN  25           HA       GLN  25   9.419  -3.123  -4.244
  177    HB2  GLN  25           HB2      GLN  25   9.747  -5.657  -4.795
  178    HB3  GLN  25           HB3      GLN  25   9.000  -5.172  -3.304
  179    HG2  GLN  25           HG2      GLN  25   7.369  -5.992  -5.755
  180    HG3  GLN  25           HG3      GLN  25   8.049  -7.153  -4.614
  181   HE21  GLN  25          HE21      GLN  25   5.309  -5.079  -5.154
  182   HE22  GLN  25          HE22      GLN  25   4.668  -5.218  -3.547
  183    H    TYR  26           H        TYR  26   7.776  -4.227  -7.216
  184    HA   TYR  26           HA       TYR  26   9.917  -4.862  -8.831
  185    HB2  TYR  26           HB2      TYR  26   7.316  -3.466  -9.518
  186    HB3  TYR  26           HB3      TYR  26   8.422  -4.101 -10.715
  187    HD1  TYR  26           HD1      TYR  26   5.998  -5.039  -8.066
  188    HD2  TYR  26           HD2      TYR  26   8.585  -6.453 -11.200
  189    HE1  TYR  26           HE1      TYR  26   4.790  -7.212  -8.073
  190    HE2  TYR  26           HE2      TYR  26   7.392  -8.616 -11.226
  191    HH   TYR  26           HH       TYR  26   5.322  -9.646 -10.596
  192    H    SER  27           H        SER  27   8.820  -1.633  -7.895
  193    HA   SER  27           HA       SER  27  11.035  -0.487  -9.527
  194    HB2  SER  27           HB2      SER  27   8.621  -0.056 -10.280
  195    HB3  SER  27           HB3      SER  27   8.476   0.992  -8.862
  196    HG   SER  27           HG       SER  27  10.465   1.136 -10.891
  197    H    ASN  28           H        ASN  28  10.658  -1.399  -6.523
  198    HA   ASN  28           HA       ASN  28  11.200  -0.734  -4.472
  199    HB2  ASN  28           HB2      ASN  28  13.386  -0.963  -5.644
  200    HB3  ASN  28           HB3      ASN  28  13.354   0.736  -6.075
  201   HD21  ASN  28          HD21      ASN  28  13.102  -1.255  -3.007
  202   HD22  ASN  28          HD22      ASN  28  14.264  -0.249  -2.184
  203    H    THR  29           H        THR  29   9.031   0.739  -5.218
  204    HA   THR  29           HA       THR  29   9.427   3.107  -3.652
  205    HB   THR  29           HB       THR  29  10.180   3.797  -5.952
  206    HG1  THR  29           HG1      THR  29   9.363   5.156  -4.277
  207   HG21  THR  29          HG21      THR  29   8.529   2.621  -7.353
  208   HG22  THR  29          HG22      THR  29   8.520   4.368  -7.638
  209   HG23  THR  29          HG23      THR  29   7.224   3.629  -6.689
  210    H    CYS  30           H        CYS  30   7.017   4.362  -4.289
  211    HA   CYS  30           HA       CYS  30   4.911   2.344  -3.712
  212    HB2  CYS  30           HB2      CYS  30   5.382   5.000  -2.339
  213    HB3  CYS  30           HB3      CYS  30   4.072   3.892  -1.979
  214    H    HIS  31           H        HIS  31   2.741   3.318  -4.122
  215    HA   HIS  31           HA       HIS  31   2.725   5.836  -5.632
  216    HB2  HIS  31           HB2      HIS  31   3.338   3.783  -7.159
  217    HB3  HIS  31           HB3      HIS  31   1.659   3.313  -6.948
  218    HD1  HIS  31           HD1      HIS  31   0.564   4.027  -9.261
  219    HD2  HIS  31           HD2      HIS  31   3.311   6.784  -7.628
  220    HE1  HIS  31           HE1      HIS  31   0.680   5.971 -10.901
  221    H    SER  32           H        SER  32   0.703   6.834  -5.583
  222    HA   SER  32           HA       SER  32  -1.120   5.858  -3.598
  223    HB2  SER  32           HB2      SER  32  -2.483   7.710  -4.087
  224    HB3  SER  32           HB3      SER  32  -0.802   8.241  -4.108
  225    HG   SER  32           HG       SER  32  -1.045   7.951  -6.555
  226    H    PHE  33           H        PHE  33  -3.024   4.742  -3.735
  227    HA   PHE  33           HA       PHE  33  -4.151   3.959  -6.331
  228    HB2  PHE  33           HB2      PHE  33  -4.094   1.690  -6.060
  229    HB3  PHE  33           HB3      PHE  33  -2.493   2.158  -5.534
  230    HD1  PHE  33           HD2      PHE  33  -2.310   2.592  -2.909
  231    HD2  PHE  33           HD1      PHE  33  -5.399   0.225  -4.722
  232    HE1  PHE  33           HE2      PHE  33  -2.703   1.397  -0.727
  233    HE2  PHE  33           HE1      PHE  33  -5.871  -0.829  -2.571
  234    HZ   PHE  33           HZ       PHE  33  -4.446  -0.240  -0.536
  235    H    THR  34           H        THR  34  -6.250   2.421  -5.535
  236    HA   THR  34           HA       THR  34  -7.780   4.239  -3.705
  237    HB   THR  34           HB       THR  34  -9.755   3.164  -5.011
  238    HG1  THR  34           HG1      THR  34  -9.180   1.862  -6.456
  239   HG21  THR  34          HG21      THR  34  -9.608   4.904  -6.724
  240   HG22  THR  34          HG22      THR  34  -7.873   5.111  -6.409
  241   HG23  THR  34          HG23      THR  34  -9.058   5.538  -5.164
  242    H    TYR  35           H        TYR  35  -8.485   3.433  -1.717
  243    HA   TYR  35           HA       TYR  35  -8.437   0.514  -1.387
  244    HB2  TYR  35           HB2      TYR  35  -6.698   1.803  -0.165
  245    HB3  TYR  35           HB3      TYR  35  -7.957   2.569   0.769
  246    HD1  TYR  35           HD1      TYR  35  -6.665  -0.818  -0.249
  247    HD2  TYR  35           HD2      TYR  35  -8.454   1.563   2.864
  248    HE1  TYR  35           HE1      TYR  35  -6.020  -2.522   1.435
  249    HE2  TYR  35           HE2      TYR  35  -7.891  -0.167   4.527
  250    HH   TYR  35           HH       TYR  35  -6.785  -2.194   4.909
  251    H    SER  36           H        SER  36  -9.857   0.024   0.828
  252    HA   SER  36           HA       SER  36 -12.404   1.519   0.758
  253    HB2  SER  36           HB2      SER  36 -11.954  -1.496   0.591
  254    HB3  SER  36           HB3      SER  36 -13.525  -0.755   0.910
  255    HG   SER  36           HG       SER  36 -13.070  -1.255  -1.337
  256    H    GLY  37           H        GLY  37 -13.590   1.367   2.809
  257    HA2  GLY  37           HA2      GLY  37 -11.992   1.399   5.133
  258    HA3  GLY  37           HA3      GLY  37 -13.768   1.327   5.069
  259    H    CYS  38           H        CYS  38 -14.456  -0.972   4.043
  260    HA   CYS  38           HA       CYS  38 -13.558  -2.974   5.993
  261    HB2  CYS  38           HB2      CYS  38 -15.697  -3.574   5.734
  262    HB3  CYS  38           HB3      CYS  38 -15.904  -2.478   4.383
  263    H    GLY  39           H        GLY  39 -12.685  -5.042   5.410
  264    HA2  GLY  39           HA2      GLY  39 -11.478  -6.529   4.152
  265    HA3  GLY  39           HA3      GLY  39 -11.919  -5.628   2.701
  266    H    GLY  40           H        GLY  40 -10.027  -5.573   1.707
  267    HA2  GLY  40           HA2      GLY  40  -8.006  -4.601   1.141
  268    HA3  GLY  40           HA3      GLY  40  -8.106  -3.659   2.623
  269    H    ASN  41           H        ASN  41  -5.637  -4.558   1.982
  270    HA   ASN  41           HA       ASN  41  -5.039  -6.578   4.045
  271    HB2  ASN  41           HB2      ASN  41  -4.001  -6.709   1.195
  272    HB3  ASN  41           HB3      ASN  41  -3.073  -7.285   2.523
  273   HD21  ASN  41          HD21      ASN  41  -6.528  -7.891   2.939
  274   HD22  ASN  41          HD22      ASN  41  -6.404  -9.580   2.508
  275    H    ALA  42           H        ALA  42  -2.767  -6.453   4.653
  276    HA   ALA  42           HA       ALA  42  -2.172  -3.944   5.573
  277    HB1  ALA  42           HB1      ALA  42  -0.167  -4.887   6.461
  278    HB2  ALA  42           HB2      ALA  42  -1.451  -6.102   6.521
  279    HB3  ALA  42           HB3      ALA  42  -0.173  -6.184   5.259
  280    H    ASN  43           H        ASN  43  -1.155  -4.854   2.239
  281    HA   ASN  43           HA       ASN  43   1.206  -3.211   2.419
  282    HB2  ASN  43           HB2      ASN  43   1.562  -3.471   0.252
  283    HB3  ASN  43           HB3      ASN  43   0.507  -4.873   0.464
  284   HD21  ASN  43          HD21      ASN  43   1.036  -3.582  -2.131
  285   HD22  ASN  43          HD22      ASN  43  -0.464  -2.796  -2.568
  286    H    ARG  44           H        ARG  44  -1.956  -2.197   2.709
  287    HA   ARG  44           HA       ARG  44  -1.809   0.265   1.225
  288    HB2  ARG  44           HB2      ARG  44  -3.895  -0.884   1.609
  289    HB3  ARG  44           HB3      ARG  44  -3.679  -0.882   3.355
  290    HG2  ARG  44           HG2      ARG  44  -3.623   1.799   2.034
  291    HG3  ARG  44           HG3      ARG  44  -5.143   0.947   1.941
  292    HD2  ARG  44           HD2      ARG  44  -4.999   0.582   4.456
  293    HD3  ARG  44           HD3      ARG  44  -3.678   1.768   4.474
  294    HE   ARG  44           HE       ARG  44  -5.644   3.047   3.074
  295   HH11  ARG  44          HH11      ARG  44  -5.645   1.554   6.289
  296   HH12  ARG  44          HH12      ARG  44  -7.161   2.274   6.766
  297   HH21  ARG  44          HH21      ARG  44  -7.505   4.059   3.688
  298   HH22  ARG  44          HH22      ARG  44  -8.267   3.778   5.221
  299    H    PHE  45           H        PHE  45  -1.045   2.155   1.856
  300    HA   PHE  45           HA       PHE  45  -0.409   2.704   4.710
  301    HB2  PHE  45           HB2      PHE  45   1.088   3.443   2.159
  302    HB3  PHE  45           HB3      PHE  45   1.432   4.176   3.720
  303    HD1  PHE  45           HD1      PHE  45   2.368   2.870   5.584
  304    HD2  PHE  45           HD2      PHE  45   1.742   1.149   1.678
  305    HE1  PHE  45           HE1      PHE  45   3.701   0.934   6.242
  306    HE2  PHE  45           HE2      PHE  45   3.135  -0.780   2.312
  307    HZ   PHE  45           HZ       PHE  45   4.199  -0.848   4.578
  308    H    ARG  46           H        ARG  46  -0.195   5.067   5.084
  309    HA   ARG  46           HA       ARG  46  -2.416   6.589   3.783
  310    HB2  ARG  46           HB2      ARG  46  -2.151   8.121   5.855
  311    HB3  ARG  46           HB3      ARG  46  -3.032   6.620   5.961
  312    HG2  ARG  46           HG2      ARG  46  -1.586   7.138   7.921
  313    HG3  ARG  46           HG3      ARG  46  -1.398   5.549   7.225
  314    HD2  ARG  46           HD2      ARG  46   0.747   6.318   7.837
  315    HD3  ARG  46           HD3      ARG  46   0.745   6.371   6.098
  316    HE   ARG  46           HE       ARG  46   0.624   8.727   6.107
  317   HH11  ARG  46          HH11      ARG  46   1.191   7.313   9.373
  318   HH12  ARG  46          HH12      ARG  46   1.912   8.757   9.972
  319   HH21  ARG  46          HH21      ARG  46   1.345  10.700   7.076
  320   HH22  ARG  46          HH22      ARG  46   2.148  10.659   8.619
  321    H    THR  47           H        THR  47   0.986   6.392   3.839
  322    HA   THR  47           HA       THR  47   1.101   8.688   2.182
  323    HB   THR  47           HB       THR  47   1.228   9.680   4.511
  324    HG1  THR  47           HG1      THR  47   2.034  10.888   2.876
  325   HG21  THR  47          HG21      THR  47   2.676   7.760   5.424
  326   HG22  THR  47          HG22      THR  47   3.280   9.404   5.789
  327   HG23  THR  47          HG23      THR  47   3.986   8.430   4.507
  328    H    ILE  48           H        ILE  48   3.133   8.901   1.052
  329    HA   ILE  48           HA       ILE  48   4.315   6.331   0.536
  330    HB   ILE  48           HB       ILE  48   4.087   7.784  -1.280
  331   HG12  ILE  48          HG12      ILE  48   7.061   7.751  -0.633
  332   HG13  ILE  48          HG13      ILE  48   6.147   6.329  -1.020
  333   HG21  ILE  48          HG21      ILE  48   5.799   9.867   0.163
  334   HG22  ILE  48          HG22      ILE  48   5.230   9.984  -1.510
  335   HG23  ILE  48          HG23      ILE  48   4.063  10.010  -0.200
  336   HD11  ILE  48          HD11      ILE  48   5.474   7.341  -3.221
  337   HD12  ILE  48          HD12      ILE  48   6.575   8.695  -2.877
  338   HD13  ILE  48          HD13      ILE  48   7.210   7.048  -3.043
  339    H    ASP  49           H        ASP  49   5.026   8.997   2.718
  340    HA   ASP  49           HA       ASP  49   7.798   8.514   3.152
  341    HB2  ASP  49           HB2      ASP  49   6.811  10.565   3.855
  342    HB3  ASP  49           HB3      ASP  49   5.680   9.736   4.927
  343    H    GLU  50           H        GLU  50   4.883   7.003   4.588
  344    HA   GLU  50           HA       GLU  50   6.356   5.497   6.571
  345    HB2  GLU  50           HB2      GLU  50   3.501   5.558   5.498
  346    HB3  GLU  50           HB3      GLU  50   4.033   4.296   6.607
  347    HG2  GLU  50           HG2      GLU  50   4.505   7.202   7.345
  348    HG3  GLU  50           HG3      GLU  50   2.917   6.470   7.542
  349    H    CYS  51           H        CYS  51   4.683   4.977   3.474
  350    HA   CYS  51           HA       CYS  51   5.177   2.255   3.229
  351    HB2  CYS  51           HB2      CYS  51   3.557   3.361   1.871
  352    HB3  CYS  51           HB3      CYS  51   4.769   4.443   1.175
  353    H    ASN  52           H        ASN  52   7.225   4.958   1.993
  354    HA   ASN  52           HA       ASN  52   9.108   3.151   0.921
  355    HB2  ASN  52           HB2      ASN  52  10.269   4.902   0.096
  356    HB3  ASN  52           HB3      ASN  52   8.651   5.577   0.203
  357   HD21  ASN  52          HD21      ASN  52   8.444   7.489   1.226
  358   HD22  ASN  52          HD22      ASN  52   9.729   8.336   2.062
  359    H    ARG  53           H        ARG  53   9.275   5.229   3.807
  360    HA   ARG  53           HA       ARG  53  11.650   4.172   4.694
  361    HB2  ARG  53           HB2      ARG  53  11.371   5.148   6.757
  362    HB3  ARG  53           HB3      ARG  53  10.340   6.124   5.699
  363    HG2  ARG  53           HG2      ARG  53   8.383   4.755   6.558
  364    HG3  ARG  53           HG3      ARG  53   9.471   4.010   7.728
  365    HD2  ARG  53           HD2      ARG  53   8.893   6.996   7.494
  366    HD3  ARG  53           HD3      ARG  53   8.191   5.896   8.693
  367    HE   ARG  53           HE       ARG  53  11.039   5.702   8.764
  368   HH11  ARG  53          HH11      ARG  53   8.357   7.728   9.992
  369   HH12  ARG  53          HH12      ARG  53   9.366   8.516  11.151
  370   HH21  ARG  53          HH21      ARG  53  12.347   6.875  10.168
  371   HH22  ARG  53          HH22      ARG  53  11.669   7.808  11.446
  372    H    THR  54           H        THR  54   8.613   2.428   4.992
  373    HA   THR  54           HA       THR  54   9.946   0.494   6.786
  374    HB   THR  54           HB       THR  54   7.698   1.561   7.188
  375    HG1  THR  54           HG1      THR  54   8.480  -0.315   8.311
  376   HG21  THR  54          HG21      THR  54   6.529  -0.675   5.565
  377   HG22  THR  54          HG22      THR  54   6.875   0.889   4.772
  378   HG23  THR  54          HG23      THR  54   5.809   0.861   6.159
  379    H    CYS  55           H        CYS  55   9.195   0.672   3.324
  380    HA   CYS  55           HA       CYS  55  10.043  -2.185   3.177
  381    HB2  CYS  55           HB2      CYS  55   7.750  -0.970   1.628
  382    HB3  CYS  55           HB3      CYS  55   8.335  -2.624   1.476
  383    H    VAL  56           H        VAL  56  10.409   0.997   1.808
  384    HA   VAL  56           HA       VAL  56  11.598  -0.071  -0.687
  385    HB   VAL  56           HB       VAL  56  11.371   2.694   0.499
  386   HG11  VAL  56          HG11      VAL  56  12.225   3.635  -1.521
  387   HG12  VAL  56          HG12      VAL  56  13.470   2.704  -0.699
  388   HG13  VAL  56          HG13      VAL  56  12.659   2.027  -2.134
  389   HG21  VAL  56          HG21      VAL  56  10.218   1.452  -2.037
  390   HG22  VAL  56          HG22      VAL  56   9.305   1.698  -0.541
  391   HG23  VAL  56          HG23      VAL  56   9.899   3.086  -1.441
  392    H    GLY  57           H        GLY  57  13.169  -1.492  -0.054
  393    HA2  GLY  57           HA2      GLY  57  15.113  -0.873   2.027
  394    HA3  GLY  57           HA3      GLY  57  14.997  -2.330   1.026
  Start of MODEL    2
    1    H1   ARG   1           H        ARG   1  13.184  -4.918   2.857
    2    HA   ARG   1           HA       ARG   1  10.892  -4.218   3.163
    3    HB2  ARG   1           HB2      ARG   1  10.573  -6.177   0.905
    4    HB3  ARG   1           HB3      ARG   1  10.103  -4.473   1.028
    5    HG2  ARG   1           HG2      ARG   1  12.348  -3.740   0.510
    6    HG3  ARG   1           HG3      ARG   1  12.991  -5.378   0.659
    7    HD2  ARG   1           HD2      ARG   1  11.925  -6.198  -1.197
    8    HD3  ARG   1           HD3      ARG   1  10.851  -4.809  -1.380
    9    HE   ARG   1           HE       ARG   1  13.595  -3.961  -1.516
   10   HH11  ARG   1          HH11      ARG   1  11.577  -6.157  -3.409
   11   HH12  ARG   1          HH12      ARG   1  12.361  -5.796  -4.915
   12   HH21  ARG   1          HH21      ARG   1  14.553  -3.363  -3.476
   13   HH22  ARG   1          HH22      ARG   1  14.027  -4.131  -4.943
   14    HA   PRO   2           HA       PRO   2   9.013  -7.541   5.535
   15    HB2  PRO   2           HB2      PRO   2   6.756  -6.277   6.360
   16    HB3  PRO   2           HB3      PRO   2   8.368  -5.922   7.046
   17    HG2  PRO   2           HG2      PRO   2   6.902  -4.404   4.870
   18    HG3  PRO   2           HG3      PRO   2   7.731  -3.736   6.313
   19    HD2  PRO   2           HD2      PRO   2   8.970  -3.797   3.892
   20    HD3  PRO   2           HD3      PRO   2   9.865  -4.135   5.395
   21    H    ARG   3           H        ARG   3   7.387  -9.084   5.255
   22    HA   ARG   3           HA       ARG   3   6.426  -9.382   2.589
   23    HB2  ARG   3           HB2      ARG   3   5.660 -11.477   3.223
   24    HB3  ARG   3           HB3      ARG   3   7.067 -11.182   4.223
   25    HG2  ARG   3           HG2      ARG   3   5.791 -11.894   5.938
   26    HG3  ARG   3           HG3      ARG   3   5.082 -10.289   5.917
   27    HD2  ARG   3           HD2      ARG   3   3.209 -11.760   5.873
   28    HD3  ARG   3           HD3      ARG   3   3.376 -11.235   4.200
   29    HE   ARG   3           HE       ARG   3   3.992 -13.358   3.549
   30   HH11  ARG   3          HH11      ARG   3   4.075 -13.219   7.115
   31   HH12  ARG   3          HH12      ARG   3   4.300 -14.925   7.305
   32   HH21  ARG   3          HH21      ARG   3   4.108 -15.658   3.826
   33   HH22  ARG   3          HH22      ARG   3   4.204 -16.341   5.411
   34    H    PHE   4           H        PHE   4   4.930  -7.792   5.338
   35    HA   PHE   4           HA       PHE   4   2.239  -8.115   4.394
   36    HB2  PHE   4           HB2      PHE   4   1.627  -6.522   6.023
   37    HB3  PHE   4           HB3      PHE   4   2.860  -7.523   6.726
   38    HD1  PHE   4           HD2      PHE   4   2.356  -4.225   4.959
   39    HD2  PHE   4           HD1      PHE   4   4.670  -6.488   7.813
   40    HE1  PHE   4           HE2      PHE   4   3.715  -2.196   5.482
   41    HE2  PHE   4           HE1      PHE   4   5.963  -4.448   8.371
   42    HZ   PHE   4           HZ       PHE   4   5.478  -2.296   7.221
   43    H    CYS   5           H        CYS   5   4.897  -5.981   3.405
   44    HA   CYS   5           HA       CYS   5   3.220  -4.012   2.160
   45    HB2  CYS   5           HB2      CYS   5   6.029  -4.453   2.685
   46    HB3  CYS   5           HB3      CYS   5   5.838  -4.103   0.983
   47    H    GLU   6           H        GLU   6   4.043  -7.255   1.212
   48    HA   GLU   6           HA       GLU   6   3.676  -6.507  -1.654
   49    HB2  GLU   6           HB2      GLU   6   4.911  -8.360  -2.245
   50    HB3  GLU   6           HB3      GLU   6   5.751  -7.559  -0.925
   51    HG2  GLU   6           HG2      GLU   6   5.232  -9.243   0.623
   52    HG3  GLU   6           HG3      GLU   6   4.116 -10.049  -0.490
   53    H    LEU   7           H        LEU   7   1.452  -6.894   0.432
   54    HA   LEU   7           HA       LEU   7   0.086  -9.270  -0.596
   55    HB2  LEU   7           HB2      LEU   7  -0.843  -7.175   1.387
   56    HB3  LEU   7           HB3      LEU   7  -1.618  -8.731   1.050
   57    HG   LEU   7           HG       LEU   7   1.074  -8.249   2.377
   58   HD11  LEU   7          HD11      LEU   7  -0.952  -7.750   3.721
   59   HD12  LEU   7          HD12      LEU   7  -0.031  -9.109   4.384
   60   HD13  LEU   7          HD13      LEU   7  -1.524  -9.407   3.467
   61   HD21  LEU   7          HD21      LEU   7   1.235 -10.348   1.144
   62   HD22  LEU   7          HD22      LEU   7  -0.252 -10.934   1.961
   63   HD23  LEU   7          HD23      LEU   7   1.225 -10.582   2.888
   64    H    ALA   8           H        ALA   8  -2.247  -8.965  -1.211
   65    HA   ALA   8           HA       ALA   8  -2.458  -6.877  -3.312
   66    HB1  ALA   8           HB1      ALA   8  -2.706  -9.182  -4.067
   67    HB2  ALA   8           HB2      ALA   8  -4.015  -9.451  -2.891
   68    HB3  ALA   8           HB3      ALA   8  -4.241  -8.309  -4.230
   69    HA   PRO   9           HA       PRO   9  -5.147  -5.022  -0.228
   70    HB2  PRO   9           HB2      PRO   9  -5.931  -2.748  -1.544
   71    HB3  PRO   9           HB3      PRO   9  -4.354  -2.972  -0.714
   72    HG2  PRO   9           HG2      PRO   9  -5.000  -3.261  -3.656
   73    HG3  PRO   9           HG3      PRO   9  -3.592  -2.464  -2.874
   74    HD2  PRO   9           HD2      PRO   9  -3.511  -5.014  -3.906
   75    HD3  PRO   9           HD3      PRO   9  -2.523  -4.524  -2.504
   76    H    SER  10           H        SER  10  -6.882  -6.389  -0.088
   77    HA   SER  10           HA       SER  10  -8.793  -6.903  -2.120
   78    HB2  SER  10           HB2      SER  10  -8.045  -8.433  -0.262
   79    HB3  SER  10           HB3      SER  10  -9.012  -7.470   0.857
   80    HG   SER  10           HG       SER  10 -10.206  -9.239   0.098
   81    H    ALA  11           H        ALA  11  -8.879  -4.250  -2.169
   82    HA   ALA  11           HA       ALA  11 -10.692  -2.911  -0.427
   83    HB1  ALA  11           HB1      ALA  11  -9.695  -2.271  -3.235
   84    HB2  ALA  11           HB2      ALA  11 -10.629  -1.151  -2.230
   85    HB3  ALA  11           HB3      ALA  11  -9.027  -1.694  -1.701
   86    H    GLY  12           H        GLY  12 -11.380  -5.076  -3.110
   87    HA2  GLY  12           HA2      GLY  12 -13.950  -3.974  -3.778
   88    HA3  GLY  12           HA3      GLY  12 -13.349  -5.589  -4.179
   89    H    SER  13           H        SER  13 -13.001  -5.480  -0.929
   90    HA   SER  13           HA       SER  13 -15.106  -7.266  -0.359
   91    HB2  SER  13           HB2      SER  13 -13.463  -5.539   1.518
   92    HB3  SER  13           HB3      SER  13 -14.416  -6.958   1.986
   93    HG   SER  13           HG       SER  13 -12.093  -6.867   0.342
   94    H    CYS  14           H        CYS  14 -14.995  -3.690   0.083
   95    HA   CYS  14           HA       CYS  14 -17.912  -3.697   0.584
   96    HB2  CYS  14           HB2      CYS  14 -15.846  -2.351   2.370
   97    HB3  CYS  14           HB3      CYS  14 -17.544  -1.919   2.324
   98    H    PHE  15           H        PHE  15 -18.778  -1.410   0.370
   99    HA   PHE  15           HA       PHE  15 -17.368  -0.198  -1.946
  100    HB2  PHE  15           HB2      PHE  15 -19.784  -0.953  -2.077
  101    HB3  PHE  15           HB3      PHE  15 -20.178   0.359  -0.967
  102    HD1  PHE  15           HD1      PHE  15 -19.246   2.792  -1.697
  103    HD2  PHE  15           HD2      PHE  15 -19.810  -0.556  -4.377
  104    HE1  PHE  15           HE1      PHE  15 -19.122   4.312  -3.614
  105    HE2  PHE  15           HE2      PHE  15 -19.854   1.011  -6.296
  106    HZ   PHE  15           HZ       PHE  15 -19.520   3.437  -5.924
  107    H    ALA  16           H        ALA  16 -15.909   1.295  -1.263
  108    HA   ALA  16           HA       ALA  16 -16.873   3.574   0.253
  109    HB1  ALA  16           HB1      ALA  16 -14.438   2.016   1.175
  110    HB2  ALA  16           HB2      ALA  16 -15.059   3.509   1.890
  111    HB3  ALA  16           HB3      ALA  16 -16.000   1.995   2.012
  112    H    PHE  17           H        PHE  17 -15.084   5.290   0.166
  113    HA   PHE  17           HA       PHE  17 -13.282   4.910  -2.177
  114    HB2  PHE  17           HB2      PHE  17 -15.516   6.101  -2.665
  115    HB3  PHE  17           HB3      PHE  17 -14.851   7.471  -1.797
  116    HD1  PHE  17           HD2      PHE  17 -11.907   7.233  -2.786
  117    HD2  PHE  17           HD1      PHE  17 -15.691   6.953  -4.852
  118    HE1  PHE  17           HE2      PHE  17 -10.810   7.875  -4.873
  119    HE2  PHE  17           HE1      PHE  17 -14.583   7.730  -6.930
  120    HZ   PHE  17           HZ       PHE  17 -12.144   8.188  -6.944
  121    H    VAL  18           H        VAL  18 -11.398   4.766  -0.956
  122    HA   VAL  18           HA       VAL  18 -10.663   7.203   0.533
  123    HB   VAL  18           HB       VAL  18  -9.577   5.689   2.277
  124   HG11  VAL  18          HG11      VAL  18 -11.493   7.240   2.660
  125   HG12  VAL  18          HG12      VAL  18 -12.614   5.915   2.315
  126   HG13  VAL  18          HG13      VAL  18 -11.517   5.822   3.706
  127   HG21  VAL  18          HG21      VAL  18 -10.787   3.616   2.856
  128   HG22  VAL  18          HG22      VAL  18 -11.783   3.761   1.395
  129   HG23  VAL  18          HG23      VAL  18 -10.033   3.464   1.267
  130    HA   PRO  19           HA       PRO  19  -7.538   5.918  -2.533
  131    HB2  PRO  19           HB2      PRO  19  -6.228   8.337  -2.788
  132    HB3  PRO  19           HB3      PRO  19  -7.699   7.876  -3.704
  133    HG2  PRO  19           HG2      PRO  19  -7.524   9.518  -1.167
  134    HG3  PRO  19           HG3      PRO  19  -8.454   9.853  -2.659
  135    HD2  PRO  19           HD2      PRO  19  -9.597   8.723  -0.461
  136    HD3  PRO  19           HD3      PRO  19 -10.077   8.207  -2.109
  137    H    SER  20           H        SER  20  -5.814   4.889  -1.816
  138    HA   SER  20           HA       SER  20  -4.374   5.921   0.585
  139    HB2  SER  20           HB2      SER  20  -5.063   3.031   0.096
  140    HB3  SER  20           HB3      SER  20  -4.217   3.732   1.493
  141    HG   SER  20           HG       SER  20  -6.854   4.456   0.693
  142    H    TYR  21           H        TYR  21  -2.152   4.228   0.696
  143    HA   TYR  21           HA       TYR  21  -0.948   4.606  -2.030
  144    HB2  TYR  21           HB2      TYR  21   0.032   5.062   0.701
  145    HB3  TYR  21           HB3      TYR  21   1.192   4.384  -0.462
  146    HD1  TYR  21           HD2      TYR  21   2.105   5.727  -2.330
  147    HD2  TYR  21           HD1      TYR  21  -0.676   7.321   0.561
  148    HE1  TYR  21           HE2      TYR  21   2.558   7.993  -3.156
  149    HE2  TYR  21           HE1      TYR  21  -0.051   9.583  -0.078
  150    HH   TYR  21           HH       TYR  21   1.517  10.903  -1.358
  151    H    TYR  22           H        TYR  22  -0.017   3.019  -3.001
  152    HA   TYR  22           HA       TYR  22  -0.163   0.251  -2.000
  153    HB2  TYR  22           HB2      TYR  22  -1.181   1.305  -4.261
  154    HB3  TYR  22           HB3      TYR  22   0.482   1.280  -4.804
  155    HD1  TYR  22           HD1      TYR  22   1.687  -1.018  -4.985
  156    HD2  TYR  22           HD2      TYR  22  -2.549  -0.588  -4.314
  157    HE1  TYR  22           HE1      TYR  22   1.390  -3.355  -5.548
  158    HE2  TYR  22           HE2      TYR  22  -2.903  -2.859  -5.110
  159    HH   TYR  22           HH       TYR  22  -1.922  -4.753  -6.009
  160    H    TYR  23           H        TYR  23   1.723  -1.029  -2.443
  161    HA   TYR  23           HA       TYR  23   4.345   0.435  -2.620
  162    HB2  TYR  23           HB2      TYR  23   4.104  -0.498  -0.402
  163    HB3  TYR  23           HB3      TYR  23   3.652  -2.068  -1.063
  164    HD1  TYR  23           HD1      TYR  23   6.469   0.458  -1.209
  165    HD2  TYR  23           HD2      TYR  23   5.344  -3.702  -1.533
  166    HE1  TYR  23           HE1      TYR  23   8.836  -0.179  -1.351
  167    HE2  TYR  23           HE2      TYR  23   7.728  -4.329  -1.501
  168    HH   TYR  23           HH       TYR  23  10.259  -2.331  -0.826
  169    H    ASN  24           H        ASN  24   5.711  -0.180  -4.258
  170    HA   ASN  24           HA       ASN  24   5.052  -2.691  -5.754
  171    HB2  ASN  24           HB2      ASN  24   5.821   0.034  -6.868
  172    HB3  ASN  24           HB3      ASN  24   5.930  -1.466  -7.787
  173   HD21  ASN  24          HD21      ASN  24   4.165   0.960  -8.198
  174   HD22  ASN  24          HD22      ASN  24   2.524   0.318  -8.189
  175    H    GLN  25           H        GLN  25   6.600  -3.862  -4.622
  176    HA   GLN  25           HA       GLN  25   9.274  -3.194  -4.118
  177    HB2  GLN  25           HB2      GLN  25   9.682  -5.754  -4.497
  178    HB3  GLN  25           HB3      GLN  25   8.806  -5.209  -3.108
  179    HG2  GLN  25           HG2      GLN  25   7.462  -6.200  -5.672
  180    HG3  GLN  25           HG3      GLN  25   7.916  -7.241  -4.318
  181   HE21  GLN  25          HE21      GLN  25   5.182  -5.597  -5.519
  182   HE22  GLN  25          HE22      GLN  25   4.441  -5.235  -4.005
  183    H    TYR  26           H        TYR  26   7.840  -4.481  -7.095
  184    HA   TYR  26           HA       TYR  26  10.043  -5.143  -8.604
  185    HB2  TYR  26           HB2      TYR  26   7.590  -3.622  -9.598
  186    HB3  TYR  26           HB3      TYR  26   8.631  -4.674 -10.536
  187    HD1  TYR  26           HD2      TYR  26   8.625  -7.163 -10.120
  188    HD2  TYR  26           HD1      TYR  26   5.745  -4.517  -8.285
  189    HE1  TYR  26           HE2      TYR  26   7.140  -9.092  -9.686
  190    HE2  TYR  26           HE1      TYR  26   4.277  -6.461  -7.818
  191    HH   TYR  26           HH       TYR  26   3.875  -8.741  -8.260
  192    H    SER  27           H        SER  27   8.792  -1.897  -7.900
  193    HA   SER  27           HA       SER  27  10.967  -0.648  -9.488
  194    HB2  SER  27           HB2      SER  27   8.521  -0.377 -10.137
  195    HB3  SER  27           HB3      SER  27   8.290   0.502  -8.631
  196    HG   SER  27           HG       SER  27   8.660   1.767 -10.507
  197    H    ASN  28           H        ASN  28  10.506  -1.569  -6.425
  198    HA   ASN  28           HA       ASN  28  10.979  -0.874  -4.356
  199    HB2  ASN  28           HB2      ASN  28  13.192  -1.264  -5.473
  200    HB3  ASN  28           HB3      ASN  28  13.290   0.464  -5.800
  201   HD21  ASN  28          HD21      ASN  28  12.415  -1.519  -2.828
  202   HD22  ASN  28          HD22      ASN  28  13.705  -0.744  -1.899
  203    H    THR  29           H        THR  29   8.884   0.564  -5.078
  204    HA   THR  29           HA       THR  29   9.319   3.074  -3.739
  205    HB   THR  29           HB       THR  29   9.933   3.461  -6.181
  206    HG1  THR  29           HG1      THR  29   9.260   5.418  -6.036
  207   HG21  THR  29          HG21      THR  29   6.923   3.349  -6.650
  208   HG22  THR  29          HG22      THR  29   8.109   2.178  -7.265
  209   HG23  THR  29          HG23      THR  29   8.161   3.868  -7.791
  210    H    CYS  30           H        CYS  30   6.945   4.299  -4.125
  211    HA   CYS  30           HA       CYS  30   4.817   2.302  -3.612
  212    HB2  CYS  30           HB2      CYS  30   5.122   4.926  -2.152
  213    HB3  CYS  30           HB3      CYS  30   4.016   3.623  -1.765
  214    H    HIS  31           H        HIS  31   2.662   3.296  -4.096
  215    HA   HIS  31           HA       HIS  31   2.738   5.799  -5.646
  216    HB2  HIS  31           HB2      HIS  31   3.324   3.681  -7.097
  217    HB3  HIS  31           HB3      HIS  31   1.627   3.260  -6.901
  218    HD1  HIS  31           HD1      HIS  31   0.655   3.858  -9.297
  219    HD2  HIS  31           HD2      HIS  31   3.357   6.656  -7.658
  220    HE1  HIS  31           HE1      HIS  31   0.881   5.706 -11.024
  221    H    SER  32           H        SER  32   0.723   6.895  -5.505
  222    HA   SER  32           HA       SER  32  -1.126   5.877  -3.576
  223    HB2  SER  32           HB2      SER  32  -2.516   7.794  -4.386
  224    HB3  SER  32           HB3      SER  32  -0.946   8.167  -3.674
  225    HG   SER  32           HG       SER  32  -0.548   9.227  -5.409
  226    H    PHE  33           H        PHE  33  -3.183   5.005  -3.829
  227    HA   PHE  33           HA       PHE  33  -4.216   4.275  -6.465
  228    HB2  PHE  33           HB2      PHE  33  -4.180   1.982  -6.236
  229    HB3  PHE  33           HB3      PHE  33  -2.593   2.431  -5.649
  230    HD1  PHE  33           HD2      PHE  33  -2.489   2.817  -2.986
  231    HD2  PHE  33           HD1      PHE  33  -5.396   0.396  -5.016
  232    HE1  PHE  33           HE2      PHE  33  -3.032   1.652  -0.840
  233    HE2  PHE  33           HE1      PHE  33  -5.901  -0.772  -2.924
  234    HZ   PHE  33           HZ       PHE  33  -4.672  -0.128  -0.798
  235    H    THR  34           H        THR  34  -6.323   2.742  -5.840
  236    HA   THR  34           HA       THR  34  -7.941   4.453  -4.004
  237    HB   THR  34           HB       THR  34  -9.840   3.342  -5.317
  238    HG1  THR  34           HG1      THR  34  -7.818   3.058  -7.302
  239   HG21  THR  34          HG21      THR  34  -9.716   5.035  -7.090
  240   HG22  THR  34          HG22      THR  34  -7.986   5.292  -6.755
  241   HG23  THR  34          HG23      THR  34  -9.207   5.726  -5.546
  242    H    TYR  35           H        TYR  35  -8.664   3.596  -2.085
  243    HA   TYR  35           HA       TYR  35  -8.603   0.652  -1.842
  244    HB2  TYR  35           HB2      TYR  35  -6.713   1.841  -0.751
  245    HB3  TYR  35           HB3      TYR  35  -7.891   2.633   0.287
  246    HD1  TYR  35           HD1      TYR  35  -6.843  -0.859  -0.711
  247    HD2  TYR  35           HD2      TYR  35  -8.242   1.773   2.407
  248    HE1  TYR  35           HE1      TYR  35  -6.318  -2.581   0.989
  249    HE2  TYR  35           HE2      TYR  35  -7.751   0.057   4.091
  250    HH   TYR  35           HH       TYR  35  -6.710  -1.961   4.493
  251    H    SER  36           H        SER  36  -9.944   0.070   0.342
  252    HA   SER  36           HA       SER  36 -12.417   1.685   0.454
  253    HB2  SER  36           HB2      SER  36 -12.623  -0.305  -1.050
  254    HB3  SER  36           HB3      SER  36 -12.260  -1.342   0.346
  255    HG   SER  36           HG       SER  36 -14.523  -0.969  -0.228
  256    H    GLY  37           H        GLY  37 -13.738   0.850   2.478
  257    HA2  GLY  37           HA2      GLY  37 -12.051   1.265   4.780
  258    HA3  GLY  37           HA3      GLY  37 -13.791   0.983   4.781
  259    H    CYS  38           H        CYS  38 -14.460  -1.320   4.273
  260    HA   CYS  38           HA       CYS  38 -13.092  -3.059   6.139
  261    HB2  CYS  38           HB2      CYS  38 -14.957  -4.253   6.148
  262    HB3  CYS  38           HB3      CYS  38 -15.649  -2.871   5.345
  263    H    GLY  39           H        GLY  39 -12.727  -5.440   5.482
  264    HA2  GLY  39           HA2      GLY  39 -11.429  -6.976   4.361
  265    HA3  GLY  39           HA3      GLY  39 -11.890  -6.149   2.859
  266    H    GLY  40           H        GLY  40 -10.097  -5.753   1.746
  267    HA2  GLY  40           HA2      GLY  40  -8.079  -4.778   1.182
  268    HA3  GLY  40           HA3      GLY  40  -8.178  -3.882   2.688
  269    H    ASN  41           H        ASN  41  -5.669  -4.729   1.935
  270    HA   ASN  41           HA       ASN  41  -5.010  -6.752   3.990
  271    HB2  ASN  41           HB2      ASN  41  -4.068  -6.920   1.109
  272    HB3  ASN  41           HB3      ASN  41  -3.087  -7.456   2.436
  273   HD21  ASN  41          HD21      ASN  41  -6.529  -8.105   3.005
  274   HD22  ASN  41          HD22      ASN  41  -6.366  -9.799   2.647
  275    H    ALA  42           H        ALA  42  -2.778  -6.544   4.660
  276    HA   ALA  42           HA       ALA  42  -2.209  -3.971   5.415
  277    HB1  ALA  42           HB1      ALA  42  -1.499  -5.968   6.594
  278    HB2  ALA  42           HB2      ALA  42  -0.342  -6.330   5.276
  279    HB3  ALA  42           HB3      ALA  42  -0.122  -4.891   6.291
  280    H    ASN  43           H        ASN  43  -1.329  -4.978   2.092
  281    HA   ASN  43           HA       ASN  43   1.137  -3.472   2.234
  282    HB2  ASN  43           HB2      ASN  43   1.431  -3.607   0.068
  283    HB3  ASN  43           HB3      ASN  43   0.378  -5.008   0.240
  284   HD21  ASN  43          HD21      ASN  43   1.038  -3.349  -2.189
  285   HD22  ASN  43          HD22      ASN  43  -0.527  -2.738  -2.695
  286    H    ARG  44           H        ARG  44  -2.170  -2.468   2.239
  287    HA   ARG  44           HA       ARG  44  -1.767   0.128   1.117
  288    HB2  ARG  44           HB2      ARG  44  -3.941  -0.945   1.164
  289    HB3  ARG  44           HB3      ARG  44  -3.923  -1.083   2.924
  290    HG2  ARG  44           HG2      ARG  44  -3.602   1.660   1.711
  291    HG3  ARG  44           HG3      ARG  44  -5.168   0.902   1.624
  292    HD2  ARG  44           HD2      ARG  44  -5.059   0.555   4.158
  293    HD3  ARG  44           HD3      ARG  44  -3.651   1.636   4.161
  294    HE   ARG  44           HE       ARG  44  -5.663   2.920   2.702
  295   HH11  ARG  44          HH11      ARG  44  -5.154   1.988   6.103
  296   HH12  ARG  44          HH12      ARG  44  -6.366   3.091   6.686
  297   HH21  ARG  44          HH21      ARG  44  -7.120   4.348   3.448
  298   HH22  ARG  44          HH22      ARG  44  -7.678   4.328   5.102
  299    H    PHE  45           H        PHE  45  -0.897   1.846   2.021
  300    HA   PHE  45           HA       PHE  45  -1.000   2.245   4.937
  301    HB2  PHE  45           HB2      PHE  45   1.515   2.118   3.373
  302    HB3  PHE  45           HB3      PHE  45   1.347   3.386   4.588
  303    HD1  PHE  45           HD2      PHE  45   0.873  -0.344   4.219
  304    HD2  PHE  45           HD1      PHE  45   1.962   2.962   6.787
  305    HE1  PHE  45           HE2      PHE  45   1.366  -1.911   6.042
  306    HE2  PHE  45           HE1      PHE  45   2.544   1.365   8.571
  307    HZ   PHE  45           HZ       PHE  45   2.265  -1.079   8.203
  308    H    ARG  46           H        ARG  46  -0.002   4.839   4.923
  309    HA   ARG  46           HA       ARG  46  -2.194   6.230   3.442
  310    HB2  ARG  46           HB2      ARG  46  -2.073   7.787   5.531
  311    HB3  ARG  46           HB3      ARG  46  -2.908   6.254   5.612
  312    HG2  ARG  46           HG2      ARG  46  -1.522   6.754   7.620
  313    HG3  ARG  46           HG3      ARG  46  -1.199   5.200   6.875
  314    HD2  ARG  46           HD2      ARG  46   0.859   6.185   7.594
  315    HD3  ARG  46           HD3      ARG  46   0.880   6.152   5.855
  316    HE   ARG  46           HE       ARG  46   0.553   8.492   5.743
  317   HH11  ARG  46          HH11      ARG  46   1.172   7.292   9.082
  318   HH12  ARG  46          HH12      ARG  46   1.721   8.833   9.619
  319   HH21  ARG  46          HH21      ARG  46   1.026  10.606   6.636
  320   HH22  ARG  46          HH22      ARG  46   1.675  10.670   8.228
  321    H    THR  47           H        THR  47   1.172   6.109   3.594
  322    HA   THR  47           HA       THR  47   1.280   8.454   2.012
  323    HB   THR  47           HB       THR  47   1.276   9.568   4.272
  324    HG1  THR  47           HG1      THR  47   3.094  10.904   3.652
  325   HG21  THR  47          HG21      THR  47   4.112   8.522   4.476
  326   HG22  THR  47          HG22      THR  47   2.805   7.744   5.325
  327   HG23  THR  47          HG23      THR  47   3.227   9.444   5.689
  328    H    ILE  48           H        ILE  48   3.158   8.684   0.815
  329    HA   ILE  48           HA       ILE  48   4.604   6.274   0.412
  330    HB   ILE  48           HB       ILE  48   4.234   7.812  -1.330
  331   HG12  ILE  48          HG12      ILE  48   7.219   7.694  -0.791
  332   HG13  ILE  48          HG13      ILE  48   6.272   6.338  -1.276
  333   HG21  ILE  48          HG21      ILE  48   4.285   9.993  -0.117
  334   HG22  ILE  48          HG22      ILE  48   6.046   9.839   0.061
  335   HG23  ILE  48          HG23      ILE  48   5.307  10.024  -1.537
  336   HD11  ILE  48          HD11      ILE  48   5.492   7.610  -3.332
  337   HD12  ILE  48          HD12      ILE  48   6.708   8.843  -2.934
  338   HD13  ILE  48          HD13      ILE  48   7.200   7.186  -3.308
  339    H    ASP  49           H        ASP  49   5.136   8.995   2.628
  340    HA   ASP  49           HA       ASP  49   7.929   8.534   3.037
  341    HB2  ASP  49           HB2      ASP  49   6.911  10.598   3.769
  342    HB3  ASP  49           HB3      ASP  49   5.878   9.744   4.898
  343    H    GLU  50           H        GLU  50   5.039   7.156   4.671
  344    HA   GLU  50           HA       GLU  50   6.535   5.677   6.609
  345    HB2  GLU  50           HB2      GLU  50   3.675   5.644   5.576
  346    HB3  GLU  50           HB3      GLU  50   4.223   4.491   6.781
  347    HG2  GLU  50           HG2      GLU  50   4.652   7.461   7.272
  348    HG3  GLU  50           HG3      GLU  50   3.075   6.719   7.523
  349    H    CYS  51           H        CYS  51   5.017   5.066   3.441
  350    HA   CYS  51           HA       CYS  51   5.442   2.262   3.466
  351    HB2  CYS  51           HB2      CYS  51   3.778   3.116   2.107
  352    HB3  CYS  51           HB3      CYS  51   4.838   4.298   1.322
  353    H    ASN  52           H        ASN  52   7.329   4.978   2.026
  354    HA   ASN  52           HA       ASN  52   9.218   3.195   0.915
  355    HB2  ASN  52           HB2      ASN  52  10.363   4.941   0.012
  356    HB3  ASN  52           HB3      ASN  52   8.746   5.579   0.104
  357   HD21  ASN  52          HD21      ASN  52   8.604   7.573   0.953
  358   HD22  ASN  52          HD22      ASN  52   9.844   8.434   1.828
  359    H    ARG  53           H        ARG  53   9.352   5.276   3.750
  360    HA   ARG  53           HA       ARG  53  11.804   4.256   4.649
  361    HB2  ARG  53           HB2      ARG  53  11.537   5.303   6.685
  362    HB3  ARG  53           HB3      ARG  53  10.537   6.247   5.577
  363    HG2  ARG  53           HG2      ARG  53   8.562   4.878   6.451
  364    HG3  ARG  53           HG3      ARG  53   9.622   4.316   7.742
  365    HD2  ARG  53           HD2      ARG  53   9.074   7.261   7.095
  366    HD3  ARG  53           HD3      ARG  53   8.180   6.347   8.299
  367    HE   ARG  53           HE       ARG  53  11.035   7.181   8.422
  368   HH11  ARG  53          HH11      ARG  53   8.384   5.426  10.056
  369   HH12  ARG  53          HH12      ARG  53   9.185   5.408  11.589
  370   HH21  ARG  53          HH21      ARG  53  11.914   7.396  10.505
  371   HH22  ARG  53          HH22      ARG  53  11.379   6.346  11.775
  372    H    THR  54           H        THR  54   8.701   2.544   4.921
  373    HA   THR  54           HA       THR  54  10.020   0.574   6.662
  374    HB   THR  54           HB       THR  54   7.796   1.483   7.211
  375    HG1  THR  54           HG1      THR  54   7.947  -1.307   6.870
  376   HG21  THR  54          HG21      THR  54   6.460  -0.561   5.476
  377   HG22  THR  54          HG22      THR  54   6.913   0.964   4.702
  378   HG23  THR  54          HG23      THR  54   5.853   0.993   6.099
  379    H    CYS  55           H        CYS  55   9.273   0.779   3.193
  380    HA   CYS  55           HA       CYS  55  10.053  -2.091   3.000
  381    HB2  CYS  55           HB2      CYS  55   7.871  -0.740   1.381
  382    HB3  CYS  55           HB3      CYS  55   8.322  -2.449   1.343
  383    H    VAL  56           H        VAL  56  10.613   1.099   1.833
  384    HA   VAL  56           HA       VAL  56  11.647   0.128  -0.770
  385    HB   VAL  56           HB       VAL  56  11.364   2.893   0.367
  386   HG11  VAL  56          HG11      VAL  56  13.305   3.115  -0.952
  387   HG12  VAL  56          HG12      VAL  56  12.622   2.089  -2.238
  388   HG13  VAL  56          HG13      VAL  56  11.943   3.707  -1.907
  389   HG21  VAL  56          HG21      VAL  56   9.293   1.718  -0.515
  390   HG22  VAL  56          HG22      VAL  56   9.731   3.132  -1.475
  391   HG23  VAL  56          HG23      VAL  56  10.139   1.509  -2.063
  392    H    GLY  57           H        GLY  57  13.036  -1.328   0.200
  393    HA2  GLY  57           HA2      GLY  57  15.275  -1.925   0.314
  394    HA3  GLY  57           HA3      GLY  57  15.732  -0.239   0.542
  Start of MODEL    3
    1    H1   ARG   1           H        ARG   1  13.112  -4.871   2.544
    2    HA   ARG   1           HA       ARG   1  10.930  -4.189   3.058
    3    HB2  ARG   1           HB2      ARG   1  10.369  -6.121   0.801
    4    HB3  ARG   1           HB3      ARG   1   9.688  -4.532   1.141
    5    HG2  ARG   1           HG2      ARG   1  10.977  -3.842  -0.475
    6    HG3  ARG   1           HG3      ARG   1  12.308  -3.843   0.696
    7    HD2  ARG   1           HD2      ARG   1  13.039  -6.032  -0.226
    8    HD3  ARG   1           HD3      ARG   1  11.576  -6.061  -1.237
    9    HE   ARG   1           HE       ARG   1  13.662  -3.962  -1.450
   10   HH11  ARG   1          HH11      ARG   1  11.999  -6.597  -3.105
   11   HH12  ARG   1          HH12      ARG   1  12.317  -5.981  -4.703
   12   HH21  ARG   1          HH21      ARG   1  14.207  -3.216  -3.507
   13   HH22  ARG   1          HH22      ARG   1  13.574  -4.001  -4.917
   14    HA   PRO   2           HA       PRO   2   9.019  -7.387   5.523
   15    HB2  PRO   2           HB2      PRO   2   6.853  -6.026   6.445
   16    HB3  PRO   2           HB3      PRO   2   8.499  -5.730   7.055
   17    HG2  PRO   2           HG2      PRO   2   6.990  -4.169   4.938
   18    HG3  PRO   2           HG3      PRO   2   7.909  -3.529   6.331
   19    HD2  PRO   2           HD2      PRO   2   9.024  -3.650   3.842
   20    HD3  PRO   2           HD3      PRO   2   9.979  -3.998   5.299
   21    H    ARG   3           H        ARG   3   7.402  -8.902   5.251
   22    HA   ARG   3           HA       ARG   3   6.327  -9.112   2.627
   23    HB2  ARG   3           HB2      ARG   3   5.442 -11.144   3.217
   24    HB3  ARG   3           HB3      ARG   3   6.934 -11.009   4.124
   25    HG2  ARG   3           HG2      ARG   3   5.663 -11.876   5.787
   26    HG3  ARG   3           HG3      ARG   3   5.249 -10.191   6.070
   27    HD2  ARG   3           HD2      ARG   3   3.252 -11.572   6.132
   28    HD3  ARG   3           HD3      ARG   3   3.150 -10.523   4.711
   29    HE   ARG   3           HE       ARG   3   4.229 -12.683   3.574
   30   HH11  ARG   3          HH11      ARG   3   1.391 -12.678   5.900
   31   HH12  ARG   3          HH12      ARG   3   1.117 -14.334   5.521
   32   HH21  ARG   3          HH21      ARG   3   3.397 -14.754   2.967
   33   HH22  ARG   3          HH22      ARG   3   2.009 -15.362   3.797
   34    H    PHE   4           H        PHE   4   4.944  -7.506   5.429
   35    HA   PHE   4           HA       PHE   4   2.221  -7.787   4.555
   36    HB2  PHE   4           HB2      PHE   4   1.660  -6.224   6.163
   37    HB3  PHE   4           HB3      PHE   4   3.043  -7.028   6.849
   38    HD1  PHE   4           HD2      PHE   4   1.902  -3.948   5.052
   39    HD2  PHE   4           HD1      PHE   4   4.945  -5.738   7.501
   40    HE1  PHE   4           HE2      PHE   4   2.914  -1.692   5.472
   41    HE2  PHE   4           HE1      PHE   4   6.012  -3.504   7.802
   42    HZ   PHE   4           HZ       PHE   4   4.988  -1.488   6.785
   43    H    CYS   5           H        CYS   5   4.914  -5.863   3.405
   44    HA   CYS   5           HA       CYS   5   3.355  -3.834   2.102
   45    HB2  CYS   5           HB2      CYS   5   6.005  -4.233   2.983
   46    HB3  CYS   5           HB3      CYS   5   6.153  -4.218   1.246
   47    H    GLU   6           H        GLU   6   3.961  -7.120   1.271
   48    HA   GLU   6           HA       GLU   6   3.663  -6.428  -1.607
   49    HB2  GLU   6           HB2      GLU   6   4.961  -8.210  -2.245
   50    HB3  GLU   6           HB3      GLU   6   5.814  -7.342  -0.975
   51    HG2  GLU   6           HG2      GLU   6   4.868  -9.189   0.615
   52    HG3  GLU   6           HG3      GLU   6   4.537 -10.093  -0.861
   53    H    LEU   7           H        LEU   7   1.578  -6.890   0.684
   54    HA   LEU   7           HA       LEU   7   0.217  -9.266  -0.316
   55    HB2  LEU   7           HB2      LEU   7  -0.837  -7.106   1.544
   56    HB3  LEU   7           HB3      LEU   7  -1.539  -8.698   1.247
   57    HG   LEU   7           HG       LEU   7   1.041  -8.044   2.691
   58   HD11  LEU   7          HD11      LEU   7  -1.152  -7.871   3.909
   59   HD12  LEU   7          HD12      LEU   7  -0.043  -9.071   4.597
   60   HD13  LEU   7          HD13      LEU   7  -1.419  -9.591   3.609
   61   HD21  LEU   7          HD21      LEU   7   1.308 -10.476   3.116
   62   HD22  LEU   7          HD22      LEU   7   1.566 -10.046   1.433
   63   HD23  LEU   7          HD23      LEU   7   0.031 -10.811   1.923
   64    H    ALA   8           H        ALA   8  -2.111  -9.009  -0.952
   65    HA   ALA   8           HA       ALA   8  -2.330  -7.015  -3.156
   66    HB1  ALA   8           HB1      ALA   8  -4.146  -8.580  -3.894
   67    HB2  ALA   8           HB2      ALA   8  -2.511  -9.277  -3.942
   68    HB3  ALA   8           HB3      ALA   8  -3.648  -9.707  -2.631
   69    HA   PRO   9           HA       PRO   9  -5.141  -5.426   0.104
   70    HB2  PRO   9           HB2      PRO   9  -5.724  -2.979  -0.947
   71    HB3  PRO   9           HB3      PRO   9  -4.161  -3.362  -0.157
   72    HG2  PRO   9           HG2      PRO   9  -4.796  -3.341  -3.127
   73    HG3  PRO   9           HG3      PRO   9  -3.378  -2.638  -2.291
   74    HD2  PRO   9           HD2      PRO   9  -3.343  -5.085  -3.511
   75    HD3  PRO   9           HD3      PRO   9  -2.338  -4.710  -2.084
   76    H    SER  10           H        SER  10  -6.979  -6.551   0.100
   77    HA   SER  10           HA       SER  10  -8.785  -6.944  -2.077
   78    HB2  SER  10           HB2      SER  10  -8.523  -7.664   0.809
   79    HB3  SER  10           HB3      SER  10 -10.161  -7.606   0.244
   80    HG   SER  10           HG       SER  10  -8.061  -8.975  -1.095
   81    H    ALA  11           H        ALA  11  -8.734  -4.475  -2.465
   82    HA   ALA  11           HA       ALA  11 -10.432  -2.704  -1.014
   83    HB1  ALA  11           HB1      ALA  11 -10.081  -1.232  -2.947
   84    HB2  ALA  11           HB2      ALA  11  -8.557  -2.006  -2.482
   85    HB3  ALA  11           HB3      ALA  11  -9.458  -2.593  -3.901
   86    H    GLY  12           H        GLY  12 -11.469  -5.374  -2.767
   87    HA2  GLY  12           HA2      GLY  12 -13.858  -4.065  -3.968
   88    HA3  GLY  12           HA3      GLY  12 -13.331  -5.737  -4.173
   89    H    SER  13           H        SER  13 -13.095  -4.912  -0.952
   90    HA   SER  13           HA       SER  13 -15.028  -6.714  -0.007
   91    HB2  SER  13           HB2      SER  13 -14.404  -5.464   2.202
   92    HB3  SER  13           HB3      SER  13 -13.165  -6.374   1.331
   93    HG   SER  13           HG       SER  13 -12.151  -4.602   0.757
   94    H    CYS  14           H        CYS  14 -15.066  -3.111   0.232
   95    HA   CYS  14           HA       CYS  14 -18.046  -3.195   0.435
   96    HB2  CYS  14           HB2      CYS  14 -16.014  -1.605   2.036
   97    HB3  CYS  14           HB3      CYS  14 -17.665  -1.050   1.860
   98    H    PHE  15           H        PHE  15 -18.937  -0.892  -0.005
   99    HA   PHE  15           HA       PHE  15 -17.608   0.075  -2.482
  100    HB2  PHE  15           HB2      PHE  15 -20.084  -0.525  -2.432
  101    HB3  PHE  15           HB3      PHE  15 -20.326   0.839  -1.348
  102    HD1  PHE  15           HD1      PHE  15 -19.320   3.167  -2.195
  103    HD2  PHE  15           HD2      PHE  15 -20.183  -0.201  -4.743
  104    HE1  PHE  15           HE1      PHE  15 -19.167   4.633  -4.166
  105    HE2  PHE  15           HE2      PHE  15 -20.150   1.300  -6.716
  106    HZ   PHE  15           HZ       PHE  15 -19.665   3.702  -6.443
  107    H    ALA  16           H        ALA  16 -15.984   1.488  -1.840
  108    HA   ALA  16           HA       ALA  16 -16.787   3.826  -0.303
  109    HB1  ALA  16           HB1      ALA  16 -16.114   2.435   1.543
  110    HB2  ALA  16           HB2      ALA  16 -14.662   1.898   0.696
  111    HB3  ALA  16           HB3      ALA  16 -14.790   3.579   1.246
  112    H    PHE  17           H        PHE  17 -15.109   5.453  -0.359
  113    HA   PHE  17           HA       PHE  17 -13.085   5.093  -2.507
  114    HB2  PHE  17           HB2      PHE  17 -15.167   6.391  -3.216
  115    HB3  PHE  17           HB3      PHE  17 -14.645   7.663  -2.140
  116    HD1  PHE  17           HD2      PHE  17 -11.462   6.784  -3.091
  117    HD2  PHE  17           HD1      PHE  17 -15.125   8.123  -4.960
  118    HE1  PHE  17           HE2      PHE  17 -10.177   7.710  -4.943
  119    HE2  PHE  17           HE1      PHE  17 -13.787   9.093  -6.820
  120    HZ   PHE  17           HZ       PHE  17 -11.312   8.872  -6.815
  121    H    VAL  18           H        VAL  18 -11.314   4.911  -1.114
  122    HA   VAL  18           HA       VAL  18 -10.691   7.239   0.530
  123    HB   VAL  18           HB       VAL  18  -9.807   5.628   2.324
  124   HG11  VAL  18          HG11      VAL  18 -11.847   5.872   3.615
  125   HG12  VAL  18          HG12      VAL  18 -11.608   7.312   2.620
  126   HG13  VAL  18          HG13      VAL  18 -12.814   6.086   2.148
  127   HG21  VAL  18          HG21      VAL  18 -10.340   3.464   1.268
  128   HG22  VAL  18          HG22      VAL  18 -11.211   3.653   2.793
  129   HG23  VAL  18          HG23      VAL  18 -12.070   3.874   1.253
  130    HA   PRO  19           HA       PRO  19  -7.508   5.819  -2.377
  131    HB2  PRO  19           HB2      PRO  19  -6.045   8.119  -2.586
  132    HB3  PRO  19           HB3      PRO  19  -7.590   7.872  -3.453
  133    HG2  PRO  19           HG2      PRO  19  -7.151   9.302  -0.810
  134    HG3  PRO  19           HG3      PRO  19  -8.054   9.890  -2.227
  135    HD2  PRO  19           HD2      PRO  19  -9.290   8.699  -0.119
  136    HD3  PRO  19           HD3      PRO  19  -9.865   8.403  -1.789
  137    H    SER  20           H        SER  20  -5.803   4.668  -1.679
  138    HA   SER  20           HA       SER  20  -4.268   5.571   0.675
  139    HB2  SER  20           HB2      SER  20  -5.657   3.800   1.481
  140    HB3  SER  20           HB3      SER  20  -5.192   2.739   0.161
  141    HG   SER  20           HG       SER  20  -3.547   3.642   2.253
  142    H    TYR  21           H        TYR  21  -2.217   3.791   0.560
  143    HA   TYR  21           HA       TYR  21  -0.815   4.447  -2.001
  144    HB2  TYR  21           HB2      TYR  21  -0.089   4.723   0.890
  145    HB3  TYR  21           HB3      TYR  21   1.134   4.204  -0.219
  146    HD1  TYR  21           HD2      TYR  21   2.008   5.969  -2.118
  147    HD2  TYR  21           HD1      TYR  21  -1.008   6.931   0.863
  148    HE1  TYR  21           HE2      TYR  21   2.142   8.259  -2.760
  149    HE2  TYR  21           HE1      TYR  21  -0.690   9.327   0.349
  150    HH   TYR  21           HH       TYR  21   1.719  10.583  -1.943
  151    H    TYR  22           H        TYR  22   0.085   2.810  -3.016
  152    HA   TYR  22           HA       TYR  22  -0.038   0.032  -1.924
  153    HB2  TYR  22           HB2      TYR  22  -1.203   0.911  -4.065
  154    HB3  TYR  22           HB3      TYR  22   0.363   0.991  -4.807
  155    HD1  TYR  22           HD1      TYR  22   1.888  -1.249  -4.754
  156    HD2  TYR  22           HD2      TYR  22  -2.416  -1.148  -4.301
  157    HE1  TYR  22           HE1      TYR  22   1.860  -3.625  -4.944
  158    HE2  TYR  22           HE2      TYR  22  -2.488  -3.553  -4.787
  159    HH   TYR  22           HH       TYR  22  -1.255  -5.495  -5.180
  160    H    TYR  23           H        TYR  23   1.936  -1.166  -1.796
  161    HA   TYR  23           HA       TYR  23   4.411   0.349  -2.591
  162    HB2  TYR  23           HB2      TYR  23   4.460  -0.436  -0.314
  163    HB3  TYR  23           HB3      TYR  23   4.058  -2.084  -0.815
  164    HD1  TYR  23           HD1      TYR  23   6.459   0.652  -1.711
  165    HD2  TYR  23           HD2      TYR  23   5.968  -3.496  -0.859
  166    HE1  TYR  23           HE1      TYR  23   8.830   0.308  -2.060
  167    HE2  TYR  23           HE2      TYR  23   8.421  -3.830  -0.933
  168    HH   TYR  23           HH       TYR  23  10.632  -1.887  -0.979
  169    H    ASN  24           H        ASN  24   5.540  -0.184  -4.424
  170    HA   ASN  24           HA       ASN  24   4.925  -2.799  -5.749
  171    HB2  ASN  24           HB2      ASN  24   5.690  -0.101  -6.934
  172    HB3  ASN  24           HB3      ASN  24   5.826  -1.625  -7.806
  173   HD21  ASN  24          HD21      ASN  24   4.239   0.536  -8.709
  174   HD22  ASN  24          HD22      ASN  24   2.564   0.000  -8.691
  175    H    GLN  25           H        GLN  25   6.525  -3.914  -4.498
  176    HA   GLN  25           HA       GLN  25   9.126  -2.973  -4.094
  177    HB2  GLN  25           HB2      GLN  25   9.616  -4.975  -3.143
  178    HB3  GLN  25           HB3      GLN  25   7.882  -4.899  -2.950
  179    HG2  GLN  25           HG2      GLN  25   9.462  -6.625  -4.854
  180    HG3  GLN  25           HG3      GLN  25   8.496  -7.135  -3.480
  181   HE21  GLN  25          HE21      GLN  25   5.931  -5.945  -3.877
  182   HE22  GLN  25          HE22      GLN  25   5.407  -6.146  -5.518
  183    H    TYR  26           H        TYR  26   7.755  -4.404  -6.985
  184    HA   TYR  26           HA       TYR  26  10.025  -5.240  -8.365
  185    HB2  TYR  26           HB2      TYR  26   7.594  -3.774  -9.477
  186    HB3  TYR  26           HB3      TYR  26   8.746  -4.678 -10.431
  187    HD1  TYR  26           HD2      TYR  26   8.831  -7.189 -10.321
  188    HD2  TYR  26           HD1      TYR  26   5.805  -4.879  -8.267
  189    HE1  TYR  26           HE2      TYR  26   7.401  -9.198 -10.160
  190    HE2  TYR  26           HE1      TYR  26   4.398  -6.891  -8.098
  191    HH   TYR  26           HH       TYR  26   4.153  -9.085  -8.619
  192    H    SER  27           H        SER  27   8.842  -1.952  -7.787
  193    HA   SER  27           HA       SER  27  11.061  -0.816  -9.443
  194    HB2  SER  27           HB2      SER  27   8.724  -0.479 -10.235
  195    HB3  SER  27           HB3      SER  27   8.369   0.400  -8.743
  196    HG   SER  27           HG       SER  27   8.880   1.718 -10.548
  197    H    ASN  28           H        ASN  28  10.541  -1.639  -6.357
  198    HA   ASN  28           HA       ASN  28  10.988  -0.924  -4.326
  199    HB2  ASN  28           HB2      ASN  28  13.220  -1.324  -5.449
  200    HB3  ASN  28           HB3      ASN  28  13.319   0.404  -5.785
  201   HD21  ASN  28          HD21      ASN  28  12.388  -1.514  -2.769
  202   HD22  ASN  28          HD22      ASN  28  13.755  -0.802  -1.900
  203    H    THR  29           H        THR  29   8.931   0.538  -5.139
  204    HA   THR  29           HA       THR  29   9.308   3.006  -3.745
  205    HB   THR  29           HB       THR  29  10.107   3.500  -6.098
  206    HG1  THR  29           HG1      THR  29   9.418   5.028  -4.563
  207   HG21  THR  29          HG21      THR  29   7.146   3.387  -6.813
  208   HG22  THR  29          HG22      THR  29   8.416   2.300  -7.426
  209   HG23  THR  29          HG23      THR  29   8.447   4.029  -7.806
  210    H    CYS  30           H        CYS  30   6.927   4.285  -4.244
  211    HA   CYS  30           HA       CYS  30   4.865   2.201  -4.059
  212    HB2  CYS  30           HB2      CYS  30   4.747   4.551  -2.268
  213    HB3  CYS  30           HB3      CYS  30   4.269   2.883  -1.984
  214    H    HIS  31           H        HIS  31   2.695   3.236  -4.402
  215    HA   HIS  31           HA       HIS  31   2.644   5.868  -5.599
  216    HB2  HIS  31           HB2      HIS  31   3.312   3.944  -7.347
  217    HB3  HIS  31           HB3      HIS  31   1.597   3.568  -7.286
  218    HD1  HIS  31           HD1      HIS  31   1.031   4.492  -9.771
  219    HD2  HIS  31           HD2      HIS  31   3.210   7.090  -7.269
  220    HE1  HIS  31           HE1      HIS  31   1.013   6.725 -10.919
  221    H    SER  32           H        SER  32   0.507   6.775  -5.447
  222    HA   SER  32           HA       SER  32  -1.198   5.548  -3.571
  223    HB2  SER  32           HB2      SER  32  -2.756   7.407  -4.328
  224    HB3  SER  32           HB3      SER  32  -1.228   7.835  -3.547
  225    HG   SER  32           HG       SER  32  -1.636   9.084  -5.421
  226    H    PHE  33           H        PHE  33  -3.094   4.489  -3.748
  227    HA   PHE  33           HA       PHE  33  -4.171   3.708  -6.387
  228    HB2  PHE  33           HB2      PHE  33  -4.161   1.443  -6.043
  229    HB3  PHE  33           HB3      PHE  33  -2.582   1.910  -5.471
  230    HD1  PHE  33           HD2      PHE  33  -2.465   2.274  -2.791
  231    HD2  PHE  33           HD1      PHE  33  -5.503  -0.022  -4.782
  232    HE1  PHE  33           HE2      PHE  33  -2.956   1.071  -0.662
  233    HE2  PHE  33           HE1      PHE  33  -6.059  -1.128  -2.671
  234    HZ   PHE  33           HZ       PHE  33  -4.783  -0.576  -0.561
  235    H    THR  34           H        THR  34  -6.359   2.253  -5.682
  236    HA   THR  34           HA       THR  34  -7.901   4.143  -3.923
  237    HB   THR  34           HB       THR  34  -9.878   3.083  -5.106
  238    HG1  THR  34           HG1      THR  34  -9.371   1.519  -6.301
  239   HG21  THR  34          HG21      THR  34  -7.990   4.712  -6.835
  240   HG22  THR  34          HG22      THR  34  -9.090   5.373  -5.605
  241   HG23  THR  34          HG23      THR  34  -9.742   4.555  -7.033
  242    H    TYR  35           H        TYR  35  -8.677   3.408  -1.932
  243    HA   TYR  35           HA       TYR  35  -8.673   0.489  -1.509
  244    HB2  TYR  35           HB2      TYR  35  -6.890   1.624  -0.362
  245    HB3  TYR  35           HB3      TYR  35  -8.005   2.654   0.485
  246    HD1  TYR  35           HD1      TYR  35  -7.139  -0.989  -0.048
  247    HD2  TYR  35           HD2      TYR  35  -8.610   2.049   2.660
  248    HE1  TYR  35           HE1      TYR  35  -7.091  -2.605   1.807
  249    HE2  TYR  35           HE2      TYR  35  -8.597   0.424   4.502
  250    HH   TYR  35           HH       TYR  35  -8.754  -2.292   4.599
  251    H    SER  36           H        SER  36 -10.068   0.109   0.688
  252    HA   SER  36           HA       SER  36 -12.516   1.667   0.897
  253    HB2  SER  36           HB2      SER  36 -12.405  -1.254   0.009
  254    HB3  SER  36           HB3      SER  36 -13.819  -0.547   0.835
  255    HG   SER  36           HG       SER  36 -12.616   0.654  -1.432
  256    H    GLY  37           H        GLY  37 -13.075   1.660   3.125
  257    HA2  GLY  37           HA2      GLY  37 -11.204   1.048   5.036
  258    HA3  GLY  37           HA3      GLY  37 -12.928   1.250   5.334
  259    H    CYS  38           H        CYS  38 -13.914  -1.051   4.006
  260    HA   CYS  38           HA       CYS  38 -13.558  -3.062   6.043
  261    HB2  CYS  38           HB2      CYS  38 -14.759  -3.329   3.271
  262    HB3  CYS  38           HB3      CYS  38 -15.096  -4.365   4.645
  263    H    GLY  39           H        GLY  39 -13.285  -5.430   5.266
  264    HA2  GLY  39           HA2      GLY  39 -11.712  -7.037   4.855
  265    HA3  GLY  39           HA3      GLY  39 -12.036  -6.550   3.180
  266    H    GLY  40           H        GLY  40 -10.390  -5.898   1.997
  267    HA2  GLY  40           HA2      GLY  40  -8.341  -5.127   1.379
  268    HA3  GLY  40           HA3      GLY  40  -8.330  -4.211   2.877
  269    H    ASN  41           H        ASN  41  -6.018  -4.863   2.242
  270    HA   ASN  41           HA       ASN  41  -5.225  -6.999   4.092
  271    HB2  ASN  41           HB2      ASN  41  -3.947  -6.773   1.316
  272    HB3  ASN  41           HB3      ASN  41  -3.360  -7.730   2.633
  273   HD21  ASN  41          HD21      ASN  41  -3.953  -9.881   2.683
  274   HD22  ASN  41          HD22      ASN  41  -5.374 -10.492   1.850
  275    H    ALA  42           H        ALA  42  -2.965  -6.746   4.746
  276    HA   ALA  42           HA       ALA  42  -2.490  -4.230   5.727
  277    HB1  ALA  42           HB1      ALA  42  -1.582  -6.337   6.623
  278    HB2  ALA  42           HB2      ALA  42  -0.379  -6.341   5.302
  279    HB3  ALA  42           HB3      ALA  42  -0.377  -5.036   6.505
  280    H    ASN  43           H        ASN  43  -1.846  -4.987   2.421
  281    HA   ASN  43           HA       ASN  43   0.476  -3.340   2.044
  282    HB2  ASN  43           HB2      ASN  43  -0.268  -5.058   0.463
  283    HB3  ASN  43           HB3      ASN  43  -1.721  -4.110   0.095
  284   HD21  ASN  43          HD21      ASN  43  -1.462  -3.040  -1.879
  285   HD22  ASN  43          HD22      ASN  43   0.081  -2.633  -2.549
  286    H    ARG  44           H        ARG  44  -2.566  -2.352   3.109
  287    HA   ARG  44           HA       ARG  44  -2.666   0.186   1.581
  288    HB2  ARG  44           HB2      ARG  44  -4.807  -0.537   2.056
  289    HB3  ARG  44           HB3      ARG  44  -4.397  -1.206   3.623
  290    HG2  ARG  44           HG2      ARG  44  -4.161   1.783   3.385
  291    HG3  ARG  44           HG3      ARG  44  -5.769   1.147   3.234
  292    HD2  ARG  44           HD2      ARG  44  -3.845   0.813   5.563
  293    HD3  ARG  44           HD3      ARG  44  -5.263   1.867   5.478
  294    HE   ARG  44           HE       ARG  44  -5.867  -0.875   4.884
  295   HH11  ARG  44          HH11      ARG  44  -5.411   1.435   7.576
  296   HH12  ARG  44          HH12      ARG  44  -6.398   0.543   8.690
  297   HH21  ARG  44          HH21      ARG  44  -7.159  -2.131   6.517
  298   HH22  ARG  44          HH22      ARG  44  -7.318  -1.467   8.099
  299    H    PHE  45           H        PHE  45  -1.868   2.021   2.312
  300    HA   PHE  45           HA       PHE  45  -0.756   2.272   5.078
  301    HB2  PHE  45           HB2      PHE  45   0.658   3.508   2.729
  302    HB3  PHE  45           HB3      PHE  45   1.306   3.143   4.307
  303    HD1  PHE  45           HD1      PHE  45   0.869   0.257   4.716
  304    HD2  PHE  45           HD2      PHE  45   1.763   2.417   1.094
  305    HE1  PHE  45           HE1      PHE  45   1.684  -1.832   3.648
  306    HE2  PHE  45           HE2      PHE  45   2.584   0.386   0.082
  307    HZ   PHE  45           HZ       PHE  45   2.586  -1.777   1.327
  308    H    ARG  46           H        ARG  46   0.012   4.783   5.187
  309    HA   ARG  46           HA       ARG  46  -2.308   6.425   4.205
  310    HB2  ARG  46           HB2      ARG  46  -1.866   7.859   6.274
  311    HB3  ARG  46           HB3      ARG  46  -2.733   6.347   6.421
  312    HG2  ARG  46           HG2      ARG  46  -1.111   6.782   8.252
  313    HG3  ARG  46           HG3      ARG  46  -0.938   5.235   7.450
  314    HD2  ARG  46           HD2      ARG  46   1.229   6.139   7.939
  315    HD3  ARG  46           HD3      ARG  46   1.049   6.124   6.209
  316    HE   ARG  46           HE       ARG  46   0.737   8.492   6.164
  317   HH11  ARG  46          HH11      ARG  46   1.788   7.251   9.360
  318   HH12  ARG  46          HH12      ARG  46   2.457   8.779   9.819
  319   HH21  ARG  46          HH21      ARG  46   1.368  10.546   6.975
  320   HH22  ARG  46          HH22      ARG  46   2.239  10.643   8.463
  321    H    THR  47           H        THR  47   1.102   6.130   3.941
  322    HA   THR  47           HA       THR  47   1.131   8.468   2.308
  323    HB   THR  47           HB       THR  47   1.366   9.475   4.619
  324    HG1  THR  47           HG1      THR  47   3.278  10.682   3.970
  325   HG21  THR  47          HG21      THR  47   4.152   8.343   4.542
  326   HG22  THR  47          HG22      THR  47   2.900   7.488   5.406
  327   HG23  THR  47          HG23      THR  47   3.375   9.154   5.870
  328    H    ILE  48           H        ILE  48   3.067   8.724   1.129
  329    HA   ILE  48           HA       ILE  48   4.286   6.271   0.576
  330    HB   ILE  48           HB       ILE  48   4.000   7.641  -1.268
  331   HG12  ILE  48          HG12      ILE  48   6.992   7.562  -0.689
  332   HG13  ILE  48          HG13      ILE  48   6.026   6.259  -1.255
  333   HG21  ILE  48          HG21      ILE  48   5.010   9.902  -1.537
  334   HG22  ILE  48          HG22      ILE  48   3.949   9.878  -0.143
  335   HG23  ILE  48          HG23      ILE  48   5.706   9.797   0.089
  336   HD11  ILE  48          HD11      ILE  48   6.607   8.793  -2.785
  337   HD12  ILE  48          HD12      ILE  48   7.074   7.125  -3.176
  338   HD13  ILE  48          HD13      ILE  48   5.370   7.608  -3.276
  339    H    ASP  49           H        ASP  49   5.010   8.974   2.637
  340    HA   ASP  49           HA       ASP  49   7.770   8.724   3.057
  341    HB2  ASP  49           HB2      ASP  49   6.265   9.301   5.530
  342    HB3  ASP  49           HB3      ASP  49   7.618  10.125   4.813
  343    H    GLU  50           H        GLU  50   5.060   7.002   4.626
  344    HA   GLU  50           HA       GLU  50   6.815   5.527   6.418
  345    HB2  GLU  50           HB2      GLU  50   3.847   5.255   5.815
  346    HB3  GLU  50           HB3      GLU  50   4.724   4.257   6.973
  347    HG2  GLU  50           HG2      GLU  50   4.393   7.275   7.147
  348    HG3  GLU  50           HG3      GLU  50   3.518   6.070   8.087
  349    H    CYS  51           H        CYS  51   4.921   4.842   3.425
  350    HA   CYS  51           HA       CYS  51   5.592   2.111   3.368
  351    HB2  CYS  51           HB2      CYS  51   4.662   2.080   1.174
  352    HB3  CYS  51           HB3      CYS  51   3.885   3.485   1.958
  353    H    ASN  52           H        ASN  52   7.425   4.921   2.181
  354    HA   ASN  52           HA       ASN  52   9.341   3.228   0.902
  355    HB2  ASN  52           HB2      ASN  52  10.349   5.052  -0.004
  356    HB3  ASN  52           HB3      ASN  52   8.672   5.574   0.143
  357   HD21  ASN  52          HD21      ASN  52   8.325   7.465   1.090
  358   HD22  ASN  52          HD22      ASN  52   9.531   8.455   1.880
  359    H    ARG  53           H        ARG  53   9.607   5.380   3.710
  360    HA   ARG  53           HA       ARG  53  12.058   4.455   4.572
  361    HB2  ARG  53           HB2      ARG  53  11.674   5.471   6.649
  362    HB3  ARG  53           HB3      ARG  53  10.588   6.331   5.538
  363    HG2  ARG  53           HG2      ARG  53   8.775   4.740   6.301
  364    HG3  ARG  53           HG3      ARG  53   9.839   4.211   7.594
  365    HD2  ARG  53           HD2      ARG  53   8.897   7.085   7.125
  366    HD3  ARG  53           HD3      ARG  53   8.205   5.931   8.282
  367    HE   ARG  53           HE       ARG  53  11.013   6.173   8.691
  368   HH11  ARG  53          HH11      ARG  53   7.853   7.626   9.553
  369   HH12  ARG  53          HH12      ARG  53   8.543   8.497  10.902
  370   HH21  ARG  53          HH21      ARG  53  11.846   7.364  10.340
  371   HH22  ARG  53          HH22      ARG  53  10.864   8.114  11.547
  372    H    THR  54           H        THR  54   9.037   2.650   4.930
  373    HA   THR  54           HA       THR  54  10.360   0.676   6.645
  374    HB   THR  54           HB       THR  54   8.056   1.806   6.959
  375    HG1  THR  54           HG1      THR  54   8.844   0.231   8.284
  376   HG21  THR  54          HG21      THR  54   6.181   0.952   5.948
  377   HG22  THR  54          HG22      THR  54   6.949  -0.598   5.526
  378   HG23  THR  54          HG23      THR  54   7.289   0.862   4.573
  379    H    CYS  55           H        CYS  55   9.544   0.859   3.145
  380    HA   CYS  55           HA       CYS  55  10.312  -2.008   2.978
  381    HB2  CYS  55           HB2      CYS  55   8.197  -0.671   1.253
  382    HB3  CYS  55           HB3      CYS  55   8.601  -2.376   1.348
  383    H    VAL  56           H        VAL  56  10.854   1.193   1.821
  384    HA   VAL  56           HA       VAL  56  11.913   0.239  -0.774
  385    HB   VAL  56           HB       VAL  56  11.579   3.010   0.341
  386   HG11  VAL  56          HG11      VAL  56  12.070   3.771  -1.979
  387   HG12  VAL  56          HG12      VAL  56  13.480   3.214  -1.084
  388   HG13  VAL  56          HG13      VAL  56  12.734   2.157  -2.321
  389   HG21  VAL  56          HG21      VAL  56   9.872   3.216  -1.399
  390   HG22  VAL  56          HG22      VAL  56  10.373   1.685  -2.102
  391   HG23  VAL  56          HG23      VAL  56   9.525   1.720  -0.524
  392    H    GLY  57           H        GLY  57  13.600  -1.100  -0.049
  393    HA2  GLY  57           HA2      GLY  57  15.997  -1.117  -0.090
  394    HA3  GLY  57           HA3      GLY  57  16.019   0.497   0.613
  Start of MODEL    4
    1    H1   ARG   1           H        ARG   1  12.623  -5.569   3.378
    2    HA   ARG   1           HA       ARG   1  10.661  -4.266   2.815
    3    HB2  ARG   1           HB2      ARG   1   9.407  -4.810   0.803
    4    HB3  ARG   1           HB3      ARG   1  10.992  -4.135   0.527
    5    HG2  ARG   1           HG2      ARG   1  11.188  -7.033   0.318
    6    HG3  ARG   1           HG3      ARG   1   9.863  -6.404  -0.652
    7    HD2  ARG   1           HD2      ARG   1  11.492  -6.124  -2.213
    8    HD3  ARG   1           HD3      ARG   1  11.614  -4.588  -1.460
    9    HE   ARG   1           HE       ARG   1  13.750  -5.078  -0.820
   10   HH11  ARG   1          HH11      ARG   1  12.102  -8.115  -1.649
   11   HH12  ARG   1          HH12      ARG   1  13.563  -9.060  -1.706
   12   HH21  ARG   1          HH21      ARG   1  15.684  -6.268  -0.955
   13   HH22  ARG   1          HH22      ARG   1  15.667  -7.935  -1.424
   14    HA   PRO   2           HA       PRO   2   9.061  -7.683   5.154
   15    HB2  PRO   2           HB2      PRO   2   6.882  -6.496   6.246
   16    HB3  PRO   2           HB3      PRO   2   8.543  -6.092   6.742
   17    HG2  PRO   2           HG2      PRO   2   6.763  -4.614   4.817
   18    HG3  PRO   2           HG3      PRO   2   7.760  -3.927   6.135
   19    HD2  PRO   2           HD2      PRO   2   8.581  -3.996   3.512
   20    HD3  PRO   2           HD3      PRO   2   9.732  -4.155   4.882
   21    H    ARG   3           H        ARG   3   7.670  -9.298   4.772
   22    HA   ARG   3           HA       ARG   3   6.371  -9.544   2.336
   23    HB2  ARG   3           HB2      ARG   3   5.977 -11.719   2.813
   24    HB3  ARG   3           HB3      ARG   3   7.371 -11.353   3.814
   25    HG2  ARG   3           HG2      ARG   3   4.489 -11.760   4.677
   26    HG3  ARG   3           HG3      ARG   3   5.891 -12.756   5.055
   27    HD2  ARG   3           HD2      ARG   3   6.847 -10.927   6.399
   28    HD3  ARG   3           HD3      ARG   3   5.447  -9.902   6.027
   29    HE   ARG   3           HE       ARG   3   4.479 -12.310   7.119
   30   HH11  ARG   3          HH11      ARG   3   6.468  -9.531   8.185
   31   HH12  ARG   3          HH12      ARG   3   5.916  -9.602   9.827
   32   HH21  ARG   3          HH21      ARG   3   3.847 -12.431   9.364
   33   HH22  ARG   3          HH22      ARG   3   4.538 -11.336  10.516
   34    H    PHE   4           H        PHE   4   5.079  -7.706   4.765
   35    HA   PHE   4           HA       PHE   4   2.266  -8.444   4.120
   36    HB2  PHE   4           HB2      PHE   4   1.602  -7.245   5.962
   37    HB3  PHE   4           HB3      PHE   4   3.073  -8.012   6.516
   38    HD1  PHE   4           HD2      PHE   4   1.555  -4.859   5.321
   39    HD2  PHE   4           HD1      PHE   4   4.947  -6.648   7.242
   40    HE1  PHE   4           HE2      PHE   4   2.386  -2.606   5.887
   41    HE2  PHE   4           HE1      PHE   4   5.868  -4.385   7.712
   42    HZ   PHE   4           HZ       PHE   4   4.607  -2.369   7.067
   43    H    CYS   5           H        CYS   5   4.779  -6.119   3.303
   44    HA   CYS   5           HA       CYS   5   3.030  -4.061   2.342
   45    HB2  CYS   5           HB2      CYS   5   5.529  -4.138   3.174
   46    HB3  CYS   5           HB3      CYS   5   5.912  -4.519   1.501
   47    H    GLU   6           H        GLU   6   4.115  -7.080   1.114
   48    HA   GLU   6           HA       GLU   6   3.743  -6.342  -1.731
   49    HB2  GLU   6           HB2      GLU   6   4.867  -8.409  -2.228
   50    HB3  GLU   6           HB3      GLU   6   5.786  -7.425  -1.094
   51    HG2  GLU   6           HG2      GLU   6   4.839  -8.838   0.766
   52    HG3  GLU   6           HG3      GLU   6   4.126  -9.905  -0.438
   53    H    LEU   7           H        LEU   7   1.372  -6.792   0.294
   54    HA   LEU   7           HA       LEU   7   0.166  -9.213  -0.906
   55    HB2  LEU   7           HB2      LEU   7  -0.910  -7.304   1.162
   56    HB3  LEU   7           HB3      LEU   7  -1.654  -8.832   0.666
   57    HG   LEU   7           HG       LEU   7   0.979  -8.443   2.146
   58   HD11  LEU   7          HD11      LEU   7  -1.155  -8.125   3.418
   59   HD12  LEU   7          HD12      LEU   7  -0.172  -9.487   3.994
   60   HD13  LEU   7          HD13      LEU   7  -1.614  -9.785   2.999
   61   HD21  LEU   7          HD21      LEU   7  -0.314 -11.040   1.263
   62   HD22  LEU   7          HD22      LEU   7   1.041 -10.881   2.414
   63   HD23  LEU   7          HD23      LEU   7   1.268 -10.392   0.733
   64    H    ALA   8           H        ALA   8  -2.231  -8.867  -1.455
   65    HA   ALA   8           HA       ALA   8  -2.343  -6.784  -3.574
   66    HB1  ALA   8           HB1      ALA   8  -4.125  -8.129  -4.542
   67    HB2  ALA   8           HB2      ALA   8  -2.679  -9.123  -4.281
   68    HB3  ALA   8           HB3      ALA   8  -4.064  -9.251  -3.171
   69    HA   PRO   9           HA       PRO   9  -5.068  -4.852  -0.552
   70    HB2  PRO   9           HB2      PRO   9  -5.891  -2.662  -1.977
   71    HB3  PRO   9           HB3      PRO   9  -4.301  -2.808  -1.182
   72    HG2  PRO   9           HG2      PRO   9  -4.970  -3.316  -4.098
   73    HG3  PRO   9           HG3      PRO   9  -3.588  -2.399  -3.418
   74    HD2  PRO   9           HD2      PRO   9  -3.361  -4.971  -4.236
   75    HD3  PRO   9           HD3      PRO   9  -2.426  -4.342  -2.843
   76    H    SER  10           H        SER  10  -6.793  -6.225  -0.329
   77    HA   SER  10           HA       SER  10  -8.688  -6.778  -2.389
   78    HB2  SER  10           HB2      SER  10  -7.983  -8.323  -0.541
   79    HB3  SER  10           HB3      SER  10  -8.913  -7.345   0.597
   80    HG   SER  10           HG       SER  10  -9.986  -9.252  -0.317
   81    H    ALA  11           H        ALA  11  -8.841  -4.214  -2.599
   82    HA   ALA  11           HA       ALA  11 -10.617  -2.800  -0.827
   83    HB1  ALA  11           HB1      ALA  11 -10.478  -1.042  -2.548
   84    HB2  ALA  11           HB2      ALA  11  -8.867  -1.719  -2.221
   85    HB3  ALA  11           HB3      ALA  11  -9.757  -2.195  -3.685
   86    H    GLY  12           H        GLY  12 -11.409  -5.173  -3.248
   87    HA2  GLY  12           HA2      GLY  12 -13.874  -3.933  -4.163
   88    HA3  GLY  12           HA3      GLY  12 -13.318  -5.592  -4.413
   89    H    SER  13           H        SER  13 -12.972  -5.606  -1.304
   90    HA   SER  13           HA       SER  13 -15.196  -7.144  -0.670
   91    HB2  SER  13           HB2      SER  13 -12.795  -6.599   0.474
   92    HB3  SER  13           HB3      SER  13 -13.842  -5.636   1.530
   93    HG   SER  13           HG       SER  13 -13.691  -8.402   1.082
   94    H    CYS  14           H        CYS  14 -14.844  -3.601  -0.309
   95    HA   CYS  14           HA       CYS  14 -17.706  -3.405   0.455
   96    HB2  CYS  14           HB2      CYS  14 -15.271  -2.472   1.996
   97    HB3  CYS  14           HB3      CYS  14 -16.626  -1.367   1.865
   98    H    PHE  15           H        PHE  15 -18.456  -1.119   0.161
   99    HA   PHE  15           HA       PHE  15 -16.933   0.220  -2.034
  100    HB2  PHE  15           HB2      PHE  15 -18.928  -0.557  -3.007
  101    HB3  PHE  15           HB3      PHE  15 -19.880  -0.161  -1.580
  102    HD1  PHE  15           HD2      PHE  15 -17.420   1.939  -3.564
  103    HD2  PHE  15           HD1      PHE  15 -21.463   1.420  -2.169
  104    HE1  PHE  15           HE2      PHE  15 -17.970   4.212  -4.323
  105    HE2  PHE  15           HE1      PHE  15 -22.054   3.641  -3.019
  106    HZ   PHE  15           HZ       PHE  15 -20.315   5.072  -4.112
  107    H    ALA  16           H        ALA  16 -15.857   1.747  -1.150
  108    HA   ALA  16           HA       ALA  16 -17.060   3.908   0.343
  109    HB1  ALA  16           HB1      ALA  16 -16.239   2.366   2.144
  110    HB2  ALA  16           HB2      ALA  16 -14.637   2.346   1.359
  111    HB3  ALA  16           HB3      ALA  16 -15.265   3.844   2.045
  112    H    PHE  17           H        PHE  17 -15.166   5.657   0.392
  113    HA   PHE  17           HA       PHE  17 -13.336   5.244  -1.914
  114    HB2  PHE  17           HB2      PHE  17 -15.412   6.525  -2.567
  115    HB3  PHE  17           HB3      PHE  17 -14.912   7.779  -1.423
  116    HD1  PHE  17           HD2      PHE  17 -13.236   5.633  -4.055
  117    HD2  PHE  17           HD1      PHE  17 -13.952   9.630  -2.591
  118    HE1  PHE  17           HE2      PHE  17 -11.645   6.511  -5.710
  119    HE2  PHE  17           HE1      PHE  17 -12.431  10.523  -4.338
  120    HZ   PHE  17           HZ       PHE  17 -11.214   8.967  -5.842
  121    H    VAL  18           H        VAL  18 -11.487   4.985  -0.746
  122    HA   VAL  18           HA       VAL  18 -10.589   7.312   0.802
  123    HB   VAL  18           HB       VAL  18  -9.527   5.601   2.415
  124   HG11  VAL  18          HG11      VAL  18 -12.494   6.273   2.520
  125   HG12  VAL  18          HG12      VAL  18 -11.493   5.760   3.900
  126   HG13  VAL  18          HG13      VAL  18 -11.121   7.274   3.069
  127   HG21  VAL  18          HG21      VAL  18 -10.865   3.619   2.949
  128   HG22  VAL  18          HG22      VAL  18 -11.949   3.929   1.580
  129   HG23  VAL  18          HG23      VAL  18 -10.246   3.501   1.305
  130    HA   PRO  19           HA       PRO  19  -7.520   6.020  -2.279
  131    HB2  PRO  19           HB2      PRO  19  -6.069   8.342  -2.416
  132    HB3  PRO  19           HB3      PRO  19  -7.599   8.108  -3.297
  133    HG2  PRO  19           HG2      PRO  19  -7.153   9.535  -0.701
  134    HG3  PRO  19           HG3      PRO  19  -8.162  10.039  -2.079
  135    HD2  PRO  19           HD2      PRO  19  -9.187   8.829   0.176
  136    HD3  PRO  19           HD3      PRO  19  -9.911   8.582  -1.446
  137    H    SER  20           H        SER  20  -5.864   4.799  -1.512
  138    HA   SER  20           HA       SER  20  -4.358   5.783   0.781
  139    HB2  SER  20           HB2      SER  20  -5.478   3.030   0.557
  140    HB3  SER  20           HB3      SER  20  -4.293   3.544   1.766
  141    HG   SER  20           HG       SER  20  -5.916   5.146   2.389
  142    H    TYR  21           H        TYR  21  -2.264   3.823   0.758
  143    HA   TYR  21           HA       TYR  21  -1.063   4.412  -1.925
  144    HB2  TYR  21           HB2      TYR  21  -0.143   4.773   0.882
  145    HB3  TYR  21           HB3      TYR  21   1.002   4.247  -0.264
  146    HD1  TYR  21           HD1      TYR  21  -1.346   6.914   0.680
  147    HD2  TYR  21           HD2      TYR  21   1.896   5.985  -2.076
  148    HE1  TYR  21           HE1      TYR  21  -1.040   9.310   0.164
  149    HE2  TYR  21           HE2      TYR  21   2.049   8.286  -2.715
  150    HH   TYR  21           HH       TYR  21   1.558  10.577  -1.883
  151    H    TYR  22           H        TYR  22  -0.043   2.926  -3.084
  152    HA   TYR  22           HA       TYR  22  -0.017   0.086  -2.313
  153    HB2  TYR  22           HB2      TYR  22  -1.072   1.268  -4.498
  154    HB3  TYR  22           HB3      TYR  22   0.546   1.307  -5.045
  155    HD1  TYR  22           HD1      TYR  22   1.952  -0.862  -5.151
  156    HD2  TYR  22           HD2      TYR  22  -2.338  -0.806  -4.722
  157    HE1  TYR  22           HE1      TYR  22   1.905  -3.213  -5.770
  158    HE2  TYR  22           HE2      TYR  22  -2.417  -3.164  -5.548
  159    HH   TYR  22           HH       TYR  22   0.520  -4.935  -6.604
  160    H    TYR  23           H        TYR  23   1.969  -0.999  -2.109
  161    HA   TYR  23           HA       TYR  23   4.448   0.555  -2.644
  162    HB2  TYR  23           HB2      TYR  23   4.225  -0.610  -0.510
  163    HB3  TYR  23           HB3      TYR  23   3.854  -2.099  -1.356
  164    HD1  TYR  23           HD1      TYR  23   6.711   0.371  -1.578
  165    HD2  TYR  23           HD2      TYR  23   5.376  -3.709  -1.241
  166    HE1  TYR  23           HE1      TYR  23   9.045  -0.374  -1.415
  167    HE2  TYR  23           HE2      TYR  23   7.709  -4.450  -0.950
  168    HH   TYR  23           HH       TYR  23  10.551  -2.285  -1.246
  169    H    ASN  24           H        ASN  24   5.883   0.037  -4.421
  170    HA   ASN  24           HA       ASN  24   5.261  -2.515  -5.851
  171    HB2  ASN  24           HB2      ASN  24   5.809   0.183  -7.082
  172    HB3  ASN  24           HB3      ASN  24   6.044  -1.333  -7.941
  173   HD21  ASN  24          HD21      ASN  24   3.831   1.057  -7.598
  174   HD22  ASN  24          HD22      ASN  24   2.371   0.153  -8.005
  175    H    GLN  25           H        GLN  25   6.831  -3.592  -4.619
  176    HA   GLN  25           HA       GLN  25   9.441  -2.682  -4.222
  177    HB2  GLN  25           HB2      GLN  25   9.986  -4.799  -3.487
  178    HB3  GLN  25           HB3      GLN  25   8.282  -4.638  -3.122
  179    HG2  GLN  25           HG2      GLN  25   9.535  -6.336  -5.257
  180    HG3  GLN  25           HG3      GLN  25   8.691  -6.848  -3.811
  181   HE21  GLN  25          HE21      GLN  25   6.147  -5.458  -3.890
  182   HE22  GLN  25          HE22      GLN  25   5.455  -5.672  -5.472
  183    H    TYR  26           H        TYR  26   8.003  -4.137  -7.140
  184    HA   TYR  26           HA       TYR  26  10.263  -4.903  -8.564
  185    HB2  TYR  26           HB2      TYR  26   7.863  -3.353  -9.617
  186    HB3  TYR  26           HB3      TYR  26   8.971  -4.323 -10.583
  187    HD1  TYR  26           HD2      TYR  26   9.170  -6.886  -9.812
  188    HD2  TYR  26           HD1      TYR  26   5.792  -4.298  -9.071
  189    HE1  TYR  26           HE2      TYR  26   7.711  -8.872  -9.503
  190    HE2  TYR  26           HE1      TYR  26   4.345  -6.262  -8.785
  191    HH   TYR  26           HH       TYR  26   4.244  -8.531  -8.636
  192    H    SER  27           H        SER  27   8.994  -1.641  -7.946
  193    HA   SER  27           HA       SER  27  11.241  -0.425  -9.447
  194    HB2  SER  27           HB2      SER  27   8.833  -0.092 -10.209
  195    HB3  SER  27           HB3      SER  27   8.577   0.837  -8.726
  196    HG   SER  27           HG       SER  27   9.102   2.108 -10.549
  197    H    ASN  28           H        ASN  28  10.741  -1.300  -6.364
  198    HA   ASN  28           HA       ASN  28  11.293  -0.582  -4.328
  199    HB2  ASN  28           HB2      ASN  28  13.487  -0.773  -5.504
  200    HB3  ASN  28           HB3      ASN  28  13.378   0.900  -6.020
  201   HD21  ASN  28          HD21      ASN  28  13.455  -1.033  -2.945
  202   HD22  ASN  28          HD22      ASN  28  14.647  -0.019  -2.206
  203    H    THR  29           H        THR  29   9.116   0.964  -5.396
  204    HA   THR  29           HA       THR  29   9.401   3.330  -3.717
  205    HB   THR  29           HB       THR  29  10.175   4.087  -5.940
  206    HG1  THR  29           HG1      THR  29   8.292   5.725  -6.106
  207   HG21  THR  29          HG21      THR  29   8.599   4.322  -7.802
  208   HG22  THR  29          HG22      THR  29   7.355   3.448  -6.881
  209   HG23  THR  29          HG23      THR  29   8.841   2.623  -7.392
  210    H    CYS  30           H        CYS  30   6.882   4.537  -4.201
  211    HA   CYS  30           HA       CYS  30   4.910   2.398  -4.000
  212    HB2  CYS  30           HB2      CYS  30   4.803   4.551  -1.935
  213    HB3  CYS  30           HB3      CYS  30   4.300   2.868  -1.927
  214    H    HIS  31           H        HIS  31   2.724   3.315  -4.429
  215    HA   HIS  31           HA       HIS  31   2.669   6.062  -5.448
  216    HB2  HIS  31           HB2      HIS  31   3.322   4.160  -7.141
  217    HB3  HIS  31           HB3      HIS  31   1.650   3.637  -7.000
  218    HD1  HIS  31           HD1      HIS  31   0.649   4.457  -9.312
  219    HD2  HIS  31           HD2      HIS  31   3.087   7.218  -7.258
  220    HE1  HIS  31           HE1      HIS  31   0.566   6.589 -10.680
  221    H    SER  32           H        SER  32   0.549   7.029  -5.242
  222    HA   SER  32           HA       SER  32  -1.229   5.726  -3.436
  223    HB2  SER  32           HB2      SER  32  -2.758   7.639  -4.032
  224    HB3  SER  32           HB3      SER  32  -1.188   8.050  -3.341
  225    HG   SER  32           HG       SER  32  -2.004   9.227  -5.244
  226    H    PHE  33           H        PHE  33  -3.221   4.747  -3.731
  227    HA   PHE  33           HA       PHE  33  -4.301   4.299  -6.388
  228    HB2  PHE  33           HB2      PHE  33  -4.176   2.013  -6.488
  229    HB3  PHE  33           HB3      PHE  33  -2.579   2.440  -5.864
  230    HD1  PHE  33           HD2      PHE  33  -2.326   2.449  -3.336
  231    HD2  PHE  33           HD1      PHE  33  -5.578   0.442  -5.272
  232    HE1  PHE  33           HE2      PHE  33  -2.423   0.767  -1.480
  233    HE2  PHE  33           HE1      PHE  33  -6.010  -0.826  -3.219
  234    HZ   PHE  33           HZ       PHE  33  -4.401  -0.552  -1.215
  235    H    THR  34           H        THR  34  -6.308   2.655  -5.825
  236    HA   THR  34           HA       THR  34  -7.937   4.254  -3.892
  237    HB   THR  34           HB       THR  34  -9.854   3.053  -4.954
  238    HG1  THR  34           HG1      THR  34  -9.390   1.391  -6.047
  239   HG21  THR  34          HG21      THR  34  -9.111   5.275  -5.769
  240   HG22  THR  34          HG22      THR  34  -9.908   4.292  -7.004
  241   HG23  THR  34          HG23      THR  34  -8.145   4.461  -7.019
  242    H    TYR  35           H        TYR  35  -8.682   3.529  -1.915
  243    HA   TYR  35           HA       TYR  35  -8.646   0.569  -1.505
  244    HB2  TYR  35           HB2      TYR  35  -6.881   1.901  -0.350
  245    HB3  TYR  35           HB3      TYR  35  -8.115   2.511   0.723
  246    HD1  TYR  35           HD1      TYR  35  -6.431  -0.638  -0.524
  247    HD2  TYR  35           HD2      TYR  35  -8.745   1.176   2.625
  248    HE1  TYR  35           HE1      TYR  35  -5.808  -2.483   0.981
  249    HE2  TYR  35           HE2      TYR  35  -8.254  -0.732   4.094
  250    HH   TYR  35           HH       TYR  35  -5.621  -2.971   3.482
  251    H    SER  36           H        SER  36 -10.076   0.164   0.748
  252    HA   SER  36           HA       SER  36 -12.537   1.748   0.578
  253    HB2  SER  36           HB2      SER  36 -12.605  -0.212  -1.051
  254    HB3  SER  36           HB3      SER  36 -12.593  -1.283   0.370
  255    HG   SER  36           HG       SER  36 -14.673  -0.657  -0.534
  256    H    GLY  37           H        GLY  37 -14.109   0.673   2.300
  257    HA2  GLY  37           HA2      GLY  37 -12.893   1.113   4.858
  258    HA3  GLY  37           HA3      GLY  37 -14.560   0.636   4.541
  259    H    CYS  38           H        CYS  38 -14.934  -1.758   4.066
  260    HA   CYS  38           HA       CYS  38 -13.373  -3.293   6.011
  261    HB2  CYS  38           HB2      CYS  38 -14.981  -4.927   5.914
  262    HB3  CYS  38           HB3      CYS  38 -15.891  -3.435   5.816
  263    H    GLY  39           H        GLY  39 -12.828  -5.622   5.394
  264    HA2  GLY  39           HA2      GLY  39 -11.604  -7.119   4.169
  265    HA3  GLY  39           HA3      GLY  39 -12.101  -6.281   2.691
  266    H    GLY  40           H        GLY  40 -10.319  -5.708   1.564
  267    HA2  GLY  40           HA2      GLY  40  -8.326  -4.675   1.051
  268    HA3  GLY  40           HA3      GLY  40  -8.425  -3.879   2.627
  269    H    ASN  41           H        ASN  41  -5.879  -4.634   1.904
  270    HA   ASN  41           HA       ASN  41  -5.326  -6.967   3.671
  271    HB2  ASN  41           HB2      ASN  41  -4.146  -6.548   0.893
  272    HB3  ASN  41           HB3      ASN  41  -3.276  -7.380   2.136
  273   HD21  ASN  41          HD21      ASN  41  -6.819  -7.961   2.179
  274   HD22  ASN  41          HD22      ASN  41  -6.656  -9.491   1.333
  275    H    ALA  42           H        ALA  42  -3.020  -6.981   4.343
  276    HA   ALA  42           HA       ALA  42  -2.414  -4.630   5.739
  277    HB1  ALA  42           HB1      ALA  42  -1.683  -6.968   6.332
  278    HB2  ALA  42           HB2      ALA  42  -0.436  -6.835   5.046
  279    HB3  ALA  42           HB3      ALA  42  -0.406  -5.746   6.438
  280    H    ASN  43           H        ASN  43  -1.627  -5.303   2.364
  281    HA   ASN  43           HA       ASN  43   0.809  -3.780   2.311
  282    HB2  ASN  43           HB2      ASN  43   0.771  -4.168   0.059
  283    HB3  ASN  43           HB3      ASN  43  -0.264  -5.438   0.572
  284   HD21  ASN  43          HD21      ASN  43  -0.003  -2.702  -1.454
  285   HD22  ASN  43          HD22      ASN  43  -1.669  -2.741  -1.999
  286    H    ARG  44           H        ARG  44  -2.352  -2.657   2.993
  287    HA   ARG  44           HA       ARG  44  -2.332  -0.216   1.543
  288    HB2  ARG  44           HB2      ARG  44  -4.263  -1.418   2.702
  289    HB3  ARG  44           HB3      ARG  44  -3.592  -0.937   4.248
  290    HG2  ARG  44           HG2      ARG  44  -3.784   1.523   3.020
  291    HG3  ARG  44           HG3      ARG  44  -5.107   0.641   2.259
  292    HD2  ARG  44           HD2      ARG  44  -5.938   0.091   4.564
  293    HD3  ARG  44           HD3      ARG  44  -4.678   1.158   5.209
  294    HE   ARG  44           HE       ARG  44  -6.050   2.512   3.129
  295   HH11  ARG  44          HH11      ARG  44  -6.677   1.316   6.397
  296   HH12  ARG  44          HH12      ARG  44  -7.805   2.542   6.847
  297   HH21  ARG  44          HH21      ARG  44  -7.463   4.169   3.621
  298   HH22  ARG  44          HH22      ARG  44  -8.375   4.218   5.111
  299    H    PHE  45           H        PHE  45  -1.580   1.765   2.016
  300    HA   PHE  45           HA       PHE  45  -0.391   2.355   4.662
  301    HB2  PHE  45           HB2      PHE  45   0.910   2.614   1.948
  302    HB3  PHE  45           HB3      PHE  45   1.323   3.744   3.235
  303    HD1  PHE  45           HD1      PHE  45   2.121   2.936   5.473
  304    HD2  PHE  45           HD2      PHE  45   1.675   0.285   2.094
  305    HE1  PHE  45           HE1      PHE  45   3.399   1.200   6.664
  306    HE2  PHE  45           HE2      PHE  45   2.993  -1.440   3.287
  307    HZ   PHE  45           HZ       PHE  45   3.902  -0.952   5.543
  308    H    ARG  46           H        ARG  46  -0.194   4.668   5.029
  309    HA   ARG  46           HA       ARG  46  -2.494   6.105   3.838
  310    HB2  ARG  46           HB2      ARG  46  -2.054   7.654   5.869
  311    HB3  ARG  46           HB3      ARG  46  -2.932   6.152   6.041
  312    HG2  ARG  46           HG2      ARG  46  -1.436   6.536   7.923
  313    HG3  ARG  46           HG3      ARG  46  -1.066   5.044   7.084
  314    HD2  ARG  46           HD2      ARG  46   0.968   6.187   7.774
  315    HD3  ARG  46           HD3      ARG  46   0.899   6.079   6.030
  316    HE   ARG  46           HE       ARG  46   0.480   8.413   5.849
  317   HH11  ARG  46          HH11      ARG  46   1.289   7.430   9.217
  318   HH12  ARG  46          HH12      ARG  46   1.882   9.002   9.581
  319   HH21  ARG  46          HH21      ARG  46   0.866  10.548   6.565
  320   HH22  ARG  46          HH22      ARG  46   1.603  10.815   8.079
  321    H    THR  47           H        THR  47   0.985   6.007   3.724
  322    HA   THR  47           HA       THR  47   0.957   8.163   1.919
  323    HB   THR  47           HB       THR  47   1.038   9.391   4.140
  324    HG1  THR  47           HG1      THR  47   1.912  10.669   2.680
  325   HG21  THR  47          HG21      THR  47   3.006   9.285   5.510
  326   HG22  THR  47          HG22      THR  47   3.886   8.371   4.302
  327   HG23  THR  47          HG23      THR  47   2.628   7.562   5.189
  328    H    ILE  48           H        ILE  48   3.023   8.454   0.884
  329    HA   ILE  48           HA       ILE  48   4.380   5.952   0.447
  330    HB   ILE  48           HB       ILE  48   4.116   7.380  -1.415
  331   HG12  ILE  48          HG12      ILE  48   7.058   7.489  -0.558
  332   HG13  ILE  48          HG13      ILE  48   6.237   6.109  -1.237
  333   HG21  ILE  48          HG21      ILE  48   3.810   9.581  -0.312
  334   HG22  ILE  48          HG22      ILE  48   5.547   9.629   0.068
  335   HG23  ILE  48          HG23      ILE  48   4.979   9.682  -1.604
  336   HD11  ILE  48          HD11      ILE  48   7.420   7.185  -3.043
  337   HD12  ILE  48          HD12      ILE  48   5.690   7.471  -3.285
  338   HD13  ILE  48          HD13      ILE  48   6.727   8.758  -2.638
  339    H    ASP  49           H        ASP  49   4.896   8.824   2.486
  340    HA   ASP  49           HA       ASP  49   7.659   8.488   2.953
  341    HB2  ASP  49           HB2      ASP  49   6.231  10.489   3.581
  342    HB3  ASP  49           HB3      ASP  49   5.734   9.566   5.012
  343    H    GLU  50           H        GLU  50   4.850   6.898   4.400
  344    HA   GLU  50           HA       GLU  50   6.467   5.566   6.436
  345    HB2  GLU  50           HB2      GLU  50   4.090   6.278   6.850
  346    HB3  GLU  50           HB3      GLU  50   3.572   5.089   5.653
  347    HG2  GLU  50           HG2      GLU  50   3.366   4.206   7.954
  348    HG3  GLU  50           HG3      GLU  50   4.517   3.256   7.016
  349    H    CYS  51           H        CYS  51   4.715   4.804   3.381
  350    HA   CYS  51           HA       CYS  51   5.201   2.064   3.374
  351    HB2  CYS  51           HB2      CYS  51   3.702   2.916   1.760
  352    HB3  CYS  51           HB3      CYS  51   4.889   4.072   1.137
  353    H    ASN  52           H        ASN  52   7.242   4.745   2.150
  354    HA   ASN  52           HA       ASN  52   9.181   2.967   1.065
  355    HB2  ASN  52           HB2      ASN  52  10.353   4.745   0.288
  356    HB3  ASN  52           HB3      ASN  52   8.707   5.359   0.337
  357   HD21  ASN  52          HD21      ASN  52   8.460   7.291   1.158
  358   HD22  ASN  52          HD22      ASN  52   9.663   8.185   2.062
  359    H    ARG  53           H        ARG  53   9.273   5.054   3.934
  360    HA   ARG  53           HA       ARG  53  11.635   3.997   4.911
  361    HB2  ARG  53           HB2      ARG  53  11.259   5.073   6.924
  362    HB3  ARG  53           HB3      ARG  53  10.241   5.929   5.739
  363    HG2  ARG  53           HG2      ARG  53   8.300   4.602   6.569
  364    HG3  ARG  53           HG3      ARG  53   9.282   3.922   7.844
  365    HD2  ARG  53           HD2      ARG  53   7.685   5.944   8.320
  366    HD3  ARG  53           HD3      ARG  53   9.262   5.923   9.072
  367    HE   ARG  53           HE       ARG  53   8.345   7.571   6.799
  368   HH11  ARG  53          HH11      ARG  53  11.129   6.641   8.825
  369   HH12  ARG  53          HH12      ARG  53  12.172   7.746   8.015
  370   HH21  ARG  53          HH21      ARG  53   9.781   9.098   5.846
  371   HH22  ARG  53          HH22      ARG  53  11.356   9.311   6.509
  372    H    THR  54           H        THR  54   8.505   2.385   5.162
  373    HA   THR  54           HA       THR  54   9.682   0.359   6.954
  374    HB   THR  54           HB       THR  54   7.404   1.578   7.155
  375    HG1  THR  54           HG1      THR  54   8.093  -0.239   8.421
  376   HG21  THR  54          HG21      THR  54   6.772   0.751   4.716
  377   HG22  THR  54          HG22      THR  54   5.585   0.800   6.010
  378   HG23  THR  54          HG23      THR  54   6.343  -0.752   5.550
  379    H    CYS  55           H        CYS  55   9.235   0.705   3.452
  380    HA   CYS  55           HA       CYS  55   9.737  -2.224   3.251
  381    HB2  CYS  55           HB2      CYS  55   8.018  -0.673   1.304
  382    HB3  CYS  55           HB3      CYS  55   8.274  -2.417   1.405
  383    H    VAL  56           H        VAL  56  10.207   0.926   1.594
  384    HA   VAL  56           HA       VAL  56  11.782  -0.109  -0.552
  385    HB   VAL  56           HB       VAL  56  11.427   2.647   0.641
  386   HG11  VAL  56          HG11      VAL  56  12.867   2.007  -1.934
  387   HG12  VAL  56          HG12      VAL  56  12.406   3.615  -1.335
  388   HG13  VAL  56          HG13      VAL  56  13.610   2.672  -0.458
  389   HG21  VAL  56          HG21      VAL  56  10.096   3.004  -1.437
  390   HG22  VAL  56          HG22      VAL  56  10.454   1.358  -1.960
  391   HG23  VAL  56          HG23      VAL  56   9.446   1.634  -0.534
  392    H    GLY  57           H        GLY  57  13.278  -1.507   0.152
  393    HA2  GLY  57           HA2      GLY  57  15.231  -0.705   2.242
  394    HA3  GLY  57           HA3      GLY  57  15.062  -2.300   1.516
  Start of MODEL    5
    1    H1   ARG   1           H        ARG   1  13.147  -5.016   2.341
    2    HA   ARG   1           HA       ARG   1  10.879  -4.415   2.801
    3    HB2  ARG   1           HB2      ARG   1  10.348  -6.428   0.660
    4    HB3  ARG   1           HB3      ARG   1   9.933  -4.714   0.749
    5    HG2  ARG   1           HG2      ARG   1  12.104  -4.062  -0.046
    6    HG3  ARG   1           HG3      ARG   1  12.804  -5.645   0.253
    7    HD2  ARG   1           HD2      ARG   1  11.752  -6.689  -1.498
    8    HD3  ARG   1           HD3      ARG   1  10.630  -5.338  -1.803
    9    HE   ARG   1           HE       ARG   1  13.360  -4.472  -1.923
   10   HH11  ARG   1          HH11      ARG   1  11.348  -6.699  -3.787
   11   HH12  ARG   1          HH12      ARG   1  12.175  -6.352  -5.283
   12   HH21  ARG   1          HH21      ARG   1  14.222  -3.802  -3.878
   13   HH22  ARG   1          HH22      ARG   1  13.624  -4.467  -5.375
   14    HA   PRO   2           HA       PRO   2   9.122  -7.730   5.288
   15    HB2  PRO   2           HB2      PRO   2   6.957  -6.500   6.318
   16    HB3  PRO   2           HB3      PRO   2   8.612  -6.086   6.845
   17    HG2  PRO   2           HG2      PRO   2   6.860  -4.664   4.859
   18    HG3  PRO   2           HG3      PRO   2   7.862  -3.937   6.154
   19    HD2  PRO   2           HD2      PRO   2   8.716  -4.085   3.534
   20    HD3  PRO   2           HD3      PRO   2   9.846  -4.212   4.918
   21    H    ARG   3           H        ARG   3   7.760  -9.348   4.821
   22    HA   ARG   3           HA       ARG   3   6.414  -9.420   2.378
   23    HB2  ARG   3           HB2      ARG   3   6.008 -11.629   2.705
   24    HB3  ARG   3           HB3      ARG   3   7.453 -11.314   3.643
   25    HG2  ARG   3           HG2      ARG   3   4.628 -11.778   4.633
   26    HG3  ARG   3           HG3      ARG   3   6.035 -12.800   4.875
   27    HD2  ARG   3           HD2      ARG   3   7.051 -11.134   6.350
   28    HD3  ARG   3           HD3      ARG   3   5.682 -10.031   6.082
   29    HE   ARG   3           HE       ARG   3   4.544 -12.415   6.918
   30   HH11  ARG   3          HH11      ARG   3   6.925 -10.173   8.400
   31   HH12  ARG   3          HH12      ARG   3   6.567 -10.741  10.009
   32   HH21  ARG   3          HH21      ARG   3   3.995 -12.927   9.038
   33   HH22  ARG   3          HH22      ARG   3   4.751 -12.145  10.394
   34    H    PHE   4           H        PHE   4   5.137  -7.768   4.969
   35    HA   PHE   4           HA       PHE   4   2.330  -8.532   4.364
   36    HB2  PHE   4           HB2      PHE   4   1.716  -7.153   6.159
   37    HB3  PHE   4           HB3      PHE   4   3.008  -8.205   6.709
   38    HD1  PHE   4           HD2      PHE   4   2.352  -4.735   5.419
   39    HD2  PHE   4           HD1      PHE   4   4.808  -7.282   7.881
   40    HE1  PHE   4           HE2      PHE   4   3.800  -2.779   6.039
   41    HE2  PHE   4           HE1      PHE   4   6.148  -5.312   8.596
   42    HZ   PHE   4           HZ       PHE   4   5.671  -3.067   7.632
   43    H    CYS   5           H        CYS   5   4.763  -6.231   3.417
   44    HA   CYS   5           HA       CYS   5   2.966  -4.127   2.540
   45    HB2  CYS   5           HB2      CYS   5   5.372  -4.146   3.469
   46    HB3  CYS   5           HB3      CYS   5   5.898  -4.678   1.876
   47    H    GLU   6           H        GLU   6   4.300  -7.084   1.241
   48    HA   GLU   6           HA       GLU   6   3.793  -6.243  -1.546
   49    HB2  GLU   6           HB2      GLU   6   4.958  -8.278  -2.167
   50    HB3  GLU   6           HB3      GLU   6   5.874  -7.289  -1.033
   51    HG2  GLU   6           HG2      GLU   6   5.023  -8.800   0.825
   52    HG3  GLU   6           HG3      GLU   6   4.370  -9.865  -0.424
   53    H    LEU   7           H        LEU   7   1.641  -6.993   0.622
   54    HA   LEU   7           HA       LEU   7   0.267  -9.243  -0.626
   55    HB2  LEU   7           HB2      LEU   7  -0.734  -7.250   1.444
   56    HB3  LEU   7           HB3      LEU   7  -1.524  -8.763   0.980
   57    HG   LEU   7           HG       LEU   7   1.123  -8.463   2.420
   58   HD11  LEU   7          HD11      LEU   7  -1.490  -9.759   3.296
   59   HD12  LEU   7          HD12      LEU   7  -0.994  -8.114   3.718
   60   HD13  LEU   7          HD13      LEU   7  -0.036  -9.489   4.280
   61   HD21  LEU   7          HD21      LEU   7  -0.203 -11.037   1.544
   62   HD22  LEU   7          HD22      LEU   7   1.154 -10.890   2.684
   63   HD23  LEU   7          HD23      LEU   7   1.386 -10.397   1.019
   64    H    ALA   8           H        ALA   8  -2.100  -8.935  -1.203
   65    HA   ALA   8           HA       ALA   8  -2.299  -6.735  -3.190
   66    HB1  ALA   8           HB1      ALA   8  -3.779  -9.355  -2.962
   67    HB2  ALA   8           HB2      ALA   8  -4.067  -8.114  -4.198
   68    HB3  ALA   8           HB3      ALA   8  -2.503  -8.951  -4.134
   69    HA   PRO   9           HA       PRO   9  -5.218  -5.233  -0.054
   70    HB2  PRO   9           HB2      PRO   9  -5.699  -2.736  -1.031
   71    HB3  PRO   9           HB3      PRO   9  -4.161  -3.180  -0.231
   72    HG2  PRO   9           HG2      PRO   9  -4.737  -2.928  -3.177
   73    HG3  PRO   9           HG3      PRO   9  -3.272  -2.445  -2.271
   74    HD2  PRO   9           HD2      PRO   9  -3.609  -4.831  -3.729
   75    HD3  PRO   9           HD3      PRO   9  -2.391  -4.587  -2.444
   76    H    SER  10           H        SER  10  -6.965  -6.486  -0.337
   77    HA   SER  10           HA       SER  10  -8.531  -6.706  -2.700
   78    HB2  SER  10           HB2      SER  10  -8.254  -8.520  -0.993
   79    HB3  SER  10           HB3      SER  10  -9.240  -7.574   0.115
   80    HG   SER  10           HG       SER  10 -10.015  -8.723  -2.382
   81    H    ALA  11           H        ALA  11  -8.759  -4.381  -2.967
   82    HA   ALA  11           HA       ALA  11 -10.465  -2.765  -1.370
   83    HB1  ALA  11           HB1      ALA  11  -8.711  -1.891  -2.892
   84    HB2  ALA  11           HB2      ALA  11  -9.664  -2.452  -4.287
   85    HB3  ALA  11           HB3      ALA  11 -10.302  -1.177  -3.225
   86    H    GLY  12           H        GLY  12 -11.355  -5.443  -2.985
   87    HA2  GLY  12           HA2      GLY  12 -13.836  -4.456  -4.297
   88    HA3  GLY  12           HA3      GLY  12 -13.176  -6.096  -4.331
   89    H    SER  13           H        SER  13 -12.800  -5.592  -1.243
   90    HA   SER  13           HA       SER  13 -14.732  -7.206  -0.216
   91    HB2  SER  13           HB2      SER  13 -13.372  -4.860   1.162
   92    HB3  SER  13           HB3      SER  13 -14.155  -6.230   1.969
   93    HG   SER  13           HG       SER  13 -11.806  -6.262   0.333
   94    H    CYS  14           H        CYS  14 -15.043  -3.566  -0.310
   95    HA   CYS  14           HA       CYS  14 -17.958  -3.837  -0.267
   96    HB2  CYS  14           HB2      CYS  14 -16.630  -1.842   1.586
   97    HB3  CYS  14           HB3      CYS  14 -18.313  -2.327   1.512
   98    H    PHE  15           H        PHE  15 -18.922  -1.751  -0.973
   99    HA   PHE  15           HA       PHE  15 -17.079  -0.401  -2.855
  100    HB2  PHE  15           HB2      PHE  15 -19.282  -1.122  -3.643
  101    HB3  PHE  15           HB3      PHE  15 -20.067  -0.220  -2.386
  102    HD1  PHE  15           HD1      PHE  15 -19.356   2.559  -2.449
  103    HD2  PHE  15           HD2      PHE  15 -19.436  -0.221  -5.762
  104    HE1  PHE  15           HE1      PHE  15 -19.551   4.409  -4.007
  105    HE2  PHE  15           HE2      PHE  15 -19.887   1.639  -7.282
  106    HZ   PHE  15           HZ       PHE  15 -19.897   3.973  -6.438
  107    H    ALA  16           H        ALA  16 -15.840   1.036  -1.888
  108    HA   ALA  16           HA       ALA  16 -16.932   3.272  -0.479
  109    HB1  ALA  16           HB1      ALA  16 -14.952   1.377   0.843
  110    HB2  ALA  16           HB2      ALA  16 -15.244   3.054   1.373
  111    HB3  ALA  16           HB3      ALA  16 -16.547   1.850   1.442
  112    H    PHE  17           H        PHE  17 -15.368   5.017  -0.658
  113    HA   PHE  17           HA       PHE  17 -13.055   4.422  -2.434
  114    HB2  PHE  17           HB2      PHE  17 -14.934   5.141  -3.772
  115    HB3  PHE  17           HB3      PHE  17 -15.083   6.618  -2.811
  116    HD1  PHE  17           HD2      PHE  17 -11.570   5.694  -3.490
  117    HD2  PHE  17           HD1      PHE  17 -15.056   7.676  -5.131
  118    HE1  PHE  17           HE2      PHE  17 -10.138   7.044  -4.946
  119    HE2  PHE  17           HE1      PHE  17 -13.570   8.902  -6.702
  120    HZ   PHE  17           HZ       PHE  17 -11.110   8.590  -6.582
  121    H    VAL  18           H        VAL  18 -11.410   4.748  -1.086
  122    HA   VAL  18           HA       VAL  18 -11.049   7.449   0.004
  123    HB   VAL  18           HB       VAL  18 -10.091   6.408   2.102
  124   HG11  VAL  18          HG11      VAL  18 -12.242   6.395   3.213
  125   HG12  VAL  18          HG12      VAL  18 -12.296   7.615   1.921
  126   HG13  VAL  18          HG13      VAL  18 -13.096   6.049   1.700
  127   HG21  VAL  18          HG21      VAL  18 -10.013   4.022   1.433
  128   HG22  VAL  18          HG22      VAL  18 -11.086   4.240   2.830
  129   HG23  VAL  18          HG23      VAL  18 -11.766   4.028   1.197
  130    HA   PRO  19           HA       PRO  19  -7.468   6.191  -2.409
  131    HB2  PRO  19           HB2      PRO  19  -5.980   8.497  -2.327
  132    HB3  PRO  19           HB3      PRO  19  -7.397   8.260  -3.389
  133    HG2  PRO  19           HG2      PRO  19  -7.296   9.659  -0.706
  134    HG3  PRO  19           HG3      PRO  19  -8.078  10.205  -2.212
  135    HD2  PRO  19           HD2      PRO  19  -9.436   8.959  -0.179
  136    HD3  PRO  19           HD3      PRO  19  -9.891   8.728  -1.895
  137    H    SER  20           H        SER  20  -5.878   4.950  -1.605
  138    HA   SER  20           HA       SER  20  -4.576   5.692   0.966
  139    HB2  SER  20           HB2      SER  20  -6.298   3.900   1.086
  140    HB3  SER  20           HB3      SER  20  -5.231   2.925   0.071
  141    HG   SER  20           HG       SER  20  -3.970   3.917   2.317
  142    H    TYR  21           H        TYR  21  -2.438   3.832   0.914
  143    HA   TYR  21           HA       TYR  21  -1.008   4.521  -1.607
  144    HB2  TYR  21           HB2      TYR  21  -0.321   4.808   1.258
  145    HB3  TYR  21           HB3      TYR  21   0.900   4.192   0.225
  146    HD1  TYR  21           HD2      TYR  21   1.978   5.811  -1.684
  147    HD2  TYR  21           HD1      TYR  21  -1.181   7.059   1.072
  148    HE1  TYR  21           HE2      TYR  21   2.346   8.089  -2.293
  149    HE2  TYR  21           HE1      TYR  21  -0.700   9.366   0.525
  150    HH   TYR  21           HH       TYR  21   1.104  10.796  -0.420
  151    H    TYR  22           H        TYR  22   0.042   2.964  -2.642
  152    HA   TYR  22           HA       TYR  22  -0.145   0.129  -1.783
  153    HB2  TYR  22           HB2      TYR  22  -1.353   1.214  -3.904
  154    HB3  TYR  22           HB3      TYR  22   0.223   1.185  -4.596
  155    HD1  TYR  22           HD1      TYR  22   1.544  -1.043  -4.692
  156    HD2  TYR  22           HD2      TYR  22  -2.705  -0.706  -4.147
  157    HE1  TYR  22           HE1      TYR  22   1.313  -3.383  -5.357
  158    HE2  TYR  22           HE2      TYR  22  -3.004  -2.965  -5.046
  159    HH   TYR  22           HH       TYR  22  -1.933  -4.615  -6.236
  160    H    TYR  23           H        TYR  23   1.730  -0.976  -1.742
  161    HA   TYR  23           HA       TYR  23   4.298   0.406  -2.287
  162    HB2  TYR  23           HB2      TYR  23   4.109  -0.867  -0.254
  163    HB3  TYR  23           HB3      TYR  23   3.595  -2.297  -1.137
  164    HD1  TYR  23           HD1      TYR  23   6.500   0.130  -1.416
  165    HD2  TYR  23           HD2      TYR  23   5.197  -3.978  -1.243
  166    HE1  TYR  23           HE1      TYR  23   8.822  -0.593  -1.448
  167    HE2  TYR  23           HE2      TYR  23   7.562  -4.720  -1.278
  168    HH   TYR  23           HH       TYR  23  10.190  -2.742  -0.853
  169    H    ASN  24           H        ASN  24   5.515   0.139  -4.164
  170    HA   ASN  24           HA       ASN  24   4.812  -2.130  -5.985
  171    HB2  ASN  24           HB2      ASN  24   5.823   0.655  -6.624
  172    HB3  ASN  24           HB3      ASN  24   5.810  -0.681  -7.760
  173   HD21  ASN  24          HD21      ASN  24   3.892  -1.186  -8.847
  174   HD22  ASN  24          HD22      ASN  24   2.350  -0.429  -8.522
  175    H    GLN  25           H        GLN  25   6.322  -3.539  -4.935
  176    HA   GLN  25           HA       GLN  25   9.047  -2.923  -4.488
  177    HB2  GLN  25           HB2      GLN  25   9.440  -5.260  -4.267
  178    HB3  GLN  25           HB3      GLN  25   7.901  -4.901  -3.536
  179    HG2  GLN  25           HG2      GLN  25   8.388  -6.317  -6.168
  180    HG3  GLN  25           HG3      GLN  25   7.706  -6.992  -4.693
  181   HE21  GLN  25          HE21      GLN  25   5.609  -5.498  -3.894
  182   HE22  GLN  25          HE22      GLN  25   4.531  -5.159  -5.266
  183    H    TYR  26           H        TYR  26   7.371  -4.037  -7.503
  184    HA   TYR  26           HA       TYR  26   9.668  -4.547  -9.022
  185    HB2  TYR  26           HB2      TYR  26   7.026  -3.391  -9.979
  186    HB3  TYR  26           HB3      TYR  26   8.252  -4.117 -11.004
  187    HD1  TYR  26           HD2      TYR  26   8.995  -6.646  -9.848
  188    HD2  TYR  26           HD1      TYR  26   5.122  -4.732  -9.903
  189    HE1  TYR  26           HE2      TYR  26   7.900  -8.838  -9.487
  190    HE2  TYR  26           HE1      TYR  26   4.040  -6.892  -9.484
  191    HH   TYR  26           HH       TYR  26   4.397  -9.047  -8.774
  192    H    SER  27           H        SER  27   8.365  -1.540  -7.955
  193    HA   SER  27           HA       SER  27  10.204  -0.018  -9.792
  194    HB2  SER  27           HB2      SER  27   7.745   0.273 -10.094
  195    HB3  SER  27           HB3      SER  27   7.631   0.847  -8.433
  196    HG   SER  27           HG       SER  27   9.213   2.134 -10.444
  197    H    ASN  28           H        ASN  28  10.162  -1.246  -6.740
  198    HA   ASN  28           HA       ASN  28  10.889  -0.721  -4.696
  199    HB2  ASN  28           HB2      ASN  28  12.937  -1.179  -5.995
  200    HB3  ASN  28           HB3      ASN  28  13.140   0.560  -6.264
  201   HD21  ASN  28          HD21      ASN  28  12.383  -1.552  -3.346
  202   HD22  ASN  28          HD22      ASN  28  13.761  -0.906  -2.468
  203    H    THR  29           H        THR  29   8.854   0.928  -5.264
  204    HA   THR  29           HA       THR  29   9.414   3.148  -3.575
  205    HB   THR  29           HB       THR  29  10.158   4.025  -5.802
  206    HG1  THR  29           HG1      THR  29   8.890   5.969  -5.454
  207   HG21  THR  29          HG21      THR  29   7.193   4.116  -6.495
  208   HG22  THR  29          HG22      THR  29   8.354   2.983  -7.220
  209   HG23  THR  29          HG23      THR  29   8.560   4.728  -7.444
  210    H    CYS  30           H        CYS  30   6.918   4.510  -3.995
  211    HA   CYS  30           HA       CYS  30   4.917   2.365  -3.840
  212    HB2  CYS  30           HB2      CYS  30   4.868   4.493  -1.743
  213    HB3  CYS  30           HB3      CYS  30   4.378   2.804  -1.760
  214    H    HIS  31           H        HIS  31   2.730   3.279  -4.150
  215    HA   HIS  31           HA       HIS  31   2.673   6.070  -5.100
  216    HB2  HIS  31           HB2      HIS  31   3.251   4.340  -6.970
  217    HB3  HIS  31           HB3      HIS  31   1.595   3.768  -6.785
  218    HD1  HIS  31           HD1      HIS  31   0.230   4.878  -8.751
  219    HD2  HIS  31           HD2      HIS  31   3.139   7.316  -6.935
  220    HE1  HIS  31           HE1      HIS  31   0.073   7.137  -9.930
  221    H    SER  32           H        SER  32   0.554   7.008  -5.069
  222    HA   SER  32           HA       SER  32  -1.175   5.789  -3.126
  223    HB2  SER  32           HB2      SER  32  -2.646   7.719  -3.593
  224    HB3  SER  32           HB3      SER  32  -0.976   8.163  -3.202
  225    HG   SER  32           HG       SER  32  -1.043   9.233  -4.991
  226    H    PHE  33           H        PHE  33  -3.229   4.890  -3.436
  227    HA   PHE  33           HA       PHE  33  -4.209   4.365  -6.150
  228    HB2  PHE  33           HB2      PHE  33  -4.175   2.076  -6.113
  229    HB3  PHE  33           HB3      PHE  33  -2.602   2.466  -5.444
  230    HD1  PHE  33           HD2      PHE  33  -2.587   2.610  -2.729
  231    HD2  PHE  33           HD1      PHE  33  -5.430   0.415  -5.106
  232    HE1  PHE  33           HE2      PHE  33  -3.239   1.297  -0.755
  233    HE2  PHE  33           HE1      PHE  33  -6.088  -0.890  -3.117
  234    HZ   PHE  33           HZ       PHE  33  -5.012  -0.368  -0.897
  235    H    THR  34           H        THR  34  -6.359   2.839  -5.716
  236    HA   THR  34           HA       THR  34  -7.973   4.506  -3.852
  237    HB   THR  34           HB       THR  34  -9.883   3.490  -5.139
  238    HG1  THR  34           HG1      THR  34  -9.307   1.811  -6.219
  239   HG21  THR  34          HG21      THR  34  -9.660   4.992  -6.965
  240   HG22  THR  34          HG22      THR  34  -7.890   4.860  -6.982
  241   HG23  THR  34          HG23      THR  34  -8.682   5.705  -5.659
  242    H    TYR  35           H        TYR  35  -8.851   3.669  -1.934
  243    HA   TYR  35           HA       TYR  35  -8.726   0.747  -1.630
  244    HB2  TYR  35           HB2      TYR  35  -6.889   1.699  -0.523
  245    HB3  TYR  35           HB3      TYR  35  -7.930   2.821   0.345
  246    HD1  TYR  35           HD1      TYR  35  -7.038  -0.929   0.096
  247    HD2  TYR  35           HD2      TYR  35  -8.774   2.317   2.449
  248    HE1  TYR  35           HE1      TYR  35  -6.998  -2.303   2.083
  249    HE2  TYR  35           HE2      TYR  35  -8.724   0.840   4.434
  250    HH   TYR  35           HH       TYR  35  -8.370  -2.419   4.372
  251    H    SER  36           H        SER  36 -10.232   0.057   0.312
  252    HA   SER  36           HA       SER  36 -12.810   1.468   0.019
  253    HB2  SER  36           HB2      SER  36 -12.641  -1.231   1.312
  254    HB3  SER  36           HB3      SER  36 -13.904  -0.535   0.296
  255    HG   SER  36           HG       SER  36 -12.895  -1.287  -1.409
  256    H    GLY  37           H        GLY  37 -11.227  -0.403   2.722
  257    HA2  GLY  37           HA2      GLY  37 -10.795   1.085   4.771
  258    HA3  GLY  37           HA3      GLY  37 -12.499   1.486   4.651
  259    H    CYS  38           H        CYS  38 -13.819  -0.795   4.146
  260    HA   CYS  38           HA       CYS  38 -13.860  -2.178   6.625
  261    HB2  CYS  38           HB2      CYS  38 -15.627  -3.419   5.640
  262    HB3  CYS  38           HB3      CYS  38 -15.764  -1.797   4.963
  263    H    GLY  39           H        GLY  39 -12.238  -2.947   3.592
  264    HA2  GLY  39           HA2      GLY  39 -11.276  -5.519   4.703
  265    HA3  GLY  39           HA3      GLY  39 -11.943  -5.431   3.080
  266    H    GLY  40           H        GLY  40  -9.930  -6.250   2.337
  267    HA2  GLY  40           HA2      GLY  40  -8.178  -5.615   1.001
  268    HA3  GLY  40           HA3      GLY  40  -7.869  -4.164   1.970
  269    H    ASN  41           H        ASN  41  -5.612  -5.252   1.804
  270    HA   ASN  41           HA       ASN  41  -5.208  -7.109   4.113
  271    HB2  ASN  41           HB2      ASN  41  -3.839  -7.197   1.391
  272    HB3  ASN  41           HB3      ASN  41  -3.215  -7.986   2.818
  273   HD21  ASN  41          HD21      ASN  41  -6.659  -8.310   3.014
  274   HD22  ASN  41          HD22      ASN  41  -6.675  -9.905   2.307
  275    H    ALA  42           H        ALA  42  -2.782  -7.014   4.733
  276    HA   ALA  42           HA       ALA  42  -2.253  -4.584   5.820
  277    HB1  ALA  42           HB1      ALA  42  -0.202  -6.708   5.182
  278    HB2  ALA  42           HB2      ALA  42  -0.142  -5.505   6.481
  279    HB3  ALA  42           HB3      ALA  42  -1.376  -6.786   6.520
  280    H    ASN  43           H        ASN  43  -1.656  -5.183   2.447
  281    HA   ASN  43           HA       ASN  43   0.645  -3.506   2.160
  282    HB2  ASN  43           HB2      ASN  43  -0.058  -4.958   0.345
  283    HB3  ASN  43           HB3      ASN  43  -1.582  -4.077   0.166
  284   HD21  ASN  43          HD21      ASN  43  -0.998  -3.680  -2.183
  285   HD22  ASN  43          HD22      ASN  43   0.305  -2.641  -2.561
  286    H    ARG  44           H        ARG  44  -2.593  -2.713   3.171
  287    HA   ARG  44           HA       ARG  44  -2.820  -0.168   2.047
  288    HB2  ARG  44           HB2      ARG  44  -4.630  -1.533   3.188
  289    HB3  ARG  44           HB3      ARG  44  -3.879  -1.212   4.757
  290    HG2  ARG  44           HG2      ARG  44  -4.129   1.270   3.307
  291    HG3  ARG  44           HG3      ARG  44  -5.661   0.390   3.247
  292    HD2  ARG  44           HD2      ARG  44  -5.734   0.449   5.667
  293    HD3  ARG  44           HD3      ARG  44  -4.248   1.446   5.661
  294    HE   ARG  44           HE       ARG  44  -5.688   2.641   3.751
  295   HH11  ARG  44          HH11      ARG  44  -7.074   1.298   6.738
  296   HH12  ARG  44          HH12      ARG  44  -8.142   2.608   7.054
  297   HH21  ARG  44          HH21      ARG  44  -7.000   4.608   4.334
  298   HH22  ARG  44          HH22      ARG  44  -8.326   4.357   5.440
  299    H    PHE  45           H        PHE  45  -1.706   1.637   2.394
  300    HA   PHE  45           HA       PHE  45  -0.674   2.253   5.092
  301    HB2  PHE  45           HB2      PHE  45   0.947   1.971   2.619
  302    HB3  PHE  45           HB3      PHE  45   1.276   3.397   3.564
  303    HD1  PHE  45           HD2      PHE  45   0.839  -0.322   3.960
  304    HD2  PHE  45           HD1      PHE  45   2.695   3.265   5.471
  305    HE1  PHE  45           HE2      PHE  45   1.953  -1.643   5.671
  306    HE2  PHE  45           HE1      PHE  45   3.872   1.909   7.192
  307    HZ   PHE  45           HZ       PHE  45   3.508  -0.535   7.313
  308    H    ARG  46           H        ARG  46   0.079   4.664   5.053
  309    HA   ARG  46           HA       ARG  46  -2.176   6.229   3.869
  310    HB2  ARG  46           HB2      ARG  46  -1.763   7.719   5.947
  311    HB3  ARG  46           HB3      ARG  46  -2.686   6.247   6.067
  312    HG2  ARG  46           HG2      ARG  46  -1.186   6.566   7.987
  313    HG3  ARG  46           HG3      ARG  46  -0.912   5.052   7.158
  314    HD2  ARG  46           HD2      ARG  46   1.183   6.036   7.851
  315    HD3  ARG  46           HD3      ARG  46   1.126   6.004   6.100
  316    HE   ARG  46           HE       ARG  46   0.843   8.349   5.999
  317   HH11  ARG  46          HH11      ARG  46   1.491   7.190   9.362
  318   HH12  ARG  46          HH12      ARG  46   2.073   8.730   9.844
  319   HH21  ARG  46          HH21      ARG  46   1.299  10.465   6.857
  320   HH22  ARG  46          HH22      ARG  46   2.017  10.575   8.417
  321    H    THR  47           H        THR  47   1.275   5.972   3.805
  322    HA   THR  47           HA       THR  47   1.370   8.222   2.089
  323    HB   THR  47           HB       THR  47   1.474   9.370   4.316
  324    HG1  THR  47           HG1      THR  47   3.228  10.642   3.648
  325   HG21  THR  47          HG21      THR  47   2.946   7.458   5.347
  326   HG22  THR  47          HG22      THR  47   3.387   9.153   5.726
  327   HG23  THR  47          HG23      THR  47   4.267   8.240   4.515
  328    H    ILE  48           H        ILE  48   3.307   8.372   0.956
  329    HA   ILE  48           HA       ILE  48   4.626   5.862   0.523
  330    HB   ILE  48           HB       ILE  48   4.335   7.241  -1.354
  331   HG12  ILE  48          HG12      ILE  48   7.273   7.401  -0.581
  332   HG13  ILE  48          HG13      ILE  48   6.479   6.000  -1.187
  333   HG21  ILE  48          HG21      ILE  48   4.010   9.465  -0.347
  334   HG22  ILE  48          HG22      ILE  48   5.730   9.533   0.078
  335   HG23  ILE  48          HG23      ILE  48   5.222   9.547  -1.613
  336   HD11  ILE  48          HD11      ILE  48   7.047   8.585  -2.660
  337   HD12  ILE  48          HD12      ILE  48   7.559   6.940  -3.062
  338   HD13  ILE  48          HD13      ILE  48   5.860   7.412  -3.274
  339    H    ASP  49           H        ASP  49   5.211   8.678   2.573
  340    HA   ASP  49           HA       ASP  49   7.978   8.364   2.996
  341    HB2  ASP  49           HB2      ASP  49   6.231  10.213   3.805
  342    HB3  ASP  49           HB3      ASP  49   6.271   9.243   5.300
  343    H    GLU  50           H        GLU  50   5.192   6.800   4.593
  344    HA   GLU  50           HA       GLU  50   6.823   5.403   6.554
  345    HB2  GLU  50           HB2      GLU  50   3.904   5.266   5.734
  346    HB3  GLU  50           HB3      GLU  50   4.614   4.221   6.965
  347    HG2  GLU  50           HG2      GLU  50   4.429   7.258   7.086
  348    HG3  GLU  50           HG3      GLU  50   3.494   6.106   8.032
  349    H    CYS  51           H        CYS  51   5.088   4.736   3.486
  350    HA   CYS  51           HA       CYS  51   5.535   1.978   3.438
  351    HB2  CYS  51           HB2      CYS  51   3.980   2.960   1.902
  352    HB3  CYS  51           HB3      CYS  51   5.211   4.043   1.248
  353    H    ASN  52           H        ASN  52   7.522   4.640   2.095
  354    HA   ASN  52           HA       ASN  52   9.383   2.821   0.961
  355    HB2  ASN  52           HB2      ASN  52  10.529   4.574   0.056
  356    HB3  ASN  52           HB3      ASN  52   8.911   5.241   0.207
  357   HD21  ASN  52          HD21      ASN  52   8.693   7.098   1.319
  358   HD22  ASN  52          HD22      ASN  52  10.011   7.964   2.072
  359    H    ARG  53           H        ARG  53   9.520   4.860   3.825
  360    HA   ARG  53           HA       ARG  53  11.981   3.856   4.738
  361    HB2  ARG  53           HB2      ARG  53  11.665   4.876   6.777
  362    HB3  ARG  53           HB3      ARG  53  10.646   5.799   5.661
  363    HG2  ARG  53           HG2      ARG  53   8.694   4.508   6.478
  364    HG3  ARG  53           HG3      ARG  53   9.698   3.687   7.659
  365    HD2  ARG  53           HD2      ARG  53   8.359   5.615   8.571
  366    HD3  ARG  53           HD3      ARG  53  10.110   5.723   8.858
  367    HE   ARG  53           HE       ARG  53   9.232   7.046   6.427
  368   HH11  ARG  53          HH11      ARG  53   9.311   7.510   9.952
  369   HH12  ARG  53          HH12      ARG  53   9.723   9.192   9.839
  370   HH21  ARG  53          HH21      ARG  53   9.763   9.270   6.292
  371   HH22  ARG  53          HH22      ARG  53   9.877  10.233   7.708
  372    H    THR  54           H        THR  54   8.825   2.252   5.017
  373    HA   THR  54           HA       THR  54  10.097   0.161   6.634
  374    HB   THR  54           HB       THR  54   7.874   1.275   7.152
  375    HG1  THR  54           HG1      THR  54   8.105  -1.525   7.040
  376   HG21  THR  54          HG21      THR  54   6.565  -0.895   5.526
  377   HG22  THR  54          HG22      THR  54   6.975   0.616   4.695
  378   HG23  THR  54          HG23      THR  54   5.916   0.652   6.104
  379    H    CYS  55           H        CYS  55   9.476   0.486   3.180
  380    HA   CYS  55           HA       CYS  55   9.993  -2.426   2.943
  381    HB2  CYS  55           HB2      CYS  55   8.015  -0.972   1.183
  382    HB3  CYS  55           HB3      CYS  55   8.265  -2.716   1.342
  383    H    VAL  56           H        VAL  56  10.678   0.779   1.736
  384    HA   VAL  56           HA       VAL  56  11.633  -0.262  -0.872
  385    HB   VAL  56           HB       VAL  56  11.478   2.480   0.355
  386   HG11  VAL  56          HG11      VAL  56  12.198   3.428  -1.754
  387   HG12  VAL  56          HG12      VAL  56  13.496   2.585  -0.919
  388   HG13  VAL  56          HG13      VAL  56  12.702   1.812  -2.316
  389   HG21  VAL  56          HG21      VAL  56   9.388   1.408  -0.596
  390   HG22  VAL  56          HG22      VAL  56   9.882   2.854  -1.469
  391   HG23  VAL  56          HG23      VAL  56  10.234   1.249  -2.143
  392    H    GLY  57           H        GLY  57  13.124  -1.747  -0.246
  393    HA2  GLY  57           HA2      GLY  57  15.510  -2.029  -0.234
  394    HA3  GLY  57           HA3      GLY  57  15.648  -0.738   0.976
  Start of MODEL    6
    1    H1   ARG   1           H        ARG   1  12.530  -5.231   3.044
    2    HA   ARG   1           HA       ARG   1  10.439  -4.230   2.808
    3    HB2  ARG   1           HB2      ARG   1   8.803  -5.124   1.117
    4    HB3  ARG   1           HB3      ARG   1  10.067  -4.061   0.577
    5    HG2  ARG   1           HG2      ARG   1  10.412  -7.076   0.269
    6    HG3  ARG   1           HG3      ARG   1   9.356  -6.180  -0.795
    7    HD2  ARG   1           HD2      ARG   1  11.139  -5.817  -2.104
    8    HD3  ARG   1           HD3      ARG   1  11.528  -4.574  -0.987
    9    HE   ARG   1           HE       ARG   1  13.400  -5.713  -0.353
   10   HH11  ARG   1          HH11      ARG   1  11.215  -8.099  -1.825
   11   HH12  ARG   1          HH12      ARG   1  12.524  -9.126  -2.340
   12   HH21  ARG   1          HH21      ARG   1  15.014  -7.232  -0.644
   13   HH22  ARG   1          HH22      ARG   1  14.668  -8.764  -1.419
   14    HA   PRO   2           HA       PRO   2   9.056  -7.611   5.392
   15    HB2  PRO   2           HB2      PRO   2   6.863  -6.408   6.483
   16    HB3  PRO   2           HB3      PRO   2   8.514  -5.971   6.984
   17    HG2  PRO   2           HG2      PRO   2   6.736  -4.552   5.019
   18    HG3  PRO   2           HG3      PRO   2   7.731  -3.833   6.326
   19    HD2  PRO   2           HD2      PRO   2   8.584  -3.901   3.731
   20    HD3  PRO   2           HD3      PRO   2   9.725  -4.116   5.087
   21    H    ARG   3           H        ARG   3   7.633  -9.241   5.003
   22    HA   ARG   3           HA       ARG   3   6.402  -9.343   2.488
   23    HB2  ARG   3           HB2      ARG   3   6.187 -11.517   2.802
   24    HB3  ARG   3           HB3      ARG   3   7.358 -11.187   4.053
   25    HG2  ARG   3           HG2      ARG   3   4.396 -11.686   4.346
   26    HG3  ARG   3           HG3      ARG   3   5.708 -12.744   4.792
   27    HD2  ARG   3           HD2      ARG   3   5.268 -10.030   6.119
   28    HD3  ARG   3           HD3      ARG   3   4.466 -11.488   6.677
   29    HE   ARG   3           HE       ARG   3   7.116 -10.675   7.270
   30   HH11  ARG   3          HH11      ARG   3   5.256 -13.630   6.561
   31   HH12  ARG   3          HH12      ARG   3   6.378 -14.694   7.325
   32   HH21  ARG   3          HH21      ARG   3   8.476 -12.105   8.570
   33   HH22  ARG   3          HH22      ARG   3   8.123 -13.788   8.623
   34    H    PHE   4           H        PHE   4   5.072  -7.632   5.005
   35    HA   PHE   4           HA       PHE   4   2.264  -8.306   4.340
   36    HB2  PHE   4           HB2      PHE   4   1.629  -6.994   6.099
   37    HB3  PHE   4           HB3      PHE   4   3.075  -7.779   6.703
   38    HD1  PHE   4           HD2      PHE   4   1.738  -4.591   5.242
   39    HD2  PHE   4           HD1      PHE   4   4.883  -6.428   7.553
   40    HE1  PHE   4           HE2      PHE   4   2.602  -2.369   5.803
   41    HE2  PHE   4           HE1      PHE   4   5.850  -4.183   7.985
   42    HZ   PHE   4           HZ       PHE   4   4.730  -2.144   7.105
   43    H    CYS   5           H        CYS   5   4.791  -6.059   3.439
   44    HA   CYS   5           HA       CYS   5   3.159  -3.964   2.389
   45    HB2  CYS   5           HB2      CYS   5   5.747  -4.349   3.130
   46    HB3  CYS   5           HB3      CYS   5   5.939  -4.574   1.403
   47    H    GLU   6           H        GLU   6   4.271  -7.041   1.213
   48    HA   GLU   6           HA       GLU   6   3.911  -6.324  -1.633
   49    HB2  GLU   6           HB2      GLU   6   4.968  -8.407  -2.127
   50    HB3  GLU   6           HB3      GLU   6   5.888  -7.565  -0.869
   51    HG2  GLU   6           HG2      GLU   6   4.932  -8.970   0.847
   52    HG3  GLU   6           HG3      GLU   6   3.924  -9.839  -0.322
   53    H    LEU   7           H        LEU   7   1.600  -6.902   0.498
   54    HA   LEU   7           HA       LEU   7   0.243  -9.173  -0.750
   55    HB2  LEU   7           HB2      LEU   7  -0.765  -7.077   1.203
   56    HB3  LEU   7           HB3      LEU   7  -1.587  -8.589   0.776
   57    HG   LEU   7           HG       LEU   7   1.060  -8.305   2.253
   58   HD11  LEU   7          HD11      LEU   7  -1.625  -9.342   3.229
   59   HD12  LEU   7          HD12      LEU   7  -0.994  -7.710   3.538
   60   HD13  LEU   7          HD13      LEU   7  -0.148  -9.122   4.186
   61   HD21  LEU   7          HD21      LEU   7   1.186 -10.335   0.983
   62   HD22  LEU   7          HD22      LEU   7  -0.430 -10.838   1.570
   63   HD23  LEU   7          HD23      LEU   7   0.945 -10.692   2.689
   64    H    ALA   8           H        ALA   8  -2.059  -8.777  -1.457
   65    HA   ALA   8           HA       ALA   8  -2.099  -6.605  -3.515
   66    HB1  ALA   8           HB1      ALA   8  -3.826  -7.939  -4.642
   67    HB2  ALA   8           HB2      ALA   8  -2.311  -8.845  -4.486
   68    HB3  ALA   8           HB3      ALA   8  -3.674  -9.189  -3.399
   69    HA   PRO   9           HA       PRO   9  -4.968  -5.083  -0.440
   70    HB2  PRO   9           HB2      PRO   9  -5.934  -2.846  -1.634
   71    HB3  PRO   9           HB3      PRO   9  -4.316  -2.966  -0.897
   72    HG2  PRO   9           HG2      PRO   9  -5.057  -3.206  -3.829
   73    HG3  PRO   9           HG3      PRO   9  -3.666  -2.356  -3.091
   74    HD2  PRO   9           HD2      PRO   9  -3.518  -4.884  -4.188
   75    HD3  PRO   9           HD3      PRO   9  -2.443  -4.331  -2.865
   76    H    SER  10           H        SER  10  -6.776  -6.388  -0.250
   77    HA   SER  10           HA       SER  10  -8.596  -7.001  -2.394
   78    HB2  SER  10           HB2      SER  10  -8.045  -8.621  -0.636
   79    HB3  SER  10           HB3      SER  10  -8.703  -7.530   0.593
   80    HG   SER  10           HG       SER  10 -10.713  -7.697  -0.521
   81    H    ALA  11           H        ALA  11  -8.588  -4.293  -2.392
   82    HA   ALA  11           HA       ALA  11 -10.400  -2.914  -0.691
   83    HB1  ALA  11           HB1      ALA  11 -10.259  -1.146  -2.417
   84    HB2  ALA  11           HB2      ALA  11  -8.654  -1.813  -2.055
   85    HB3  ALA  11           HB3      ALA  11  -9.509  -2.291  -3.539
   86    H    GLY  12           H        GLY  12 -11.125  -5.172  -3.155
   87    HA2  GLY  12           HA2      GLY  12 -13.580  -4.043  -4.176
   88    HA3  GLY  12           HA3      GLY  12 -13.040  -5.722  -4.317
   89    H    SER  13           H        SER  13 -12.914  -5.169  -1.121
   90    HA   SER  13           HA       SER  13 -14.984  -6.832  -0.379
   91    HB2  SER  13           HB2      SER  13 -12.811  -6.028   0.779
   92    HB3  SER  13           HB3      SER  13 -13.785  -4.707   1.420
   93    HG   SER  13           HG       SER  13 -14.060  -7.512   1.687
   94    H    CYS  14           H        CYS  14 -15.139  -3.165  -0.338
   95    HA   CYS  14           HA       CYS  14 -18.065  -3.396  -0.368
   96    HB2  CYS  14           HB2      CYS  14 -16.701  -1.607   1.677
   97    HB3  CYS  14           HB3      CYS  14 -18.416  -1.904   1.478
   98    H    PHE  15           H        PHE  15 -19.085  -1.276  -0.882
   99    HA   PHE  15           HA       PHE  15 -17.215   0.365  -2.524
  100    HB2  PHE  15           HB2      PHE  15 -19.181  -0.150  -3.746
  101    HB3  PHE  15           HB3      PHE  15 -20.226   0.177  -2.389
  102    HD1  PHE  15           HD2      PHE  15 -17.474   2.143  -4.101
  103    HD2  PHE  15           HD1      PHE  15 -21.549   2.046  -2.773
  104    HE1  PHE  15           HE2      PHE  15 -17.762   4.524  -4.777
  105    HE2  PHE  15           HE1      PHE  15 -21.897   4.361  -3.619
  106    HZ   PHE  15           HZ       PHE  15 -19.967   5.622  -4.568
  107    H    ALA  16           H        ALA  16 -16.155   1.611  -1.378
  108    HA   ALA  16           HA       ALA  16 -17.161   3.753   0.263
  109    HB1  ALA  16           HB1      ALA  16 -15.253   1.580   1.219
  110    HB2  ALA  16           HB2      ALA  16 -15.298   3.205   1.933
  111    HB3  ALA  16           HB3      ALA  16 -16.726   2.152   2.016
  112    H    PHE  17           H        PHE  17 -15.370   5.431   0.151
  113    HA   PHE  17           HA       PHE  17 -13.252   4.728  -1.830
  114    HB2  PHE  17           HB2      PHE  17 -15.268   5.933  -2.790
  115    HB3  PHE  17           HB3      PHE  17 -14.802   7.320  -1.809
  116    HD1  PHE  17           HD2      PHE  17 -13.235   4.833  -4.225
  117    HD2  PHE  17           HD1      PHE  17 -13.522   8.941  -2.939
  118    HE1  PHE  17           HE2      PHE  17 -11.645   5.498  -5.998
  119    HE2  PHE  17           HE1      PHE  17 -11.933   9.596  -4.707
  120    HZ   PHE  17           HZ       PHE  17 -10.936   7.876  -6.202
  121    H    VAL  18           H        VAL  18 -11.432   4.737  -0.668
  122    HA   VAL  18           HA       VAL  18 -10.750   7.209   0.779
  123    HB   VAL  18           HB       VAL  18  -9.716   5.735   2.588
  124   HG11  VAL  18          HG11      VAL  18 -11.662   7.275   2.877
  125   HG12  VAL  18          HG12      VAL  18 -12.762   5.943   2.480
  126   HG13  VAL  18          HG13      VAL  18 -11.746   5.861   3.929
  127   HG21  VAL  18          HG21      VAL  18 -10.920   3.670   3.173
  128   HG22  VAL  18          HG22      VAL  18 -11.905   3.782   1.698
  129   HG23  VAL  18          HG23      VAL  18 -10.160   3.492   1.588
  130    HA   PRO  19           HA       PRO  19  -7.719   5.875  -2.391
  131    HB2  PRO  19           HB2      PRO  19  -6.493   8.339  -2.723
  132    HB3  PRO  19           HB3      PRO  19  -7.971   7.804  -3.584
  133    HG2  PRO  19           HG2      PRO  19  -7.785   9.504  -1.082
  134    HG3  PRO  19           HG3      PRO  19  -8.790   9.777  -2.537
  135    HD2  PRO  19           HD2      PRO  19  -9.815   8.660  -0.317
  136    HD3  PRO  19           HD3      PRO  19 -10.300   8.043  -1.925
  137    H    SER  20           H        SER  20  -6.132   4.696  -1.531
  138    HA   SER  20           HA       SER  20  -4.501   5.875   0.633
  139    HB2  SER  20           HB2      SER  20  -5.300   2.977   0.550
  140    HB3  SER  20           HB3      SER  20  -4.436   3.836   1.817
  141    HG   SER  20           HG       SER  20  -7.076   4.410   0.940
  142    H    TYR  21           H        TYR  21  -2.356   4.225   0.818
  143    HA   TYR  21           HA       TYR  21  -1.127   4.484  -1.898
  144    HB2  TYR  21           HB2      TYR  21  -0.329   5.064   0.905
  145    HB3  TYR  21           HB3      TYR  21   0.877   4.435  -0.119
  146    HD1  TYR  21           HD2      TYR  21   1.779   5.990  -2.170
  147    HD2  TYR  21           HD1      TYR  21  -1.317   7.240   0.643
  148    HE1  TYR  21           HE2      TYR  21   1.975   8.220  -2.971
  149    HE2  TYR  21           HE1      TYR  21  -0.991   9.553  -0.093
  150    HH   TYR  21           HH       TYR  21   1.303  10.447  -2.726
  151    H    TYR  22           H        TYR  22  -0.061   2.916  -2.872
  152    HA   TYR  22           HA       TYR  22  -0.072   0.126  -1.847
  153    HB2  TYR  22           HB2      TYR  22  -1.234   1.045  -4.005
  154    HB3  TYR  22           HB3      TYR  22   0.366   1.232  -4.658
  155    HD1  TYR  22           HD1      TYR  22   1.940  -0.789  -4.836
  156    HD2  TYR  22           HD2      TYR  22  -2.329  -1.020  -4.380
  157    HE1  TYR  22           HE1      TYR  22   2.039  -3.162  -5.435
  158    HE2  TYR  22           HE2      TYR  22  -2.258  -3.383  -5.185
  159    HH   TYR  22           HH       TYR  22  -0.781  -5.268  -5.831
  160    H    TYR  23           H        TYR  23   1.873  -1.024  -1.750
  161    HA   TYR  23           HA       TYR  23   4.422   0.428  -2.305
  162    HB2  TYR  23           HB2      TYR  23   4.217  -0.681  -0.159
  163    HB3  TYR  23           HB3      TYR  23   3.746  -2.181  -0.936
  164    HD1  TYR  23           HD1      TYR  23   6.613   0.289  -1.105
  165    HD2  TYR  23           HD2      TYR  23   5.389  -3.838  -1.179
  166    HE1  TYR  23           HE1      TYR  23   8.952  -0.379  -1.224
  167    HE2  TYR  23           HE2      TYR  23   7.742  -4.518  -1.254
  168    HH   TYR  23           HH       TYR  23  10.483  -2.218  -1.491
  169    H    ASN  24           H        ASN  24   5.630   0.074  -4.233
  170    HA   ASN  24           HA       ASN  24   5.073  -2.477  -5.681
  171    HB2  ASN  24           HB2      ASN  24   5.692   0.268  -6.789
  172    HB3  ASN  24           HB3      ASN  24   5.807  -1.222  -7.720
  173   HD21  ASN  24          HD21      ASN  24   3.848   1.272  -7.408
  174   HD22  ASN  24          HD22      ASN  24   2.266   0.530  -7.627
  175    H    GLN  25           H        GLN  25   6.690  -3.571  -4.551
  176    HA   GLN  25           HA       GLN  25   9.362  -2.881  -4.179
  177    HB2  GLN  25           HB2      GLN  25   9.802  -5.414  -4.444
  178    HB3  GLN  25           HB3      GLN  25   8.809  -4.888  -3.122
  179    HG2  GLN  25           HG2      GLN  25   7.583  -5.866  -5.725
  180    HG3  GLN  25           HG3      GLN  25   8.082  -6.967  -4.441
  181   HE21  GLN  25          HE21      GLN  25   5.291  -5.299  -5.542
  182   HE22  GLN  25          HE22      GLN  25   4.549  -5.029  -3.999
  183    H    TYR  26           H        TYR  26   7.797  -4.117  -7.136
  184    HA   TYR  26           HA       TYR  26   9.954  -4.817  -8.705
  185    HB2  TYR  26           HB2      TYR  26   7.511  -3.207  -9.572
  186    HB3  TYR  26           HB3      TYR  26   8.574  -4.109 -10.631
  187    HD1  TYR  26           HD2      TYR  26   8.831  -6.698 -10.110
  188    HD2  TYR  26           HD1      TYR  26   5.492  -4.231  -8.911
  189    HE1  TYR  26           HE2      TYR  26   7.379  -8.694 -10.058
  190    HE2  TYR  26           HE1      TYR  26   4.041  -6.209  -8.875
  191    HH   TYR  26           HH       TYR  26   5.186  -9.439  -9.921
  192    H    SER  27           H        SER  27   8.814  -1.522  -7.918
  193    HA   SER  27           HA       SER  27  11.116  -0.426  -9.441
  194    HB2  SER  27           HB2      SER  27   8.713   0.006 -10.252
  195    HB3  SER  27           HB3      SER  27   8.549   1.054  -8.836
  196    HG   SER  27           HG       SER  27  10.435   1.238 -10.976
  197    H    ASN  28           H        ASN  28  10.596  -1.271  -6.399
  198    HA   ASN  28           HA       ASN  28  11.144  -0.553  -4.366
  199    HB2  ASN  28           HB2      ASN  28  13.333  -0.916  -5.418
  200    HB3  ASN  28           HB3      ASN  28  13.330   0.691  -6.099
  201   HD21  ASN  28          HD21      ASN  28  13.414  -0.952  -2.815
  202   HD22  ASN  28          HD22      ASN  28  14.536   0.268  -2.211
  203    H    THR  29           H        THR  29   9.003   0.933  -5.254
  204    HA   THR  29           HA       THR  29   9.326   3.330  -3.692
  205    HB   THR  29           HB       THR  29  10.041   4.058  -5.988
  206    HG1  THR  29           HG1      THR  29   8.507   5.862  -5.988
  207   HG21  THR  29          HG21      THR  29   8.318   4.443  -7.698
  208   HG22  THR  29          HG22      THR  29   7.120   3.574  -6.741
  209   HG23  THR  29          HG23      THR  29   8.534   2.716  -7.389
  210    H    CYS  30           H        CYS  30   6.831   4.509  -4.110
  211    HA   CYS  30           HA       CYS  30   4.857   2.333  -3.945
  212    HB2  CYS  30           HB2      CYS  30   4.776   4.530  -1.920
  213    HB3  CYS  30           HB3      CYS  30   4.206   2.858  -1.939
  214    H    HIS  31           H        HIS  31   2.683   3.142  -4.420
  215    HA   HIS  31           HA       HIS  31   2.536   5.917  -5.404
  216    HB2  HIS  31           HB2      HIS  31   3.215   4.125  -7.176
  217    HB3  HIS  31           HB3      HIS  31   1.551   3.567  -7.024
  218    HD1  HIS  31           HD1      HIS  31   0.073   4.688  -8.905
  219    HD2  HIS  31           HD2      HIS  31   3.216   7.082  -7.434
  220    HE1  HIS  31           HE1      HIS  31   0.016   6.832 -10.257
  221    H    SER  32           H        SER  32   0.322   6.738  -5.608
  222    HA   SER  32           HA       SER  32  -1.402   5.704  -3.572
  223    HB2  SER  32           HB2      SER  32  -2.958   7.384  -4.480
  224    HB3  SER  32           HB3      SER  32  -1.372   8.044  -4.049
  225    HG   SER  32           HG       SER  32  -2.185   8.777  -6.103
  226    H    PHE  33           H        PHE  33  -3.327   4.589  -3.745
  227    HA   PHE  33           HA       PHE  33  -4.377   3.711  -6.320
  228    HB2  PHE  33           HB2      PHE  33  -4.225   1.450  -6.008
  229    HB3  PHE  33           HB3      PHE  33  -2.654   1.997  -5.450
  230    HD1  PHE  33           HD2      PHE  33  -2.502   2.429  -2.840
  231    HD2  PHE  33           HD1      PHE  33  -5.566   0.052  -4.678
  232    HE1  PHE  33           HE2      PHE  33  -2.968   1.309  -0.646
  233    HE2  PHE  33           HE1      PHE  33  -6.146  -0.891  -2.509
  234    HZ   PHE  33           HZ       PHE  33  -4.756  -0.277  -0.453
  235    H    THR  34           H        THR  34  -6.477   2.177  -5.504
  236    HA   THR  34           HA       THR  34  -8.037   4.056  -3.758
  237    HB   THR  34           HB       THR  34 -10.003   2.940  -4.969
  238    HG1  THR  34           HG1      THR  34  -9.353   1.300  -6.093
  239   HG21  THR  34          HG21      THR  34  -8.021   4.551  -6.636
  240   HG22  THR  34          HG22      THR  34  -9.199   5.226  -5.500
  241   HG23  THR  34          HG23      THR  34  -9.751   4.367  -6.952
  242    H    TYR  35           H        TYR  35  -8.867   3.402  -1.778
  243    HA   TYR  35           HA       TYR  35  -8.936   0.483  -1.288
  244    HB2  TYR  35           HB2      TYR  35  -7.098   1.814  -0.110
  245    HB3  TYR  35           HB3      TYR  35  -8.355   2.500   0.870
  246    HD1  TYR  35           HD1      TYR  35  -6.987  -0.807  -0.332
  247    HD2  TYR  35           HD2      TYR  35  -8.708   1.428   2.949
  248    HE1  TYR  35           HE1      TYR  35  -6.256  -2.538   1.242
  249    HE2  TYR  35           HE2      TYR  35  -8.132  -0.414   4.489
  250    HH   TYR  35           HH       TYR  35  -7.181  -2.585   4.663
  251    H    SER  36           H        SER  36 -10.483  -0.031   0.619
  252    HA   SER  36           HA       SER  36 -12.876   1.742   0.574
  253    HB2  SER  36           HB2      SER  36 -14.168  -0.430   0.755
  254    HB3  SER  36           HB3      SER  36 -13.375  -0.087  -0.792
  255    HG   SER  36           HG       SER  36 -12.620  -1.970  -0.547
  256    H    GLY  37           H        GLY  37 -10.558   0.159   2.646
  257    HA2  GLY  37           HA2      GLY  37 -10.348   0.400   4.913
  258    HA3  GLY  37           HA3      GLY  37 -11.868   1.278   4.966
  259    H    CYS  38           H        CYS  38 -13.664  -0.800   3.968
  260    HA   CYS  38           HA       CYS  38 -14.038  -2.264   6.400
  261    HB2  CYS  38           HB2      CYS  38 -15.955  -3.111   5.463
  262    HB3  CYS  38           HB3      CYS  38 -15.777  -1.632   4.527
  263    H    GLY  39           H        GLY  39 -12.169  -2.939   3.600
  264    HA2  GLY  39           HA2      GLY  39 -11.368  -5.595   4.533
  265    HA3  GLY  39           HA3      GLY  39 -12.001  -5.446   2.873
  266    H    GLY  40           H        GLY  40  -9.908  -6.124   2.190
  267    HA2  GLY  40           HA2      GLY  40  -8.148  -5.113   0.884
  268    HA3  GLY  40           HA3      GLY  40  -7.982  -3.869   2.089
  269    H    ASN  41           H        ASN  41  -5.625  -4.736   1.722
  270    HA   ASN  41           HA       ASN  41  -5.083  -6.738   3.837
  271    HB2  ASN  41           HB2      ASN  41  -3.928  -6.784   1.013
  272    HB3  ASN  41           HB3      ASN  41  -3.080  -7.465   2.378
  273   HD21  ASN  41          HD21      ASN  41  -5.250  -8.373  -0.019
  274   HD22  ASN  41          HD22      ASN  41  -6.045  -9.706   0.816
  275    H    ALA  42           H        ALA  42  -2.871  -6.602   4.594
  276    HA   ALA  42           HA       ALA  42  -2.217  -4.114   5.536
  277    HB1  ALA  42           HB1      ALA  42  -1.490  -6.366   6.409
  278    HB2  ALA  42           HB2      ALA  42  -0.239  -6.374   5.136
  279    HB3  ALA  42           HB3      ALA  42  -0.221  -5.125   6.399
  280    H    ASN  43           H        ASN  43  -1.456  -5.120   2.274
  281    HA   ASN  43           HA       ASN  43   0.979  -3.698   1.878
  282    HB2  ASN  43           HB2      ASN  43   0.668  -4.834  -0.037
  283    HB3  ASN  43           HB3      ASN  43  -1.048  -5.059   0.270
  284   HD21  ASN  43          HD21      ASN  43   1.143  -3.527  -1.892
  285   HD22  ASN  43          HD22      ASN  43  -0.173  -2.714  -2.707
  286    H    ARG  44           H        ARG  44  -2.257  -2.522   2.390
  287    HA   ARG  44           HA       ARG  44  -1.937  -0.020   1.019
  288    HB2  ARG  44           HB2      ARG  44  -4.099  -1.111   1.438
  289    HB3  ARG  44           HB3      ARG  44  -3.872  -1.043   3.167
  290    HG2  ARG  44           HG2      ARG  44  -3.661   1.631   1.889
  291    HG3  ARG  44           HG3      ARG  44  -5.185   0.851   1.558
  292    HD2  ARG  44           HD2      ARG  44  -5.235   2.322   3.559
  293    HD3  ARG  44           HD3      ARG  44  -5.750   0.664   3.869
  294    HE   ARG  44           HE       ARG  44  -3.270   0.350   4.616
  295   HH11  ARG  44          HH11      ARG  44  -5.547   2.907   5.505
  296   HH12  ARG  44          HH12      ARG  44  -4.613   3.362   6.924
  297   HH21  ARG  44          HH21      ARG  44  -2.434   0.622   6.639
  298   HH22  ARG  44          HH22      ARG  44  -2.902   1.952   7.645
  299    H    PHE  45           H        PHE  45  -1.291   1.914   1.795
  300    HA   PHE  45           HA       PHE  45  -0.566   2.314   4.652
  301    HB2  PHE  45           HB2      PHE  45   0.970   3.138   2.143
  302    HB3  PHE  45           HB3      PHE  45   1.336   3.737   3.759
  303    HD1  PHE  45           HD1      PHE  45   2.127   2.192   5.567
  304    HD2  PHE  45           HD2      PHE  45   1.615   0.900   1.473
  305    HE1  PHE  45           HE1      PHE  45   3.462   0.160   6.031
  306    HE2  PHE  45           HE2      PHE  45   2.943  -1.100   1.938
  307    HZ   PHE  45           HZ       PHE  45   3.930  -1.458   4.209
  308    H    ARG  46           H        ARG  46  -0.215   4.788   4.938
  309    HA   ARG  46           HA       ARG  46  -2.511   6.221   3.705
  310    HB2  ARG  46           HB2      ARG  46  -2.112   7.784   5.733
  311    HB3  ARG  46           HB3      ARG  46  -2.981   6.277   5.914
  312    HG2  ARG  46           HG2      ARG  46  -1.471   6.696   7.790
  313    HG3  ARG  46           HG3      ARG  46  -1.131   5.183   6.984
  314    HD2  ARG  46           HD2      ARG  46   0.896   6.303   7.656
  315    HD3  ARG  46           HD3      ARG  46   0.852   6.185   5.910
  316    HE   ARG  46           HE       ARG  46   0.498   8.522   5.709
  317   HH11  ARG  46          HH11      ARG  46   1.126   7.558   9.127
  318   HH12  ARG  46          HH12      ARG  46   1.545   9.174   9.564
  319   HH21  ARG  46          HH21      ARG  46   0.762  10.659   6.458
  320   HH22  ARG  46          HH22      ARG  46   1.243  10.967   8.069
  321    H    THR  47           H        THR  47   0.957   6.080   3.599
  322    HA   THR  47           HA       THR  47   0.968   8.244   1.802
  323    HB   THR  47           HB       THR  47   1.017   9.462   4.005
  324    HG1  THR  47           HG1      THR  47   1.840  10.767   2.562
  325   HG21  THR  47          HG21      THR  47   2.987   9.408   5.358
  326   HG22  THR  47          HG22      THR  47   3.872   8.492   4.144
  327   HG23  THR  47          HG23      THR  47   2.612   7.684   5.044
  328    H    ILE  48           H        ILE  48   3.004   8.524   0.736
  329    HA   ILE  48           HA       ILE  48   4.301   6.003   0.264
  330    HB   ILE  48           HB       ILE  48   4.079   7.415  -1.587
  331   HG12  ILE  48          HG12      ILE  48   7.011   7.489  -0.706
  332   HG13  ILE  48          HG13      ILE  48   6.190   6.132  -1.423
  333   HG21  ILE  48          HG21      ILE  48   3.821   9.638  -0.491
  334   HG22  ILE  48          HG22      ILE  48   5.564   9.653  -0.124
  335   HG23  ILE  48          HG23      ILE  48   4.978   9.705  -1.794
  336   HD11  ILE  48          HD11      ILE  48   5.785   7.520  -3.488
  337   HD12  ILE  48          HD12      ILE  48   6.812   8.783  -2.772
  338   HD13  ILE  48          HD13      ILE  48   7.482   7.187  -3.133
  339    H    ASP  49           H        ASP  49   4.940   8.821   2.372
  340    HA   ASP  49           HA       ASP  49   7.702   8.279   2.792
  341    HB2  ASP  49           HB2      ASP  49   6.620  10.374   3.453
  342    HB3  ASP  49           HB3      ASP  49   5.764   9.528   4.741
  343    H    GLU  50           H        GLU  50   4.777   7.050   4.459
  344    HA   GLU  50           HA       GLU  50   6.336   5.593   6.421
  345    HB2  GLU  50           HB2      GLU  50   3.416   5.464   5.577
  346    HB3  GLU  50           HB3      GLU  50   4.108   4.450   6.844
  347    HG2  GLU  50           HG2      GLU  50   3.959   7.495   6.876
  348    HG3  GLU  50           HG3      GLU  50   3.019   6.374   7.861
  349    H    CYS  51           H        CYS  51   4.679   4.890   3.325
  350    HA   CYS  51           HA       CYS  51   5.078   2.121   3.360
  351    HB2  CYS  51           HB2      CYS  51   3.564   3.122   1.814
  352    HB3  CYS  51           HB3      CYS  51   4.830   4.156   1.131
  353    H    ASN  52           H        ASN  52   7.151   4.754   2.070
  354    HA   ASN  52           HA       ASN  52   9.068   2.898   1.064
  355    HB2  ASN  52           HB2      ASN  52  10.207   4.598   0.100
  356    HB3  ASN  52           HB3      ASN  52   8.598   5.259   0.145
  357   HD21  ASN  52          HD21      ASN  52   8.508   7.310   0.862
  358   HD22  ASN  52          HD22      ASN  52   9.758   8.158   1.743
  359    H    ARG  53           H        ARG  53   9.149   5.144   3.864
  360    HA   ARG  53           HA       ARG  53  11.579   4.146   4.803
  361    HB2  ARG  53           HB2      ARG  53  11.233   5.298   6.795
  362    HB3  ARG  53           HB3      ARG  53  10.230   6.174   5.619
  363    HG2  ARG  53           HG2      ARG  53   8.282   4.782   6.453
  364    HG3  ARG  53           HG3      ARG  53   9.305   4.235   7.778
  365    HD2  ARG  53           HD2      ARG  53   8.652   7.148   7.142
  366    HD3  ARG  53           HD3      ARG  53   7.838   6.180   8.359
  367    HE   ARG  53           HE       ARG  53  10.558   7.277   8.458
  368   HH11  ARG  53          HH11      ARG  53   8.159   5.178  10.031
  369   HH12  ARG  53          HH12      ARG  53   8.893   5.223  11.590
  370   HH21  ARG  53          HH21      ARG  53  11.703   7.137  10.448
  371   HH22  ARG  53          HH22      ARG  53  10.970   6.411  11.838
  372    H    THR  54           H        THR  54   8.503   2.465   5.019
  373    HA   THR  54           HA       THR  54   9.646   0.568   6.967
  374    HB   THR  54           HB       THR  54   7.363   1.688   7.167
  375    HG1  THR  54           HG1      THR  54   7.844  -1.060   7.442
  376   HG21  THR  54          HG21      THR  54   6.718   0.820   4.714
  377   HG22  THR  54          HG22      THR  54   5.546   0.979   6.004
  378   HG23  THR  54          HG23      THR  54   6.237  -0.631   5.611
  379    H    CYS  55           H        CYS  55   9.376   0.766   3.501
  380    HA   CYS  55           HA       CYS  55   9.948  -2.161   3.398
  381    HB2  CYS  55           HB2      CYS  55   8.054  -0.729   1.510
  382    HB3  CYS  55           HB3      CYS  55   8.446  -2.445   1.523
  383    H    VAL  56           H        VAL  56  10.225   0.978   1.696
  384    HA   VAL  56           HA       VAL  56  11.585  -0.093  -0.601
  385    HB   VAL  56           HB       VAL  56  11.313   2.669   0.580
  386   HG11  VAL  56          HG11      VAL  56  12.318   3.671  -1.316
  387   HG12  VAL  56          HG12      VAL  56  13.517   2.643  -0.538
  388   HG13  VAL  56          HG13      VAL  56  12.708   2.095  -2.030
  389   HG21  VAL  56          HG21      VAL  56   9.988   3.020  -1.515
  390   HG22  VAL  56          HG22      VAL  56  10.341   1.365  -2.008
  391   HG23  VAL  56          HG23      VAL  56   9.329   1.666  -0.588
  392    H    GLY  57           H        GLY  57  13.382  -1.051  -0.603
  393    HA2  GLY  57           HA2      GLY  57  15.300  -0.906   1.635
  394    HA3  GLY  57           HA3      GLY  57  15.361  -1.990   0.213
  Start of MODEL    7
    1    H1   ARG   1           H        ARG   1  12.846  -4.765   1.696
    2    HA   ARG   1           HA       ARG   1  10.733  -4.151   2.688
    3    HB2  ARG   1           HB2      ARG   1   9.156  -4.867   0.827
    4    HB3  ARG   1           HB3      ARG   1  10.507  -3.828   0.467
    5    HG2  ARG   1           HG2      ARG   1  10.798  -6.813  -0.052
    6    HG3  ARG   1           HG3      ARG   1   9.802  -5.805  -1.078
    7    HD2  ARG   1           HD2      ARG   1  11.630  -5.523  -2.313
    8    HD3  ARG   1           HD3      ARG   1  11.901  -4.231  -1.203
    9    HE   ARG   1           HE       ARG   1  13.779  -5.272  -0.381
   10   HH11  ARG   1          HH11      ARG   1  11.949  -7.632  -2.357
   11   HH12  ARG   1          HH12      ARG   1  13.343  -8.598  -2.703
   12   HH21  ARG   1          HH21      ARG   1  15.474  -6.712  -0.565
   13   HH22  ARG   1          HH22      ARG   1  15.393  -8.125  -1.595
   14    HA   PRO   2           HA       PRO   2   9.236  -7.570   5.110
   15    HB2  PRO   2           HB2      PRO   2   7.088  -6.336   6.292
   16    HB3  PRO   2           HB3      PRO   2   8.768  -6.054   6.797
   17    HG2  PRO   2           HG2      PRO   2   7.104  -4.387   4.915
   18    HG3  PRO   2           HG3      PRO   2   8.126  -3.824   6.285
   19    HD2  PRO   2           HD2      PRO   2   9.018  -3.771   3.730
   20    HD3  PRO   2           HD3      PRO   2  10.122  -4.210   5.066
   21    H    ARG   3           H        ARG   3   7.652  -9.119   4.861
   22    HA   ARG   3           HA       ARG   3   6.359  -9.253   2.388
   23    HB2  ARG   3           HB2      ARG   3   5.502 -11.339   2.998
   24    HB3  ARG   3           HB3      ARG   3   7.036 -11.172   3.818
   25    HG2  ARG   3           HG2      ARG   3   5.789 -12.099   5.493
   26    HG3  ARG   3           HG3      ARG   3   5.549 -10.398   5.890
   27    HD2  ARG   3           HD2      ARG   3   3.335 -10.427   4.827
   28    HD3  ARG   3           HD3      ARG   3   3.631 -12.013   4.136
   29    HE   ARG   3           HE       ARG   3   2.898 -11.342   6.903
   30   HH11  ARG   3          HH11      ARG   3   3.951 -13.958   4.715
   31   HH12  ARG   3          HH12      ARG   3   3.134 -15.197   5.604
   32   HH21  ARG   3          HH21      ARG   3   1.889 -13.045   8.130
   33   HH22  ARG   3          HH22      ARG   3   1.953 -14.659   7.520
   34    H    PHE   4           H        PHE   4   5.087  -7.611   5.217
   35    HA   PHE   4           HA       PHE   4   2.333  -7.907   4.399
   36    HB2  PHE   4           HB2      PHE   4   1.783  -6.378   6.056
   37    HB3  PHE   4           HB3      PHE   4   3.158  -7.230   6.712
   38    HD1  PHE   4           HD2      PHE   4   2.002  -4.073   5.106
   39    HD2  PHE   4           HD1      PHE   4   5.158  -6.005   7.304
   40    HE1  PHE   4           HE2      PHE   4   3.076  -1.853   5.577
   41    HE2  PHE   4           HE1      PHE   4   6.222  -3.804   7.729
   42    HZ   PHE   4           HZ       PHE   4   5.163  -1.727   6.866
   43    H    CYS   5           H        CYS   5   4.981  -5.827   3.283
   44    HA   CYS   5           HA       CYS   5   3.276  -3.842   2.115
   45    HB2  CYS   5           HB2      CYS   5   6.114  -4.356   2.493
   46    HB3  CYS   5           HB3      CYS   5   5.825  -3.925   0.829
   47    H    GLU   6           H        GLU   6   4.078  -7.063   1.140
   48    HA   GLU   6           HA       GLU   6   3.600  -6.400  -1.725
   49    HB2  GLU   6           HB2      GLU   6   4.753  -8.317  -2.327
   50    HB3  GLU   6           HB3      GLU   6   5.665  -7.541  -1.032
   51    HG2  GLU   6           HG2      GLU   6   5.179  -9.198   0.535
   52    HG3  GLU   6           HG3      GLU   6   3.889  -9.915  -0.431
   53    H    LEU   7           H        LEU   7   1.396  -6.735   0.461
   54    HA   LEU   7           HA       LEU   7   0.082  -9.200  -0.493
   55    HB2  LEU   7           HB2      LEU   7  -0.948  -7.072   1.389
   56    HB3  LEU   7           HB3      LEU   7  -1.648  -8.677   1.097
   57    HG   LEU   7           HG       LEU   7   0.994  -8.002   2.434
   58   HD11  LEU   7          HD11      LEU   7  -1.372  -9.534   3.537
   59   HD12  LEU   7          HD12      LEU   7  -1.196  -7.782   3.691
   60   HD13  LEU   7          HD13      LEU   7   0.024  -8.840   4.412
   61   HD21  LEU   7          HD21      LEU   7  -0.074 -10.778   1.884
   62   HD22  LEU   7          HD22      LEU   7   1.364 -10.350   2.855
   63   HD23  LEU   7          HD23      LEU   7   1.370 -10.051   1.133
   64    H    ALA   8           H        ALA   8  -2.228  -8.967  -1.213
   65    HA   ALA   8           HA       ALA   8  -2.297  -6.943  -3.390
   66    HB1  ALA   8           HB1      ALA   8  -4.023  -9.400  -2.944
   67    HB2  ALA   8           HB2      ALA   8  -3.963  -8.375  -4.392
   68    HB3  ALA   8           HB3      ALA   8  -2.559  -9.358  -3.957
   69    HA   PRO   9           HA       PRO   9  -5.163  -4.952  -0.641
   70    HB2  PRO   9           HB2      PRO   9  -6.204  -2.952  -2.222
   71    HB3  PRO   9           HB3      PRO   9  -4.554  -2.892  -1.533
   72    HG2  PRO   9           HG2      PRO   9  -5.363  -3.789  -4.299
   73    HG3  PRO   9           HG3      PRO   9  -4.059  -2.662  -3.826
   74    HD2  PRO   9           HD2      PRO   9  -3.579  -5.308  -4.352
   75    HD3  PRO   9           HD3      PRO   9  -2.671  -4.434  -3.074
   76    H    SER  10           H        SER  10  -6.862  -6.142  -0.121
   77    HA   SER  10           HA       SER  10  -8.774  -7.168  -2.024
   78    HB2  SER  10           HB2      SER  10  -7.933  -8.377   0.026
   79    HB3  SER  10           HB3      SER  10  -8.829  -7.237   1.018
   80    HG   SER  10           HG       SER  10 -10.172  -8.845   0.849
   81    H    ALA  11           H        ALA  11  -8.799  -4.480  -2.385
   82    HA   ALA  11           HA       ALA  11 -10.615  -2.982  -0.738
   83    HB1  ALA  11           HB1      ALA  11  -9.668  -2.469  -3.593
   84    HB2  ALA  11           HB2      ALA  11 -10.412  -1.280  -2.507
   85    HB3  ALA  11           HB3      ALA  11  -8.825  -1.953  -2.112
   86    H    GLY  12           H        GLY  12 -11.338  -5.435  -3.040
   87    HA2  GLY  12           HA2      GLY  12 -13.814  -4.255  -4.031
   88    HA3  GLY  12           HA3      GLY  12 -13.227  -5.904  -4.257
   89    H    SER  13           H        SER  13 -12.979  -5.608  -1.059
   90    HA   SER  13           HA       SER  13 -14.919  -7.355  -0.332
   91    HB2  SER  13           HB2      SER  13 -12.847  -6.292   0.896
   92    HB3  SER  13           HB3      SER  13 -14.064  -5.232   1.623
   93    HG   SER  13           HG       SER  13 -13.888  -8.064   1.643
   94    H    CYS  14           H        CYS  14 -15.331  -3.756   0.134
   95    HA   CYS  14           HA       CYS  14 -18.243  -4.121  -0.071
   96    HB2  CYS  14           HB2      CYS  14 -17.230  -2.431   2.183
   97    HB3  CYS  14           HB3      CYS  14 -18.772  -3.237   2.015
   98    H    PHE  15           H        PHE  15 -19.223  -1.719   0.039
   99    HA   PHE  15           HA       PHE  15 -17.624  -0.237  -1.938
  100    HB2  PHE  15           HB2      PHE  15 -20.141  -0.679  -2.006
  101    HB3  PHE  15           HB3      PHE  15 -20.303   0.560  -0.770
  102    HD1  PHE  15           HD1      PHE  15 -18.734   2.835  -1.484
  103    HD2  PHE  15           HD2      PHE  15 -20.696   0.025  -4.129
  104    HE1  PHE  15           HE1      PHE  15 -18.692   4.500  -3.292
  105    HE2  PHE  15           HE2      PHE  15 -20.725   1.757  -5.906
  106    HZ   PHE  15           HZ       PHE  15 -19.727   3.985  -5.485
  107    H    ALA  16           H        ALA  16 -15.972   0.872  -1.045
  108    HA   ALA  16           HA       ALA  16 -16.531   2.995   0.856
  109    HB1  ALA  16           HB1      ALA  16 -14.540   0.771   1.439
  110    HB2  ALA  16           HB2      ALA  16 -14.554   2.349   2.251
  111    HB3  ALA  16           HB3      ALA  16 -15.941   1.243   2.398
  112    H    PHE  17           H        PHE  17 -15.244   4.760   0.192
  113    HA   PHE  17           HA       PHE  17 -13.121   4.185  -1.828
  114    HB2  PHE  17           HB2      PHE  17 -15.296   4.927  -2.782
  115    HB3  PHE  17           HB3      PHE  17 -15.188   6.399  -1.827
  116    HD1  PHE  17           HD2      PHE  17 -12.045   5.142  -3.424
  117    HD2  PHE  17           HD1      PHE  17 -15.559   7.621  -3.931
  118    HE1  PHE  17           HE2      PHE  17 -10.954   6.339  -5.274
  119    HE2  PHE  17           HE1      PHE  17 -14.429   8.799  -5.804
  120    HZ   PHE  17           HZ       PHE  17 -12.117   8.184  -6.442
  121    H    VAL  18           H        VAL  18 -11.295   4.512  -0.701
  122    HA   VAL  18           HA       VAL  18 -10.832   7.166   0.501
  123    HB   VAL  18           HB       VAL  18  -9.610   5.951   2.380
  124   HG11  VAL  18          HG11      VAL  18 -11.608   5.838   3.757
  125   HG12  VAL  18          HG12      VAL  18 -11.777   7.188   2.631
  126   HG13  VAL  18          HG13      VAL  18 -12.654   5.682   2.325
  127   HG21  VAL  18          HG21      VAL  18  -9.738   3.608   1.464
  128   HG22  VAL  18          HG22      VAL  18 -10.438   3.763   3.081
  129   HG23  VAL  18          HG23      VAL  18 -11.495   3.646   1.658
  130    HA   PRO  19           HA       PRO  19  -7.390   6.274  -2.336
  131    HB2  PRO  19           HB2      PRO  19  -6.101   8.714  -2.227
  132    HB3  PRO  19           HB3      PRO  19  -7.509   8.354  -3.256
  133    HG2  PRO  19           HG2      PRO  19  -7.447   9.743  -0.578
  134    HG3  PRO  19           HG3      PRO  19  -8.394  10.162  -2.030
  135    HD2  PRO  19           HD2      PRO  19  -9.440   8.793   0.115
  136    HD3  PRO  19           HD3      PRO  19 -10.004   8.510  -1.551
  137    H    SER  20           H        SER  20  -5.824   4.954  -1.525
  138    HA   SER  20           HA       SER  20  -4.205   5.906   0.767
  139    HB2  SER  20           HB2      SER  20  -5.115   3.063   0.397
  140    HB3  SER  20           HB3      SER  20  -4.177   3.766   1.701
  141    HG   SER  20           HG       SER  20  -6.804   4.521   0.989
  142    H    TYR  21           H        TYR  21  -2.197   4.003   0.792
  143    HA   TYR  21           HA       TYR  21  -0.904   4.463  -1.877
  144    HB2  TYR  21           HB2      TYR  21   0.023   4.723   0.929
  145    HB3  TYR  21           HB3      TYR  21   1.180   4.165  -0.251
  146    HD1  TYR  21           HD1      TYR  21  -0.932   6.986   0.788
  147    HD2  TYR  21           HD2      TYR  21   2.106   5.667  -2.013
  148    HE1  TYR  21           HE1      TYR  21  -0.466   9.313   0.198
  149    HE2  TYR  21           HE2      TYR  21   2.442   7.981  -2.729
  150    HH   TYR  21           HH       TYR  21   0.856  10.743  -1.058
  151    H    TYR  22           H        TYR  22   0.030   2.903  -2.934
  152    HA   TYR  22           HA       TYR  22  -0.126   0.087  -2.085
  153    HB2  TYR  22           HB2      TYR  22  -1.208   1.151  -4.255
  154    HB3  TYR  22           HB3      TYR  22   0.414   1.317  -4.840
  155    HD1  TYR  22           HD1      TYR  22   1.830  -0.775  -5.247
  156    HD2  TYR  22           HD2      TYR  22  -2.394  -0.872  -4.371
  157    HE1  TYR  22           HE1      TYR  22   1.724  -3.043  -6.164
  158    HE2  TYR  22           HE2      TYR  22  -2.496  -3.186  -5.328
  159    HH   TYR  22           HH       TYR  22   0.318  -4.750  -6.839
  160    H    TYR  23           H        TYR  23   1.789  -1.175  -2.351
  161    HA   TYR  23           HA       TYR  23   4.342   0.404  -2.778
  162    HB2  TYR  23           HB2      TYR  23   4.316  -0.272  -0.539
  163    HB3  TYR  23           HB3      TYR  23   3.747  -1.898  -0.931
  164    HD1  TYR  23           HD2      TYR  23   5.295  -3.575  -1.844
  165    HD2  TYR  23           HD1      TYR  23   6.652   0.376  -0.765
  166    HE1  TYR  23           HE2      TYR  23   7.635  -4.345  -1.858
  167    HE2  TYR  23           HE1      TYR  23   8.995  -0.377  -0.920
  168    HH   TYR  23           HH       TYR  23  10.466  -2.163  -1.524
  169    H    ASN  24           H        ASN  24   5.779  -0.233  -4.327
  170    HA   ASN  24           HA       ASN  24   5.201  -2.774  -5.770
  171    HB2  ASN  24           HB2      ASN  24   5.963  -0.089  -6.978
  172    HB3  ASN  24           HB3      ASN  24   5.922  -1.621  -7.840
  173   HD21  ASN  24          HD21      ASN  24   4.039   1.098  -6.922
  174   HD22  ASN  24          HD22      ASN  24   2.528   0.466  -7.556
  175    H    GLN  25           H        GLN  25   6.883  -3.873  -4.581
  176    HA   GLN  25           HA       GLN  25   9.518  -3.015  -4.188
  177    HB2  GLN  25           HB2      GLN  25  10.166  -5.485  -4.438
  178    HB3  GLN  25           HB3      GLN  25   9.083  -5.091  -3.154
  179    HG2  GLN  25           HG2      GLN  25   8.049  -6.142  -5.837
  180    HG3  GLN  25           HG3      GLN  25   8.606  -7.190  -4.547
  181   HE21  GLN  25          HE21      GLN  25   5.740  -5.617  -5.717
  182   HE22  GLN  25          HE22      GLN  25   4.901  -5.682  -4.200
  183    H    TYR  26           H        TYR  26   8.060  -4.377  -7.115
  184    HA   TYR  26           HA       TYR  26  10.300  -4.994  -8.615
  185    HB2  TYR  26           HB2      TYR  26   7.740  -3.696  -9.595
  186    HB3  TYR  26           HB3      TYR  26   8.831  -4.698 -10.530
  187    HD1  TYR  26           HD2      TYR  26   9.294  -7.110  -9.106
  188    HD2  TYR  26           HD1      TYR  26   5.711  -4.707  -9.026
  189    HE1  TYR  26           HE2      TYR  26   7.981  -9.102  -8.429
  190    HE2  TYR  26           HE1      TYR  26   4.401  -6.701  -8.348
  191    HH   TYR  26           HH       TYR  26   5.777  -9.972  -8.061
  192    H    SER  27           H        SER  27   8.914  -1.800  -7.931
  193    HA   SER  27           HA       SER  27  11.035  -0.549  -9.570
  194    HB2  SER  27           HB2      SER  27   8.503  -0.257 -10.115
  195    HB3  SER  27           HB3      SER  27   8.457   0.780  -8.699
  196    HG   SER  27           HG       SER  27  10.209   1.000 -10.932
  197    H    ASN  28           H        ASN  28  10.658  -1.470  -6.472
  198    HA   ASN  28           HA       ASN  28  11.280  -0.761  -4.466
  199    HB2  ASN  28           HB2      ASN  28  13.440  -1.003  -5.580
  200    HB3  ASN  28           HB3      ASN  28  13.319   0.581  -6.311
  201   HD21  ASN  28          HD21      ASN  28  13.133  -0.540  -2.788
  202   HD22  ASN  28          HD22      ASN  28  14.424   0.591  -2.367
  203    H    THR  29           H        THR  29   9.039   0.658  -5.323
  204    HA   THR  29           HA       THR  29   9.358   3.067  -3.778
  205    HB   THR  29           HB       THR  29  10.077   3.801  -6.067
  206    HG1  THR  29           HG1      THR  29   8.496   5.616  -6.009
  207   HG21  THR  29          HG21      THR  29   8.528   2.488  -7.459
  208   HG22  THR  29          HG22      THR  29   8.412   4.220  -7.785
  209   HG23  THR  29          HG23      THR  29   7.150   3.425  -6.833
  210    H    CYS  30           H        CYS  30   7.008   4.256  -4.280
  211    HA   CYS  30           HA       CYS  30   4.860   2.284  -3.758
  212    HB2  CYS  30           HB2      CYS  30   5.646   4.876  -2.386
  213    HB3  CYS  30           HB3      CYS  30   4.125   4.079  -2.104
  214    H    HIS  31           H        HIS  31   2.703   3.403  -4.076
  215    HA   HIS  31           HA       HIS  31   2.739   5.910  -5.515
  216    HB2  HIS  31           HB2      HIS  31   3.323   3.888  -7.139
  217    HB3  HIS  31           HB3      HIS  31   1.624   3.487  -6.972
  218    HD1  HIS  31           HD1      HIS  31   0.760   4.320  -9.402
  219    HD2  HIS  31           HD2      HIS  31   3.252   7.000  -7.318
  220    HE1  HIS  31           HE1      HIS  31   0.686   6.496 -10.692
  221    H    SER  32           H        SER  32   0.671   6.927  -5.386
  222    HA   SER  32           HA       SER  32  -1.117   5.834  -3.435
  223    HB2  SER  32           HB2      SER  32  -2.530   7.721  -3.997
  224    HB3  SER  32           HB3      SER  32  -0.854   8.229  -3.752
  225    HG   SER  32           HG       SER  32  -2.128   7.772  -6.247
  226    H    PHE  33           H        PHE  33  -3.086   4.777  -3.687
  227    HA   PHE  33           HA       PHE  33  -4.137   4.181  -6.373
  228    HB2  PHE  33           HB2      PHE  33  -4.119   1.894  -6.211
  229    HB3  PHE  33           HB3      PHE  33  -2.529   2.318  -5.604
  230    HD1  PHE  33           HD2      PHE  33  -2.437   2.599  -2.942
  231    HD2  PHE  33           HD1      PHE  33  -5.440   0.340  -5.012
  232    HE1  PHE  33           HE2      PHE  33  -2.937   1.301  -0.843
  233    HE2  PHE  33           HE1      PHE  33  -6.009  -0.825  -2.932
  234    HZ   PHE  33           HZ       PHE  33  -4.685  -0.342  -0.807
  235    H    THR  34           H        THR  34  -6.333   2.675  -5.783
  236    HA   THR  34           HA       THR  34  -7.832   4.405  -3.867
  237    HB   THR  34           HB       THR  34  -9.833   3.549  -5.085
  238    HG1  THR  34           HG1      THR  34  -9.440   1.876  -6.249
  239   HG21  THR  34          HG21      THR  34  -7.772   4.953  -6.839
  240   HG22  THR  34          HG22      THR  34  -8.758   5.729  -5.589
  241   HG23  THR  34          HG23      THR  34  -9.538   5.007  -7.013
  242    H    TYR  35           H        TYR  35  -8.472   3.588  -1.924
  243    HA   TYR  35           HA       TYR  35  -8.499   0.650  -1.646
  244    HB2  TYR  35           HB2      TYR  35  -6.661   1.604  -0.426
  245    HB3  TYR  35           HB3      TYR  35  -7.734   2.727   0.399
  246    HD1  TYR  35           HD1      TYR  35  -6.921  -0.905  -0.120
  247    HD2  TYR  35           HD2      TYR  35  -8.465   2.099   2.587
  248    HE1  TYR  35           HE1      TYR  35  -6.900  -2.520   1.704
  249    HE2  TYR  35           HE2      TYR  35  -8.416   0.453   4.428
  250    HH   TYR  35           HH       TYR  35  -8.254  -1.955   4.900
  251    H    SER  36           H        SER  36  -9.881   0.013   0.264
  252    HA   SER  36           HA       SER  36 -12.350   1.559   0.619
  253    HB2  SER  36           HB2      SER  36 -12.040  -1.374  -0.187
  254    HB3  SER  36           HB3      SER  36 -13.580  -0.576   0.136
  255    HG   SER  36           HG       SER  36 -13.165   0.844  -1.573
  256    H    GLY  37           H        GLY  37 -12.478   1.781   2.862
  257    HA2  GLY  37           HA2      GLY  37 -10.641   0.787   4.674
  258    HA3  GLY  37           HA3      GLY  37 -12.254   1.373   5.071
  259    H    CYS  38           H        CYS  38 -13.653  -0.672   3.606
  260    HA   CYS  38           HA       CYS  38 -13.825  -2.749   5.617
  261    HB2  CYS  38           HB2      CYS  38 -15.640  -1.578   4.108
  262    HB3  CYS  38           HB3      CYS  38 -15.098  -2.704   2.868
  263    H    GLY  39           H        GLY  39 -12.813  -4.793   5.487
  264    HA2  GLY  39           HA2      GLY  39 -11.707  -6.592   4.605
  265    HA3  GLY  39           HA3      GLY  39 -12.112  -6.033   2.970
  266    H    GLY  40           H        GLY  40 -10.322  -5.699   1.793
  267    HA2  GLY  40           HA2      GLY  40  -8.276  -4.799   1.172
  268    HA3  GLY  40           HA3      GLY  40  -8.308  -3.866   2.662
  269    H    ASN  41           H        ASN  41  -5.864  -4.710   2.031
  270    HA   ASN  41           HA       ASN  41  -5.292  -6.898   3.981
  271    HB2  ASN  41           HB2      ASN  41  -4.119  -6.709   1.162
  272    HB3  ASN  41           HB3      ASN  41  -3.285  -7.473   2.471
  273   HD21  ASN  41          HD21      ASN  41  -6.764  -8.053   2.665
  274   HD22  ASN  41          HD22      ASN  41  -6.627  -9.690   2.058
  275    H    ALA  42           H        ALA  42  -2.915  -6.787   4.626
  276    HA   ALA  42           HA       ALA  42  -2.386  -4.277   5.690
  277    HB1  ALA  42           HB1      ALA  42  -0.292  -6.402   5.180
  278    HB2  ALA  42           HB2      ALA  42  -0.340  -5.198   6.480
  279    HB3  ALA  42           HB3      ALA  42  -1.535  -6.514   6.466
  280    H    ASN  43           H        ASN  43  -1.712  -5.095   2.303
  281    HA   ASN  43           HA       ASN  43   0.654  -3.452   2.206
  282    HB2  ASN  43           HB2      ASN  43   0.814  -3.860   0.000
  283    HB3  ASN  43           HB3      ASN  43  -0.083  -5.276   0.508
  284   HD21  ASN  43          HD21      ASN  43   0.075  -3.021  -1.886
  285   HD22  ASN  43          HD22      ASN  43  -1.595  -2.993  -2.372
  286    H    ARG  44           H        ARG  44  -2.342  -2.341   3.014
  287    HA   ARG  44           HA       ARG  44  -2.266   0.037   1.253
  288    HB2  ARG  44           HB2      ARG  44  -4.460  -0.879   1.640
  289    HB3  ARG  44           HB3      ARG  44  -4.226  -0.966   3.395
  290    HG2  ARG  44           HG2      ARG  44  -3.902   1.695   2.050
  291    HG3  ARG  44           HG3      ARG  44  -5.516   1.051   2.123
  292    HD2  ARG  44           HD2      ARG  44  -5.467   0.912   4.557
  293    HD3  ARG  44           HD3      ARG  44  -3.774   1.434   4.563
  294    HE   ARG  44           HE       ARG  44  -5.618   3.242   3.208
  295   HH11  ARG  44          HH11      ARG  44  -4.124   2.521   6.341
  296   HH12  ARG  44          HH12      ARG  44  -4.116   4.159   6.900
  297   HH21  ARG  44          HH21      ARG  44  -5.570   5.348   3.816
  298   HH22  ARG  44          HH22      ARG  44  -5.050   5.850   5.398
  299    H    PHE  45           H        PHE  45  -1.421   1.944   1.993
  300    HA   PHE  45           HA       PHE  45  -0.779   2.226   4.887
  301    HB2  PHE  45           HB2      PHE  45   1.052   3.398   2.832
  302    HB3  PHE  45           HB3      PHE  45   1.410   2.930   4.474
  303    HD1  PHE  45           HD1      PHE  45   1.070   0.185   4.909
  304    HD2  PHE  45           HD2      PHE  45   1.586   2.096   1.126
  305    HE1  PHE  45           HE1      PHE  45   1.753  -1.984   3.884
  306    HE2  PHE  45           HE2      PHE  45   2.309  -0.021   0.119
  307    HZ   PHE  45           HZ       PHE  45   2.468  -2.057   1.488
  308    H    ARG  46           H        ARG  46  -0.063   4.741   5.129
  309    HA   ARG  46           HA       ARG  46  -2.340   6.278   3.943
  310    HB2  ARG  46           HB2      ARG  46  -1.916   7.795   5.994
  311    HB3  ARG  46           HB3      ARG  46  -2.803   6.296   6.149
  312    HG2  ARG  46           HG2      ARG  46  -1.268   6.691   8.040
  313    HG3  ARG  46           HG3      ARG  46  -1.009   5.171   7.216
  314    HD2  ARG  46           HD2      ARG  46   1.120   6.127   7.799
  315    HD3  ARG  46           HD3      ARG  46   0.986   6.144   6.066
  316    HE   ARG  46           HE       ARG  46   0.664   8.517   6.065
  317   HH11  ARG  46          HH11      ARG  46   1.682   7.192   9.232
  318   HH12  ARG  46          HH12      ARG  46   2.167   8.740   9.811
  319   HH21  ARG  46          HH21      ARG  46   1.033  10.595   7.026
  320   HH22  ARG  46          HH22      ARG  46   1.740  10.677   8.591
  321    H    THR  47           H        THR  47   1.156   6.143   3.883
  322    HA   THR  47           HA       THR  47   1.056   8.349   2.137
  323    HB   THR  47           HB       THR  47   1.140   9.528   4.371
  324    HG1  THR  47           HG1      THR  47   2.847  10.902   3.669
  325   HG21  THR  47          HG21      THR  47   2.784   7.759   5.356
  326   HG22  THR  47          HG22      THR  47   3.126   9.477   5.713
  327   HG23  THR  47          HG23      THR  47   4.025   8.607   4.479
  328    H    ILE  48           H        ILE  48   3.098   8.758   1.131
  329    HA   ILE  48           HA       ILE  48   4.448   6.370   0.550
  330    HB   ILE  48           HB       ILE  48   4.166   7.889  -1.176
  331   HG12  ILE  48          HG12      ILE  48   7.129   7.804  -0.479
  332   HG13  ILE  48          HG13      ILE  48   6.204   6.469  -1.108
  333   HG21  ILE  48          HG21      ILE  48   4.097  10.048   0.105
  334   HG22  ILE  48          HG22      ILE  48   5.864   9.961   0.297
  335   HG23  ILE  48          HG23      ILE  48   5.136  10.145  -1.304
  336   HD11  ILE  48          HD11      ILE  48   5.629   7.766  -3.141
  337   HD12  ILE  48          HD12      ILE  48   6.664   9.094  -2.569
  338   HD13  ILE  48          HD13      ILE  48   7.374   7.524  -2.956
  339    H    ASP  49           H        ASP  49   5.091   9.078   2.738
  340    HA   ASP  49           HA       ASP  49   7.875   8.578   3.155
  341    HB2  ASP  49           HB2      ASP  49   6.780  10.674   3.724
  342    HB3  ASP  49           HB3      ASP  49   5.858   9.848   4.993
  343    H    GLU  50           H        GLU  50   4.967   7.033   4.545
  344    HA   GLU  50           HA       GLU  50   6.404   5.751   6.697
  345    HB2  GLU  50           HB2      GLU  50   4.034   6.662   6.789
  346    HB3  GLU  50           HB3      GLU  50   3.567   5.433   5.606
  347    HG2  GLU  50           HG2      GLU  50   2.949   4.442   7.586
  348    HG3  GLU  50           HG3      GLU  50   4.568   3.754   7.392
  349    H    CYS  51           H        CYS  51   4.835   4.984   3.513
  350    HA   CYS  51           HA       CYS  51   5.316   2.233   3.703
  351    HB2  CYS  51           HB2      CYS  51   4.544   2.084   1.487
  352    HB3  CYS  51           HB3      CYS  51   3.727   3.526   2.135
  353    H    ASN  52           H        ASN  52   7.265   4.878   2.278
  354    HA   ASN  52           HA       ASN  52   9.140   3.048   1.175
  355    HB2  ASN  52           HB2      ASN  52  10.164   4.776   0.128
  356    HB3  ASN  52           HB3      ASN  52   8.592   5.463   0.364
  357   HD21  ASN  52          HD21      ASN  52   8.487   7.347   1.483
  358   HD22  ASN  52          HD22      ASN  52   9.884   8.219   2.106
  359    H    ARG  53           H        ARG  53   9.303   5.252   3.967
  360    HA   ARG  53           HA       ARG  53  11.778   4.316   4.868
  361    HB2  ARG  53           HB2      ARG  53  11.436   5.317   6.906
  362    HB3  ARG  53           HB3      ARG  53  10.389   6.215   5.803
  363    HG2  ARG  53           HG2      ARG  53   8.446   4.866   6.664
  364    HG3  ARG  53           HG3      ARG  53   9.520   4.122   7.849
  365    HD2  ARG  53           HD2      ARG  53   8.813   7.081   7.640
  366    HD3  ARG  53           HD3      ARG  53   8.279   5.928   8.878
  367    HE   ARG  53           HE       ARG  53  11.101   5.886   8.822
  368   HH11  ARG  53          HH11      ARG  53   8.471   7.987   9.968
  369   HH12  ARG  53          HH12      ARG  53   9.474   8.781  11.144
  370   HH21  ARG  53          HH21      ARG  53  12.428   7.109  10.065
  371   HH22  ARG  53          HH22      ARG  53  11.789   8.102  11.354
  372    H    THR  54           H        THR  54   8.773   2.504   5.104
  373    HA   THR  54           HA       THR  54  10.098   0.599   6.937
  374    HB   THR  54           HB       THR  54   7.836   1.629   7.423
  375    HG1  THR  54           HG1      THR  54   8.070  -1.186   7.372
  376   HG21  THR  54          HG21      THR  54   5.901   0.795   6.409
  377   HG22  THR  54          HG22      THR  54   6.763  -0.573   5.633
  378   HG23  THR  54          HG23      THR  54   6.952   1.082   5.030
  379    H    CYS  55           H        CYS  55   9.538   0.872   3.534
  380    HA   CYS  55           HA       CYS  55  10.130  -2.041   3.313
  381    HB2  CYS  55           HB2      CYS  55   8.074  -0.551   1.639
  382    HB3  CYS  55           HB3      CYS  55   8.557  -2.234   1.455
  383    H    VAL  56           H        VAL  56  10.125   1.133   1.630
  384    HA   VAL  56           HA       VAL  56  11.537   0.126  -0.663
  385    HB   VAL  56           HB       VAL  56  11.171   2.890   0.470
  386   HG11  VAL  56          HG11      VAL  56  12.429   2.205  -2.177
  387   HG12  VAL  56          HG12      VAL  56  11.922   3.820  -1.645
  388   HG13  VAL  56          HG13      VAL  56  13.224   2.997  -0.791
  389   HG21  VAL  56          HG21      VAL  56   9.114   1.776  -0.499
  390   HG22  VAL  56          HG22      VAL  56   9.629   3.143  -1.477
  391   HG23  VAL  56          HG23      VAL  56  10.012   1.498  -2.003
  392    H    GLY  57           H        GLY  57  13.458  -0.642  -0.635
  393    HA2  GLY  57           HA2      GLY  57  15.333  -0.316   1.592
  394    HA3  GLY  57           HA3      GLY  57  15.605  -1.236   0.096
  Start of MODEL    8
    1    H1   ARG   1           H        ARG   1  12.226  -5.911   3.945
    2    HA   ARG   1           HA       ARG   1  10.463  -4.572   2.940
    3    HB2  ARG   1           HB2      ARG   1   9.607  -5.197   0.730
    4    HB3  ARG   1           HB3      ARG   1  11.199  -4.502   0.758
    5    HG2  ARG   1           HG2      ARG   1  11.722  -7.295   0.745
    6    HG3  ARG   1           HG3      ARG   1  10.356  -7.058  -0.343
    7    HD2  ARG   1           HD2      ARG   1  12.316  -6.809  -1.663
    8    HD3  ARG   1           HD3      ARG   1  11.652  -5.192  -1.472
    9    HE   ARG   1           HE       ARG   1  13.701  -5.942   0.523
   10   HH11  ARG   1          HH11      ARG   1  13.301  -4.655  -2.763
   11   HH12  ARG   1          HH12      ARG   1  14.848  -3.865  -2.748
   12   HH21  ARG   1          HH21      ARG   1  15.631  -4.846   0.558
   13   HH22  ARG   1          HH22      ARG   1  16.171  -3.955  -0.870
   14    HA   PRO   2           HA       PRO   2   8.720  -7.974   5.230
   15    HB2  PRO   2           HB2      PRO   2   6.594  -6.687   6.339
   16    HB3  PRO   2           HB3      PRO   2   8.284  -6.419   6.877
   17    HG2  PRO   2           HG2      PRO   2   6.679  -4.791   4.890
   18    HG3  PRO   2           HG3      PRO   2   7.588  -4.175   6.312
   19    HD2  PRO   2           HD2      PRO   2   8.717  -4.112   3.850
   20    HD3  PRO   2           HD3      PRO   2   9.682  -4.598   5.276
   21    H    ARG   3           H        ARG   3   7.242  -9.532   4.793
   22    HA   ARG   3           HA       ARG   3   5.933  -9.671   2.361
   23    HB2  ARG   3           HB2      ARG   3   5.144 -11.739   2.975
   24    HB3  ARG   3           HB3      ARG   3   6.622 -11.555   3.880
   25    HG2  ARG   3           HG2      ARG   3   3.766 -11.438   4.910
   26    HG3  ARG   3           HG3      ARG   3   5.005 -12.643   5.268
   27    HD2  ARG   3           HD2      ARG   3   4.962  -9.766   6.196
   28    HD3  ARG   3           HD3      ARG   3   4.672 -11.206   7.187
   29    HE   ARG   3           HE       ARG   3   7.103 -11.802   6.300
   30   HH11  ARG   3          HH11      ARG   3   5.851  -9.189   8.240
   31   HH12  ARG   3          HH12      ARG   3   7.357  -8.392   8.508
   32   HH21  ARG   3          HH21      ARG   3   9.225 -10.832   6.652
   33   HH22  ARG   3          HH22      ARG   3   9.316  -9.455   7.702
   34    H    PHE   4           H        PHE   4   4.691  -7.912   5.072
   35    HA   PHE   4           HA       PHE   4   1.903  -8.341   4.259
   36    HB2  PHE   4           HB2      PHE   4   1.316  -6.895   6.019
   37    HB3  PHE   4           HB3      PHE   4   2.532  -7.995   6.623
   38    HD1  PHE   4           HD2      PHE   4   2.008  -4.547   5.274
   39    HD2  PHE   4           HD1      PHE   4   4.390  -7.098   7.782
   40    HE1  PHE   4           HE2      PHE   4   3.479  -2.609   5.915
   41    HE2  PHE   4           HE1      PHE   4   5.721  -5.155   8.549
   42    HZ   PHE   4           HZ       PHE   4   5.283  -2.911   7.568
   43    H    CYS   5           H        CYS   5   4.597  -6.182   3.323
   44    HA   CYS   5           HA       CYS   5   2.934  -4.055   2.350
   45    HB2  CYS   5           HB2      CYS   5   5.593  -4.492   3.003
   46    HB3  CYS   5           HB3      CYS   5   5.659  -4.515   1.250
   47    H    GLU   6           H        GLU   6   3.929  -7.176   1.130
   48    HA   GLU   6           HA       GLU   6   3.556  -6.386  -1.700
   49    HB2  GLU   6           HB2      GLU   6   4.601  -8.439  -2.247
   50    HB3  GLU   6           HB3      GLU   6   5.506  -7.638  -0.965
   51    HG2  GLU   6           HG2      GLU   6   4.578  -9.105   0.684
   52    HG3  GLU   6           HG3      GLU   6   3.645  -9.991  -0.537
   53    H    LEU   7           H        LEU   7   1.275  -6.762   0.411
   54    HA   LEU   7           HA       LEU   7  -0.151  -9.068  -0.732
   55    HB2  LEU   7           HB2      LEU   7  -1.090  -6.968   1.255
   56    HB3  LEU   7           HB3      LEU   7  -1.964  -8.442   0.788
   57    HG   LEU   7           HG       LEU   7   0.636  -8.220   2.335
   58   HD11  LEU   7          HD11      LEU   7  -1.556  -7.899   3.522
   59   HD12  LEU   7          HD12      LEU   7  -0.591  -9.258   4.124
   60   HD13  LEU   7          HD13      LEU   7  -1.995  -9.556   3.079
   61   HD21  LEU   7          HD21      LEU   7   0.695 -10.629   2.543
   62   HD22  LEU   7          HD22      LEU   7   0.968 -10.125   0.895
   63   HD23  LEU   7          HD23      LEU   7  -0.627 -10.797   1.348
   64    H    ALA   8           H        ALA   8  -2.362  -8.716  -1.473
   65    HA   ALA   8           HA       ALA   8  -2.375  -6.546  -3.526
   66    HB1  ALA   8           HB1      ALA   8  -4.002  -7.835  -4.754
   67    HB2  ALA   8           HB2      ALA   8  -2.576  -8.839  -4.448
   68    HB3  ALA   8           HB3      ALA   8  -4.065  -9.068  -3.494
   69    HA   PRO   9           HA       PRO   9  -5.256  -5.014  -0.400
   70    HB2  PRO   9           HB2      PRO   9  -6.034  -2.684  -1.612
   71    HB3  PRO   9           HB3      PRO   9  -4.466  -2.893  -0.786
   72    HG2  PRO   9           HG2      PRO   9  -5.076  -3.044  -3.745
   73    HG3  PRO   9           HG3      PRO   9  -3.680  -2.266  -2.946
   74    HD2  PRO   9           HD2      PRO   9  -3.572  -4.758  -4.085
   75    HD3  PRO   9           HD3      PRO   9  -2.561  -4.285  -2.685
   76    H    SER  10           H        SER  10  -6.979  -6.405  -0.433
   77    HA   SER  10           HA       SER  10  -8.624  -6.791  -2.748
   78    HB2  SER  10           HB2      SER  10  -7.934  -8.502  -0.984
   79    HB3  SER  10           HB3      SER  10  -9.140  -7.762   0.080
   80    HG   SER  10           HG       SER  10  -9.605  -8.932  -2.496
   81    H    ALA  11           H        ALA  11  -8.809  -4.218  -2.599
   82    HA   ALA  11           HA       ALA  11 -10.676  -3.026  -0.767
   83    HB1  ALA  11           HB1      ALA  11 -10.724  -1.174  -2.393
   84    HB2  ALA  11           HB2      ALA  11  -9.053  -1.713  -2.106
   85    HB3  ALA  11           HB3      ALA  11  -9.907  -2.181  -3.602
   86    H    GLY  12           H        GLY  12 -11.067  -4.895  -3.752
   87    HA2  GLY  12           HA2      GLY  12 -13.681  -4.208  -4.477
   88    HA3  GLY  12           HA3      GLY  12 -12.884  -5.757  -4.789
   89    H    SER  13           H        SER  13 -12.618  -6.050  -1.663
   90    HA   SER  13           HA       SER  13 -14.845  -7.702  -1.266
   91    HB2  SER  13           HB2      SER  13 -12.816  -6.437   0.581
   92    HB3  SER  13           HB3      SER  13 -13.968  -7.652   1.124
   93    HG   SER  13           HG       SER  13 -12.045  -8.599   0.569
   94    H    CYS  14           H        CYS  14 -14.675  -4.222  -0.875
   95    HA   CYS  14           HA       CYS  14 -17.386  -4.126   0.297
   96    HB2  CYS  14           HB2      CYS  14 -14.956  -2.701   1.448
   97    HB3  CYS  14           HB3      CYS  14 -16.640  -2.443   1.920
   98    H    PHE  15           H        PHE  15 -17.976  -1.546   0.331
   99    HA   PHE  15           HA       PHE  15 -16.899  -0.376  -2.210
  100    HB2  PHE  15           HB2      PHE  15 -19.139  -1.109  -2.727
  101    HB3  PHE  15           HB3      PHE  15 -19.755  -0.501  -1.203
  102    HD1  PHE  15           HD1      PHE  15 -20.035   2.008  -0.824
  103    HD2  PHE  15           HD2      PHE  15 -18.905   0.400  -4.665
  104    HE1  PHE  15           HE1      PHE  15 -20.389   4.198  -1.850
  105    HE2  PHE  15           HE2      PHE  15 -19.347   2.583  -5.703
  106    HZ   PHE  15           HZ       PHE  15 -20.025   4.520  -4.294
  107    H    ALA  16           H        ALA  16 -15.595   1.188  -1.500
  108    HA   ALA  16           HA       ALA  16 -16.690   3.311   0.034
  109    HB1  ALA  16           HB1      ALA  16 -15.907   2.947   2.068
  110    HB2  ALA  16           HB2      ALA  16 -15.372   1.344   1.561
  111    HB3  ALA  16           HB3      ALA  16 -14.263   2.769   1.468
  112    H    PHE  17           H        PHE  17 -15.120   5.172   0.069
  113    HA   PHE  17           HA       PHE  17 -13.039   4.946  -2.060
  114    HB2  PHE  17           HB2      PHE  17 -15.019   5.951  -3.002
  115    HB3  PHE  17           HB3      PHE  17 -15.140   7.077  -1.648
  116    HD1  PHE  17           HD2      PHE  17 -12.146   6.114  -3.755
  117    HD2  PHE  17           HD1      PHE  17 -14.888   9.241  -2.596
  118    HE1  PHE  17           HE2      PHE  17 -10.719   7.766  -4.882
  119    HE2  PHE  17           HE1      PHE  17 -13.491  10.889  -3.810
  120    HZ   PHE  17           HZ       PHE  17 -11.390  10.163  -4.929
  121    H    VAL  18           H        VAL  18 -11.280   4.924  -0.803
  122    HA   VAL  18           HA       VAL  18 -10.623   7.327   0.707
  123    HB   VAL  18           HB       VAL  18  -9.570   5.853   2.504
  124   HG11  VAL  18          HG11      VAL  18 -11.553   6.036   3.868
  125   HG12  VAL  18          HG12      VAL  18 -11.529   7.401   2.736
  126   HG13  VAL  18          HG13      VAL  18 -12.609   6.033   2.439
  127   HG21  VAL  18          HG21      VAL  18 -10.776   3.782   3.087
  128   HG22  VAL  18          HG22      VAL  18 -11.737   3.902   1.600
  129   HG23  VAL  18          HG23      VAL  18  -9.986   3.604   1.517
  130    HA   PRO  19           HA       PRO  19  -7.430   6.061  -2.314
  131    HB2  PRO  19           HB2      PRO  19  -6.195   8.518  -2.597
  132    HB3  PRO  19           HB3      PRO  19  -7.662   7.995  -3.490
  133    HG2  PRO  19           HG2      PRO  19  -7.518   9.694  -0.990
  134    HG3  PRO  19           HG3      PRO  19  -8.492   9.971  -2.468
  135    HD2  PRO  19           HD2      PRO  19  -9.546   8.839  -0.241
  136    HD3  PRO  19           HD3      PRO  19 -10.032   8.272  -1.876
  137    H    SER  20           H        SER  20  -5.870   4.883  -1.392
  138    HA   SER  20           HA       SER  20  -4.284   5.987   0.847
  139    HB2  SER  20           HB2      SER  20  -5.265   3.157   0.581
  140    HB3  SER  20           HB3      SER  20  -4.377   3.868   1.934
  141    HG   SER  20           HG       SER  20  -6.966   4.545   0.954
  142    H    TYR  21           H        TYR  21  -2.191   4.032   0.871
  143    HA   TYR  21           HA       TYR  21  -0.883   4.558  -1.778
  144    HB2  TYR  21           HB2      TYR  21   0.122   4.867   1.000
  145    HB3  TYR  21           HB3      TYR  21   1.240   4.170  -0.152
  146    HD1  TYR  21           HD2      TYR  21   2.087   5.465  -2.137
  147    HD2  TYR  21           HD1      TYR  21  -0.621   7.173   0.777
  148    HE1  TYR  21           HE2      TYR  21   2.442   7.706  -3.098
  149    HE2  TYR  21           HE1      TYR  21  -0.174   9.396  -0.100
  150    HH   TYR  21           HH       TYR  21   0.830  10.656  -1.966
  151    H    TYR  22           H        TYR  22   0.205   3.073  -2.790
  152    HA   TYR  22           HA       TYR  22   0.045   0.219  -1.964
  153    HB2  TYR  22           HB2      TYR  22  -0.935   1.281  -4.343
  154    HB3  TYR  22           HB3      TYR  22   0.751   1.264  -4.720
  155    HD1  TYR  22           HD1      TYR  22   1.973  -0.806  -5.155
  156    HD2  TYR  22           HD2      TYR  22  -2.231  -0.793  -4.169
  157    HE1  TYR  22           HE1      TYR  22   1.787  -3.132  -5.931
  158    HE2  TYR  22           HE2      TYR  22  -2.432  -3.077  -5.060
  159    HH   TYR  22           HH       TYR  22  -1.296  -4.956  -5.991
  160    H    TYR  23           H        TYR  23   1.953  -1.067  -2.555
  161    HA   TYR  23           HA       TYR  23   4.566   0.373  -2.683
  162    HB2  TYR  23           HB2      TYR  23   4.261  -0.596  -0.468
  163    HB3  TYR  23           HB3      TYR  23   3.676  -2.095  -1.147
  164    HD1  TYR  23           HD1      TYR  23   6.720   0.126  -1.212
  165    HD2  TYR  23           HD2      TYR  23   5.177  -3.901  -1.445
  166    HE1  TYR  23           HE1      TYR  23   9.024  -0.773  -1.203
  167    HE2  TYR  23           HE2      TYR  23   7.485  -4.781  -1.402
  168    HH   TYR  23           HH       TYR  23  10.275  -2.851  -0.807
  169    H    ASN  24           H        ASN  24   5.719  -0.196  -4.506
  170    HA   ASN  24           HA       ASN  24   5.043  -2.791  -5.873
  171    HB2  ASN  24           HB2      ASN  24   5.706  -0.087  -7.083
  172    HB3  ASN  24           HB3      ASN  24   5.999  -1.577  -7.950
  173   HD21  ASN  24          HD21      ASN  24   3.785  -3.199  -7.727
  174   HD22  ASN  24          HD22      ASN  24   2.443  -2.299  -8.394
  175    H    GLN  25           H        GLN  25   6.654  -3.998  -4.815
  176    HA   GLN  25           HA       GLN  25   9.326  -3.204  -4.404
  177    HB2  GLN  25           HB2      GLN  25   9.882  -5.690  -4.509
  178    HB3  GLN  25           HB3      GLN  25   8.784  -5.162  -3.266
  179    HG2  GLN  25           HG2      GLN  25   7.748  -6.335  -5.888
  180    HG3  GLN  25           HG3      GLN  25   8.290  -7.341  -4.542
  181   HE21  GLN  25          HE21      GLN  25   5.484  -5.592  -5.723
  182   HE22  GLN  25          HE22      GLN  25   4.645  -5.689  -4.208
  183    H    TYR  26           H        TYR  26   7.790  -4.274  -7.374
  184    HA   TYR  26           HA       TYR  26   9.961  -5.110  -8.913
  185    HB2  TYR  26           HB2      TYR  26   7.449  -3.568  -9.709
  186    HB3  TYR  26           HB3      TYR  26   8.526  -4.367 -10.836
  187    HD1  TYR  26           HD2      TYR  26   8.687  -6.816 -10.964
  188    HD2  TYR  26           HD1      TYR  26   5.895  -4.894  -8.298
  189    HE1  TYR  26           HE2      TYR  26   7.463  -8.942 -10.718
  190    HE2  TYR  26           HE1      TYR  26   4.660  -7.052  -8.050
  191    HH   TYR  26           HH       TYR  26   5.242  -9.725 -10.172
  192    H    SER  27           H        SER  27   8.816  -1.810  -8.211
  193    HA   SER  27           HA       SER  27  11.153  -0.663  -9.676
  194    HB2  SER  27           HB2      SER  27   8.865  -0.124 -10.504
  195    HB3  SER  27           HB3      SER  27   8.477   0.560  -8.919
  196    HG   SER  27           HG       SER  27   9.086   2.136 -10.406
  197    H    ASN  28           H        ASN  28  10.253  -1.625  -6.654
  198    HA   ASN  28           HA       ASN  28  10.593  -1.105  -4.549
  199    HB2  ASN  28           HB2      ASN  28  12.842  -1.766  -5.477
  200    HB3  ASN  28           HB3      ASN  28  13.228  -0.047  -5.572
  201   HD21  ASN  28          HD21      ASN  28  14.391   0.561  -3.879
  202   HD22  ASN  28          HD22      ASN  28  14.463  -0.189  -2.281
  203    H    THR  29           H        THR  29   8.800   0.497  -5.157
  204    HA   THR  29           HA       THR  29   9.376   2.949  -3.810
  205    HB   THR  29           HB       THR  29  10.067   3.375  -6.208
  206    HG1  THR  29           HG1      THR  29   9.726   5.301  -5.696
  207   HG21  THR  29          HG21      THR  29   8.182   2.174  -7.340
  208   HG22  THR  29          HG22      THR  29   8.399   3.848  -7.880
  209   HG23  THR  29          HG23      THR  29   7.078   3.448  -6.775
  210    H    CYS  30           H        CYS  30   7.105   4.263  -4.085
  211    HA   CYS  30           HA       CYS  30   4.844   2.354  -3.702
  212    HB2  CYS  30           HB2      CYS  30   5.509   4.826  -2.137
  213    HB3  CYS  30           HB3      CYS  30   4.137   3.778  -1.817
  214    H    HIS  31           H        HIS  31   2.726   3.385  -4.112
  215    HA   HIS  31           HA       HIS  31   2.741   6.039  -5.387
  216    HB2  HIS  31           HB2      HIS  31   3.273   4.009  -7.034
  217    HB3  HIS  31           HB3      HIS  31   1.551   3.683  -6.896
  218    HD1  HIS  31           HD1      HIS  31   0.582   4.643  -9.178
  219    HD2  HIS  31           HD2      HIS  31   3.532   7.001  -7.320
  220    HE1  HIS  31           HE1      HIS  31   0.966   6.618 -10.719
  221    H    SER  32           H        SER  32   0.586   7.009  -5.302
  222    HA   SER  32           HA       SER  32  -1.104   5.849  -3.306
  223    HB2  SER  32           HB2      SER  32  -2.579   7.737  -4.003
  224    HB3  SER  32           HB3      SER  32  -0.970   8.202  -3.418
  225    HG   SER  32           HG       SER  32  -1.648   9.227  -5.464
  226    H    PHE  33           H        PHE  33  -3.064   4.812  -3.555
  227    HA   PHE  33           HA       PHE  33  -4.146   4.310  -6.238
  228    HB2  PHE  33           HB2      PHE  33  -4.148   2.011  -6.190
  229    HB3  PHE  33           HB3      PHE  33  -2.537   2.411  -5.611
  230    HD1  PHE  33           HD2      PHE  33  -2.158   2.367  -3.138
  231    HD2  PHE  33           HD1      PHE  33  -5.701   0.738  -4.837
  232    HE1  PHE  33           HE2      PHE  33  -2.303   0.643  -1.283
  233    HE2  PHE  33           HE1      PHE  33  -6.153  -0.505  -2.746
  234    HZ   PHE  33           HZ       PHE  33  -4.395  -0.424  -0.856
  235    H    THR  34           H        THR  34  -6.159   2.735  -5.652
  236    HA   THR  34           HA       THR  34  -7.821   4.407  -3.765
  237    HB   THR  34           HB       THR  34  -9.778   3.433  -5.049
  238    HG1  THR  34           HG1      THR  34  -9.454   2.354  -6.732
  239   HG21  THR  34          HG21      THR  34  -9.040   5.770  -5.291
  240   HG22  THR  34          HG22      THR  34  -9.578   5.108  -6.841
  241   HG23  THR  34          HG23      THR  34  -7.846   5.286  -6.505
  242    H    TYR  35           H        TYR  35  -8.501   3.596  -1.856
  243    HA   TYR  35           HA       TYR  35  -8.662   0.653  -1.571
  244    HB2  TYR  35           HB2      TYR  35  -6.772   1.777  -0.383
  245    HB3  TYR  35           HB3      TYR  35  -7.953   2.586   0.625
  246    HD1  TYR  35           HD1      TYR  35  -6.837  -0.818  -0.552
  247    HD2  TYR  35           HD2      TYR  35  -8.552   1.517   2.649
  248    HE1  TYR  35           HE1      TYR  35  -6.384  -2.651   1.032
  249    HE2  TYR  35           HE2      TYR  35  -8.189  -0.368   4.212
  250    HH   TYR  35           HH       TYR  35  -6.779  -2.258   4.515
  251    H    SER  36           H        SER  36 -10.149   0.150   0.570
  252    HA   SER  36           HA       SER  36 -12.460   1.981   0.618
  253    HB2  SER  36           HB2      SER  36 -12.531  -1.025   0.190
  254    HB3  SER  36           HB3      SER  36 -13.945  -0.012   0.484
  255    HG   SER  36           HG       SER  36 -13.157   1.251  -1.416
  256    H    GLY  37           H        GLY  37 -14.052   0.975   2.505
  257    HA2  GLY  37           HA2      GLY  37 -12.677   1.464   4.960
  258    HA3  GLY  37           HA3      GLY  37 -14.375   1.026   4.735
  259    H    CYS  38           H        CYS  38 -14.963  -1.254   4.584
  260    HA   CYS  38           HA       CYS  38 -13.127  -2.929   6.130
  261    HB2  CYS  38           HB2      CYS  38 -14.848  -4.652   5.900
  262    HB3  CYS  38           HB3      CYS  38 -15.441  -3.144   6.548
  263    H    GLY  39           H        GLY  39 -12.918  -5.364   5.089
  264    HA2  GLY  39           HA2      GLY  39 -12.000  -6.622   3.345
  265    HA3  GLY  39           HA3      GLY  39 -12.464  -5.318   2.234
  266    H    GLY  40           H        GLY  40 -10.403  -5.558   1.184
  267    HA2  GLY  40           HA2      GLY  40  -8.318  -4.728   0.725
  268    HA3  GLY  40           HA3      GLY  40  -8.502  -3.714   2.143
  269    H    ASN  41           H        ASN  41  -5.992  -4.601   1.638
  270    HA   ASN  41           HA       ASN  41  -5.530  -6.638   3.747
  271    HB2  ASN  41           HB2      ASN  41  -4.238  -6.613   1.001
  272    HB3  ASN  41           HB3      ASN  41  -3.617  -7.524   2.362
  273   HD21  ASN  41          HD21      ASN  41  -4.526  -9.537   2.893
  274   HD22  ASN  41          HD22      ASN  41  -5.847 -10.203   1.939
  275    H    ALA  42           H        ALA  42  -3.182  -6.677   4.480
  276    HA   ALA  42           HA       ALA  42  -2.494  -4.307   5.595
  277    HB1  ALA  42           HB1      ALA  42  -0.489  -5.398   6.333
  278    HB2  ALA  42           HB2      ALA  42  -1.824  -6.575   6.346
  279    HB3  ALA  42           HB3      ALA  42  -0.611  -6.594   5.029
  280    H    ASN  43           H        ASN  43  -1.844  -5.040   2.256
  281    HA   ASN  43           HA       ASN  43   0.601  -3.559   1.964
  282    HB2  ASN  43           HB2      ASN  43   0.286  -4.630   0.012
  283    HB3  ASN  43           HB3      ASN  43  -1.443  -4.798   0.251
  284   HD21  ASN  43          HD21      ASN  43   0.660  -3.596  -2.018
  285   HD22  ASN  43          HD22      ASN  43  -0.474  -2.455  -2.653
  286    H    ARG  44           H        ARG  44  -2.616  -2.522   2.810
  287    HA   ARG  44           HA       ARG  44  -2.540   0.004   1.605
  288    HB2  ARG  44           HB2      ARG  44  -4.579  -1.139   2.528
  289    HB3  ARG  44           HB3      ARG  44  -4.007  -0.823   4.159
  290    HG2  ARG  44           HG2      ARG  44  -3.923   1.722   2.932
  291    HG3  ARG  44           HG3      ARG  44  -5.344   0.968   2.229
  292    HD2  ARG  44           HD2      ARG  44  -6.089   0.574   4.655
  293    HD3  ARG  44           HD3      ARG  44  -4.691   1.531   5.138
  294    HE   ARG  44           HE       ARG  44  -6.050   3.006   3.184
  295   HH11  ARG  44          HH11      ARG  44  -6.590   1.915   6.519
  296   HH12  ARG  44          HH12      ARG  44  -7.817   3.066   6.875
  297   HH21  ARG  44          HH21      ARG  44  -7.543   4.665   3.678
  298   HH22  ARG  44          HH22      ARG  44  -8.479   4.590   5.152
  299    H    PHE  45           H        PHE  45  -1.563   1.839   2.117
  300    HA   PHE  45           HA       PHE  45  -0.613   2.347   4.854
  301    HB2  PHE  45           HB2      PHE  45   0.989   2.230   2.326
  302    HB3  PHE  45           HB3      PHE  45   1.313   3.595   3.385
  303    HD1  PHE  45           HD2      PHE  45   0.742  -0.147   3.691
  304    HD2  PHE  45           HD1      PHE  45   2.922   3.308   5.047
  305    HE1  PHE  45           HE2      PHE  45   1.688  -1.484   5.483
  306    HE2  PHE  45           HE1      PHE  45   3.983   1.917   6.818
  307    HZ   PHE  45           HZ       PHE  45   3.350  -0.468   7.071
  308    H    ARG  46           H        ARG  46  -0.140   4.732   5.177
  309    HA   ARG  46           HA       ARG  46  -2.357   6.283   3.915
  310    HB2  ARG  46           HB2      ARG  46  -1.868   7.851   5.963
  311    HB3  ARG  46           HB3      ARG  46  -2.908   6.451   6.070
  312    HG2  ARG  46           HG2      ARG  46  -1.473   6.712   8.040
  313    HG3  ARG  46           HG3      ARG  46  -1.309   5.172   7.242
  314    HD2  ARG  46           HD2      ARG  46   0.859   5.830   7.935
  315    HD3  ARG  46           HD3      ARG  46   0.856   5.988   6.203
  316    HE   ARG  46           HE       ARG  46   0.866   8.324   6.335
  317   HH11  ARG  46          HH11      ARG  46   1.280   6.749   9.575
  318   HH12  ARG  46          HH12      ARG  46   2.133   8.098  10.204
  319   HH21  ARG  46          HH21      ARG  46   1.674  10.218   7.410
  320   HH22  ARG  46          HH22      ARG  46   2.492  10.041   8.927
  321    H    THR  47           H        THR  47   1.109   6.087   3.957
  322    HA   THR  47           HA       THR  47   1.112   8.307   2.195
  323    HB   THR  47           HB       THR  47   1.266   9.436   4.432
  324    HG1  THR  47           HG1      THR  47   2.193  10.646   2.930
  325   HG21  THR  47          HG21      THR  47   4.053   8.251   4.601
  326   HG22  THR  47          HG22      THR  47   2.720   7.513   5.449
  327   HG23  THR  47          HG23      THR  47   3.209   9.195   5.816
  328    H    ILE  48           H        ILE  48   3.054   8.505   1.008
  329    HA   ILE  48           HA       ILE  48   4.392   6.043   0.456
  330    HB   ILE  48           HB       ILE  48   4.107   7.575  -1.284
  331   HG12  ILE  48          HG12      ILE  48   7.052   7.805  -0.590
  332   HG13  ILE  48          HG13      ILE  48   6.291   6.338  -1.118
  333   HG21  ILE  48          HG21      ILE  48   5.579   9.751   0.268
  334   HG22  ILE  48          HG22      ILE  48   4.977   9.886  -1.388
  335   HG23  ILE  48          HG23      ILE  48   3.834   9.732  -0.086
  336   HD11  ILE  48          HD11      ILE  48   6.467   8.903  -2.743
  337   HD12  ILE  48          HD12      ILE  48   7.220   7.336  -3.095
  338   HD13  ILE  48          HD13      ILE  48   5.470   7.498  -3.187
  339    H    ASP  49           H        ASP  49   4.985   8.765   2.628
  340    HA   ASP  49           HA       ASP  49   7.762   8.441   3.007
  341    HB2  ASP  49           HB2      ASP  49   5.694  10.084   4.024
  342    HB3  ASP  49           HB3      ASP  49   6.416   9.284   5.431
  343    H    GLU  50           H        GLU  50   4.995   6.747   4.485
  344    HA   GLU  50           HA       GLU  50   6.620   5.379   6.477
  345    HB2  GLU  50           HB2      GLU  50   3.691   5.367   5.667
  346    HB3  GLU  50           HB3      GLU  50   4.360   4.190   6.792
  347    HG2  GLU  50           HG2      GLU  50   4.437   7.201   7.214
  348    HG3  GLU  50           HG3      GLU  50   3.248   6.089   7.912
  349    H    CYS  51           H        CYS  51   4.751   4.773   3.453
  350    HA   CYS  51           HA       CYS  51   5.187   2.030   3.314
  351    HB2  CYS  51           HB2      CYS  51   3.548   3.046   1.934
  352    HB3  CYS  51           HB3      CYS  51   4.718   4.151   1.204
  353    H    ASN  52           H        ASN  52   7.177   4.677   1.915
  354    HA   ASN  52           HA       ASN  52   9.018   2.846   0.804
  355    HB2  ASN  52           HB2      ASN  52  10.087   4.571  -0.165
  356    HB3  ASN  52           HB3      ASN  52   8.546   5.317   0.083
  357   HD21  ASN  52          HD21      ASN  52   8.466   7.137   1.383
  358   HD22  ASN  52          HD22      ASN  52   9.927   7.922   2.012
  359    H    ARG  53           H        ARG  53   9.287   5.008   3.671
  360    HA   ARG  53           HA       ARG  53  11.725   3.919   4.415
  361    HB2  ARG  53           HB2      ARG  53  11.582   4.981   6.476
  362    HB3  ARG  53           HB3      ARG  53  10.493   5.928   5.436
  363    HG2  ARG  53           HG2      ARG  53   8.571   4.687   6.419
  364    HG3  ARG  53           HG3      ARG  53   9.666   3.802   7.473
  365    HD2  ARG  53           HD2      ARG  53   8.583   5.633   8.669
  366    HD3  ARG  53           HD3      ARG  53  10.351   5.826   8.608
  367    HE   ARG  53           HE       ARG  53   9.122   7.235   6.452
  368   HH11  ARG  53          HH11      ARG  53   9.277   7.360  10.004
  369   HH12  ARG  53          HH12      ARG  53   9.268   9.078  10.106
  370   HH21  ARG  53          HH21      ARG  53   9.163   9.634   6.600
  371   HH22  ARG  53          HH22      ARG  53   9.208  10.381   8.131
  372    H    THR  54           H        THR  54   8.664   2.305   4.826
  373    HA   THR  54           HA       THR  54   9.901   0.325   6.597
  374    HB   THR  54           HB       THR  54   7.644   1.628   6.845
  375    HG1  THR  54           HG1      THR  54   8.596   0.266   8.260
  376   HG21  THR  54          HG21      THR  54   5.706   0.571   6.125
  377   HG22  THR  54          HG22      THR  54   6.543  -0.915   5.631
  378   HG23  THR  54          HG23      THR  54   6.712   0.591   4.677
  379    H    CYS  55           H        CYS  55   9.308   0.537   3.174
  380    HA   CYS  55           HA       CYS  55   9.860  -2.396   3.022
  381    HB2  CYS  55           HB2      CYS  55   7.799  -1.003   1.303
  382    HB3  CYS  55           HB3      CYS  55   8.153  -2.736   1.370
  383    H    VAL  56           H        VAL  56  10.334   0.745   1.658
  384    HA   VAL  56           HA       VAL  56  11.509  -0.298  -0.870
  385    HB   VAL  56           HB       VAL  56  11.213   2.498   0.251
  386   HG11  VAL  56          HG11      VAL  56  12.487   1.794  -2.361
  387   HG12  VAL  56          HG12      VAL  56  11.955   3.406  -1.853
  388   HG13  VAL  56          HG13      VAL  56  13.255   2.599  -0.972
  389   HG21  VAL  56          HG21      VAL  56   9.651   2.771  -1.633
  390   HG22  VAL  56          HG22      VAL  56  10.027   1.132  -2.200
  391   HG23  VAL  56          HG23      VAL  56   9.152   1.378  -0.682
  392    H    GLY  57           H        GLY  57  13.217  -1.578  -0.305
  393    HA2  GLY  57           HA2      GLY  57  15.080  -0.874   1.809
  394    HA3  GLY  57           HA3      GLY  57  15.262  -2.186   0.635
  Start of MODEL    9
    1    H1   ARG   1           H        ARG   1  12.809  -4.585   3.016
    2    HA   ARG   1           HA       ARG   1  10.513  -4.136   3.245
    3    HB2  ARG   1           HB2      ARG   1   9.563  -4.863   1.097
    4    HB3  ARG   1           HB3      ARG   1  11.159  -4.151   1.006
    5    HG2  ARG   1           HG2      ARG   1  11.579  -6.988   1.092
    6    HG3  ARG   1           HG3      ARG   1  10.247  -6.673   0.004
    7    HD2  ARG   1           HD2      ARG   1  12.253  -6.591  -1.280
    8    HD3  ARG   1           HD3      ARG   1  11.594  -4.968  -1.201
    9    HE   ARG   1           HE       ARG   1  13.685  -5.624   0.803
   10   HH11  ARG   1          HH11      ARG   1  13.065  -4.375  -2.466
   11   HH12  ARG   1          HH12      ARG   1  14.687  -3.815  -2.691
   12   HH21  ARG   1          HH21      ARG   1  15.726  -4.642   0.606
   13   HH22  ARG   1          HH22      ARG   1  16.172  -3.817  -0.876
   14    HA   PRO   2           HA       PRO   2   8.742  -7.476   5.555
   15    HB2  PRO   2           HB2      PRO   2   6.543  -6.220   6.500
   16    HB3  PRO   2           HB3      PRO   2   8.170  -5.875   7.135
   17    HG2  PRO   2           HG2      PRO   2   6.646  -4.351   5.007
   18    HG3  PRO   2           HG3      PRO   2   7.475  -3.655   6.437
   19    HD2  PRO   2           HD2      PRO   2   8.702  -3.694   4.032
   20    HD3  PRO   2           HD3      PRO   2   9.614  -4.073   5.524
   21    H    ARG   3           H        ARG   3   7.443  -9.058   4.798
   22    HA   ARG   3           HA       ARG   3   6.242  -8.932   2.264
   23    HB2  ARG   3           HB2      ARG   3   5.474 -11.133   2.597
   24    HB3  ARG   3           HB3      ARG   3   6.988 -10.982   3.483
   25    HG2  ARG   3           HG2      ARG   3   5.783 -12.078   5.080
   26    HG3  ARG   3           HG3      ARG   3   5.327 -10.432   5.527
   27    HD2  ARG   3           HD2      ARG   3   3.258 -10.741   4.017
   28    HD3  ARG   3           HD3      ARG   3   3.769 -12.421   3.819
   29    HE   ARG   3           HE       ARG   3   3.554 -11.497   6.596
   30   HH11  ARG   3          HH11      ARG   3   1.729 -13.048   3.880
   31   HH12  ARG   3          HH12      ARG   3   0.652 -13.829   4.986
   32   HH21  ARG   3          HH21      ARG   3   2.084 -12.602   7.970
   33   HH22  ARG   3          HH22      ARG   3   1.121 -13.859   7.295
   34    H    PHE   4           H        PHE   4   4.785  -7.719   5.228
   35    HA   PHE   4           HA       PHE   4   2.069  -8.126   4.326
   36    HB2  PHE   4           HB2      PHE   4   1.384  -6.722   6.048
   37    HB3  PHE   4           HB3      PHE   4   2.756  -7.606   6.687
   38    HD1  PHE   4           HD2      PHE   4   1.739  -4.331   5.155
   39    HD2  PHE   4           HD1      PHE   4   4.554  -6.397   7.685
   40    HE1  PHE   4           HE2      PHE   4   2.716  -2.186   5.797
   41    HE2  PHE   4           HE1      PHE   4   5.627  -4.235   8.240
   42    HZ   PHE   4           HZ       PHE   4   4.712  -2.107   7.320
   43    H    CYS   5           H        CYS   5   4.607  -5.879   3.396
   44    HA   CYS   5           HA       CYS   5   2.940  -3.857   2.243
   45    HB2  CYS   5           HB2      CYS   5   5.584  -4.233   3.010
   46    HB3  CYS   5           HB3      CYS   5   5.729  -4.325   1.275
   47    H    GLU   6           H        GLU   6   4.038  -7.054   1.194
   48    HA   GLU   6           HA       GLU   6   3.633  -6.367  -1.643
   49    HB2  GLU   6           HB2      GLU   6   4.834  -8.201  -2.240
   50    HB3  GLU   6           HB3      GLU   6   5.607  -7.709  -0.752
   51    HG2  GLU   6           HG2      GLU   6   4.007  -9.557   0.301
   52    HG3  GLU   6           HG3      GLU   6   3.834 -10.098  -1.347
   53    H    LEU   7           H        LEU   7   1.392  -6.959   0.616
   54    HA   LEU   7           HA       LEU   7  -0.047  -9.166  -0.596
   55    HB2  LEU   7           HB2      LEU   7  -0.989  -7.032   1.344
   56    HB3  LEU   7           HB3      LEU   7  -1.825  -8.552   0.970
   57    HG   LEU   7           HG       LEU   7   0.786  -8.177   2.466
   58   HD11  LEU   7          HD11      LEU   7  -0.404  -9.049   4.332
   59   HD12  LEU   7          HD12      LEU   7  -1.787  -9.544   3.330
   60   HD13  LEU   7          HD13      LEU   7  -1.462  -7.828   3.599
   61   HD21  LEU   7          HD21      LEU   7  -0.469 -10.830   1.741
   62   HD22  LEU   7          HD22      LEU   7   0.896 -10.573   2.850
   63   HD23  LEU   7          HD23      LEU   7   1.092 -10.201   1.142
   64    H    ALA   8           H        ALA   8  -2.328  -8.804  -1.260
   65    HA   ALA   8           HA       ALA   8  -2.409  -6.703  -3.340
   66    HB1  ALA   8           HB1      ALA   8  -3.902  -8.018  -4.500
   67    HB2  ALA   8           HB2      ALA   8  -2.683  -9.143  -3.892
   68    HB3  ALA   8           HB3      ALA   8  -4.281  -9.049  -3.110
   69    HA   PRO   9           HA       PRO   9  -5.367  -4.918  -0.333
   70    HB2  PRO   9           HB2      PRO   9  -5.105  -2.328  -0.958
   71    HB3  PRO   9           HB3      PRO   9  -3.775  -3.215  -0.170
   72    HG2  PRO   9           HG2      PRO   9  -4.143  -2.652  -3.143
   73    HG3  PRO   9           HG3      PRO   9  -2.681  -2.383  -2.135
   74    HD2  PRO   9           HD2      PRO   9  -3.083  -4.647  -3.649
   75    HD3  PRO   9           HD3      PRO   9  -2.156  -4.621  -2.126
   76    H    SER  10           H        SER  10  -6.808  -6.271  -1.747
   77    HA   SER  10           HA       SER  10  -8.216  -5.180  -3.940
   78    HB2  SER  10           HB2      SER  10  -7.858  -7.600  -3.038
   79    HB3  SER  10           HB3      SER  10  -9.349  -7.326  -2.136
   80    HG   SER  10           HG       SER  10  -9.524  -8.294  -4.276
   81    H    ALA  11           H        ALA  11  -9.111  -3.161  -3.549
   82    HA   ALA  11           HA       ALA  11 -10.507  -2.426  -1.175
   83    HB1  ALA  11           HB1      ALA  11 -11.158  -0.435  -2.494
   84    HB2  ALA  11           HB2      ALA  11  -9.442  -0.836  -2.745
   85    HB3  ALA  11           HB3      ALA  11 -10.639  -1.241  -3.983
   86    H    GLY  12           H        GLY  12 -11.592  -4.443  -3.745
   87    HA2  GLY  12           HA2      GLY  12 -14.382  -3.619  -3.636
   88    HA3  GLY  12           HA3      GLY  12 -13.722  -5.005  -4.497
   89    H    SER  13           H        SER  13 -12.486  -5.577  -1.554
   90    HA   SER  13           HA       SER  13 -14.340  -7.611  -0.907
   91    HB2  SER  13           HB2      SER  13 -12.154  -6.345   0.766
   92    HB3  SER  13           HB3      SER  13 -12.862  -7.959   1.015
   93    HG   SER  13           HG       SER  13 -10.796  -7.753  -0.253
   94    H    CYS  14           H        CYS  14 -14.642  -4.274  -0.250
   95    HA   CYS  14           HA       CYS  14 -17.037  -4.626   1.354
   96    HB2  CYS  14           HB2      CYS  14 -15.238  -4.489   3.118
   97    HB3  CYS  14           HB3      CYS  14 -14.604  -3.056   2.287
   98    H    PHE  15           H        PHE  15 -18.392  -2.786   0.585
   99    HA   PHE  15           HA       PHE  15 -17.043  -1.277  -1.541
  100    HB2  PHE  15           HB2      PHE  15 -19.287  -2.199  -1.842
  101    HB3  PHE  15           HB3      PHE  15 -19.892  -1.231  -0.516
  102    HD1  PHE  15           HD1      PHE  15 -19.848   1.382  -0.745
  103    HD2  PHE  15           HD2      PHE  15 -19.296  -1.346  -4.049
  104    HE1  PHE  15           HE1      PHE  15 -20.384   3.179  -2.313
  105    HE2  PHE  15           HE2      PHE  15 -19.981   0.446  -5.620
  106    HZ   PHE  15           HZ       PHE  15 -20.521   2.708  -4.768
  107    H    ALA  16           H        ALA  16 -15.757   0.328  -0.925
  108    HA   ALA  16           HA       ALA  16 -16.816   2.609   0.419
  109    HB1  ALA  16           HB1      ALA  16 -14.935   2.784   2.075
  110    HB2  ALA  16           HB2      ALA  16 -16.105   1.499   2.439
  111    HB3  ALA  16           HB3      ALA  16 -14.546   1.090   1.724
  112    H    PHE  17           H        PHE  17 -15.379   4.454  -0.018
  113    HA   PHE  17           HA       PHE  17 -13.289   3.905  -2.074
  114    HB2  PHE  17           HB2      PHE  17 -15.385   4.482  -3.154
  115    HB3  PHE  17           HB3      PHE  17 -15.479   5.986  -2.238
  116    HD1  PHE  17           HD2      PHE  17 -12.480   4.444  -3.994
  117    HD2  PHE  17           HD1      PHE  17 -15.384   7.652  -3.939
  118    HE1  PHE  17           HE2      PHE  17 -11.241   5.619  -5.761
  119    HE2  PHE  17           HE1      PHE  17 -14.112   8.800  -5.734
  120    HZ   PHE  17           HZ       PHE  17 -12.032   7.806  -6.624
  121    H    VAL  18           H        VAL  18 -11.482   4.371  -0.916
  122    HA   VAL  18           HA       VAL  18 -11.151   7.162  -0.028
  123    HB   VAL  18           HB       VAL  18  -9.888   6.252   1.989
  124   HG11  VAL  18          HG11      VAL  18 -11.901   6.216   3.365
  125   HG12  VAL  18          HG12      VAL  18 -12.089   7.432   2.092
  126   HG13  VAL  18          HG13      VAL  18 -12.919   5.871   1.956
  127   HG21  VAL  18          HG21      VAL  18  -9.851   3.830   1.422
  128   HG22  VAL  18          HG22      VAL  18 -10.697   4.115   2.947
  129   HG23  VAL  18          HG23      VAL  18 -11.624   3.791   1.471
  130    HA   PRO  19           HA       PRO  19  -7.621   6.117  -2.656
  131    HB2  PRO  19           HB2      PRO  19  -6.246   8.528  -2.491
  132    HB3  PRO  19           HB3      PRO  19  -7.554   8.187  -3.640
  133    HG2  PRO  19           HG2      PRO  19  -7.659   9.713  -1.058
  134    HG3  PRO  19           HG3      PRO  19  -8.571   9.993  -2.573
  135    HD2  PRO  19           HD2      PRO  19  -9.624   8.767  -0.318
  136    HD3  PRO  19           HD3      PRO  19 -10.209   8.450  -1.980
  137    H    SER  20           H        SER  20  -5.874   4.991  -1.898
  138    HA   SER  20           HA       SER  20  -4.509   5.995   0.549
  139    HB2  SER  20           HB2      SER  20  -6.319   4.328   1.018
  140    HB3  SER  20           HB3      SER  20  -5.385   3.188   0.048
  141    HG   SER  20           HG       SER  20  -4.186   4.444   2.287
  142    H    TYR  21           H        TYR  21  -2.394   4.190   0.697
  143    HA   TYR  21           HA       TYR  21  -1.097   4.611  -1.968
  144    HB2  TYR  21           HB2      TYR  21  -0.312   5.027   0.851
  145    HB3  TYR  21           HB3      TYR  21   0.851   4.384  -0.231
  146    HD1  TYR  21           HD2      TYR  21   1.859   5.833  -2.180
  147    HD2  TYR  21           HD1      TYR  21  -1.028   7.298   0.721
  148    HE1  TYR  21           HE2      TYR  21   2.381   8.085  -2.830
  149    HE2  TYR  21           HE1      TYR  21  -0.372   9.606   0.174
  150    HH   TYR  21           HH       TYR  21   1.181  10.921  -0.954
  151    H    TYR  22           H        TYR  22  -0.124   3.044  -3.050
  152    HA   TYR  22           HA       TYR  22  -0.172   0.250  -1.998
  153    HB2  TYR  22           HB2      TYR  22  -1.308   1.158  -4.218
  154    HB3  TYR  22           HB3      TYR  22   0.286   1.188  -4.855
  155    HD1  TYR  22           HD1      TYR  22   1.691  -0.945  -4.948
  156    HD2  TYR  22           HD2      TYR  22  -2.563  -0.861  -4.275
  157    HE1  TYR  22           HE1      TYR  22   1.560  -3.277  -5.644
  158    HE2  TYR  22           HE2      TYR  22  -2.732  -3.171  -5.102
  159    HH   TYR  22           HH       TYR  22  -1.548  -5.085  -5.917
  160    H    TYR  23           H        TYR  23   1.740  -0.812  -1.707
  161    HA   TYR  23           HA       TYR  23   4.340   0.483  -2.413
  162    HB2  TYR  23           HB2      TYR  23   4.177  -0.598  -0.234
  163    HB3  TYR  23           HB3      TYR  23   3.635  -2.083  -0.976
  164    HD1  TYR  23           HD1      TYR  23   6.632   0.219  -1.356
  165    HD2  TYR  23           HD2      TYR  23   5.131  -3.811  -1.246
  166    HE1  TYR  23           HE1      TYR  23   8.939  -0.634  -1.295
  167    HE2  TYR  23           HE2      TYR  23   7.444  -4.660  -1.080
  168    HH   TYR  23           HH       TYR  23  10.225  -2.659  -0.720
  169    H    ASN  24           H        ASN  24   5.608  -0.102  -4.209
  170    HA   ASN  24           HA       ASN  24   4.869  -2.621  -5.638
  171    HB2  ASN  24           HB2      ASN  24   5.653   0.059  -6.824
  172    HB3  ASN  24           HB3      ASN  24   5.541  -1.462  -7.720
  173   HD21  ASN  24          HD21      ASN  24   3.773   1.265  -6.767
  174   HD22  ASN  24          HD22      ASN  24   2.167   0.604  -7.076
  175    H    GLN  25           H        GLN  25   6.498  -3.772  -4.499
  176    HA   GLN  25           HA       GLN  25   9.169  -2.994  -4.185
  177    HB2  GLN  25           HB2      GLN  25   9.727  -5.470  -4.241
  178    HB3  GLN  25           HB3      GLN  25   8.655  -4.934  -2.987
  179    HG2  GLN  25           HG2      GLN  25   7.631  -6.226  -5.538
  180    HG3  GLN  25           HG3      GLN  25   8.107  -7.131  -4.093
  181   HE21  GLN  25          HE21      GLN  25   5.368  -5.674  -5.574
  182   HE22  GLN  25          HE22      GLN  25   4.435  -5.475  -4.124
  183    H    TYR  26           H        TYR  26   7.564  -4.323  -7.075
  184    HA   TYR  26           HA       TYR  26   9.681  -5.116  -8.634
  185    HB2  TYR  26           HB2      TYR  26   7.269  -3.487  -9.528
  186    HB3  TYR  26           HB3      TYR  26   8.314  -4.426 -10.580
  187    HD1  TYR  26           HD2      TYR  26   8.600  -6.994  -9.900
  188    HD2  TYR  26           HD1      TYR  26   5.231  -4.503  -8.849
  189    HE1  TYR  26           HE2      TYR  26   7.202  -9.011  -9.629
  190    HE2  TYR  26           HE1      TYR  26   3.835  -6.516  -8.588
  191    HH   TYR  26           HH       TYR  26   5.152  -9.819  -8.927
  192    H    SER  27           H        SER  27   8.578  -1.753  -8.095
  193    HA   SER  27           HA       SER  27  10.933  -0.770  -9.606
  194    HB2  SER  27           HB2      SER  27   8.534  -0.188 -10.319
  195    HB3  SER  27           HB3      SER  27   8.475   0.817  -8.864
  196    HG   SER  27           HG       SER  27  10.061   1.084 -11.204
  197    H    ASN  28           H        ASN  28  10.379  -1.551  -6.551
  198    HA   ASN  28           HA       ASN  28  11.040  -0.886  -4.500
  199    HB2  ASN  28           HB2      ASN  28  13.189  -1.314  -5.667
  200    HB3  ASN  28           HB3      ASN  28  13.263   0.366  -6.177
  201   HD21  ASN  28          HD21      ASN  28  12.932  -1.492  -3.057
  202   HD22  ASN  28          HD22      ASN  28  14.203  -0.501  -2.284
  203    H    THR  29           H        THR  29   8.913   0.606  -5.104
  204    HA   THR  29           HA       THR  29   9.389   3.016  -3.669
  205    HB   THR  29           HB       THR  29  10.112   3.764  -5.914
  206    HG1  THR  29           HG1      THR  29   8.549   5.585  -5.882
  207   HG21  THR  29          HG21      THR  29   8.623   2.473  -7.350
  208   HG22  THR  29          HG22      THR  29   8.413   4.210  -7.618
  209   HG23  THR  29          HG23      THR  29   7.207   3.315  -6.674
  210    H    CYS  30           H        CYS  30   6.913   4.312  -4.073
  211    HA   CYS  30           HA       CYS  30   4.828   2.265  -3.825
  212    HB2  CYS  30           HB2      CYS  30   4.782   4.422  -1.796
  213    HB3  CYS  30           HB3      CYS  30   4.328   2.715  -1.759
  214    H    HIS  31           H        HIS  31   2.675   3.241  -4.288
  215    HA   HIS  31           HA       HIS  31   2.678   5.990  -5.316
  216    HB2  HIS  31           HB2      HIS  31   3.418   4.170  -7.015
  217    HB3  HIS  31           HB3      HIS  31   1.763   3.588  -6.951
  218    HD1  HIS  31           HD1      HIS  31   0.548   4.509  -9.054
  219    HD2  HIS  31           HD2      HIS  31   3.427   7.085  -7.379
  220    HE1  HIS  31           HE1      HIS  31   0.600   6.582 -10.561
  221    H    SER  32           H        SER  32   0.560   6.915  -5.222
  222    HA   SER  32           HA       SER  32  -1.344   5.766  -3.480
  223    HB2  SER  32           HB2      SER  32  -1.524   7.796  -5.611
  224    HB3  SER  32           HB3      SER  32  -2.832   7.543  -4.435
  225    HG   SER  32           HG       SER  32  -1.493   9.269  -3.882
  226    H    PHE  33           H        PHE  33  -3.293   4.775  -3.833
  227    HA   PHE  33           HA       PHE  33  -4.292   4.141  -6.511
  228    HB2  PHE  33           HB2      PHE  33  -4.192   1.839  -6.396
  229    HB3  PHE  33           HB3      PHE  33  -2.605   2.323  -5.778
  230    HD1  PHE  33           HD2      PHE  33  -2.524   2.692  -3.138
  231    HD2  PHE  33           HD1      PHE  33  -5.389   0.197  -5.182
  232    HE1  PHE  33           HE2      PHE  33  -2.979   1.506  -1.058
  233    HE2  PHE  33           HE1      PHE  33  -5.867  -0.945  -3.032
  234    HZ   PHE  33           HZ       PHE  33  -4.645  -0.243  -0.953
  235    H    THR  34           H        THR  34  -6.422   2.554  -5.918
  236    HA   THR  34           HA       THR  34  -7.963   4.272  -4.016
  237    HB   THR  34           HB       THR  34  -9.982   3.387  -5.082
  238    HG1  THR  34           HG1      THR  34  -9.846   1.729  -6.298
  239   HG21  THR  34          HG21      THR  34  -9.732   4.620  -7.188
  240   HG22  THR  34          HG22      THR  34  -7.970   4.554  -7.061
  241   HG23  THR  34          HG23      THR  34  -8.899   5.471  -5.862
  242    H    TYR  35           H        TYR  35  -8.655   3.544  -2.067
  243    HA   TYR  35           HA       TYR  35  -8.515   0.662  -1.621
  244    HB2  TYR  35           HB2      TYR  35  -6.678   1.813  -0.636
  245    HB3  TYR  35           HB3      TYR  35  -7.795   2.675   0.442
  246    HD1  TYR  35           HD1      TYR  35  -6.705  -0.817  -0.612
  247    HD2  TYR  35           HD2      TYR  35  -8.286   1.653   2.569
  248    HE1  TYR  35           HE1      TYR  35  -6.175  -2.563   1.022
  249    HE2  TYR  35           HE2      TYR  35  -7.873  -0.231   4.173
  250    HH   TYR  35           HH       TYR  35  -5.887  -2.973   3.396
  251    H    SER  36           H        SER  36  -9.800   0.225   0.617
  252    HA   SER  36           HA       SER  36 -12.439   1.610   0.502
  253    HB2  SER  36           HB2      SER  36 -12.819  -0.361  -0.556
  254    HB3  SER  36           HB3      SER  36 -11.625  -1.272   0.372
  255    HG   SER  36           HG       SER  36 -14.075  -1.457   0.644
  256    H    GLY  37           H        GLY  37 -10.137  -0.219   2.651
  257    HA2  GLY  37           HA2      GLY  37  -9.576   0.724   4.835
  258    HA3  GLY  37           HA3      GLY  37 -11.191   1.398   4.950
  259    H    CYS  38           H        CYS  38 -13.034  -0.214   4.781
  260    HA   CYS  38           HA       CYS  38 -12.649  -2.413   6.610
  261    HB2  CYS  38           HB2      CYS  38 -15.022  -2.952   5.872
  262    HB3  CYS  38           HB3      CYS  38 -14.757  -1.374   6.607
  263    H    GLY  39           H        GLY  39 -12.381  -2.040   3.127
  264    HA2  GLY  39           HA2      GLY  39 -12.091  -4.968   2.699
  265    HA3  GLY  39           HA3      GLY  39 -12.569  -3.772   1.472
  266    H    GLY  40           H        GLY  40 -10.263  -5.632   1.529
  267    HA2  GLY  40           HA2      GLY  40  -8.284  -5.274   0.292
  268    HA3  GLY  40           HA3      GLY  40  -8.095  -3.682   1.030
  269    H    ASN  41           H        ASN  41  -5.922  -5.070   1.115
  270    HA   ASN  41           HA       ASN  41  -5.704  -6.449   3.750
  271    HB2  ASN  41           HB2      ASN  41  -4.144  -6.890   1.168
  272    HB3  ASN  41           HB3      ASN  41  -3.703  -7.598   2.695
  273   HD21  ASN  41          HD21      ASN  41  -4.951  -9.223   3.713
  274   HD22  ASN  41          HD22      ASN  41  -6.166 -10.082   2.769
  275    H    ALA  42           H        ALA  42  -3.238  -6.589   4.346
  276    HA   ALA  42           HA       ALA  42  -2.531  -4.235   5.513
  277    HB1  ALA  42           HB1      ALA  42  -0.598  -5.300   6.314
  278    HB2  ALA  42           HB2      ALA  42  -1.855  -6.544   6.217
  279    HB3  ALA  42           HB3      ALA  42  -0.564  -6.453   4.980
  280    H    ASN  43           H        ASN  43  -1.813  -4.831   2.142
  281    HA   ASN  43           HA       ASN  43   0.648  -3.303   2.060
  282    HB2  ASN  43           HB2      ASN  43  -0.043  -4.736   0.219
  283    HB3  ASN  43           HB3      ASN  43  -1.478  -3.737  -0.062
  284   HD21  ASN  43          HD21      ASN  43  -0.576  -3.687  -2.320
  285   HD22  ASN  43          HD22      ASN  43   0.685  -2.549  -2.686
  286    H    ARG  44           H        ARG  44  -2.443  -2.411   3.011
  287    HA   ARG  44           HA       ARG  44  -2.589   0.228   1.996
  288    HB2  ARG  44           HB2      ARG  44  -4.431  -1.174   3.183
  289    HB3  ARG  44           HB3      ARG  44  -3.689  -0.729   4.719
  290    HG2  ARG  44           HG2      ARG  44  -3.926   1.682   3.244
  291    HG3  ARG  44           HG3      ARG  44  -5.386   0.776   2.927
  292    HD2  ARG  44           HD2      ARG  44  -5.846   0.810   5.365
  293    HD3  ARG  44           HD3      ARG  44  -4.437   1.918   5.506
  294    HE   ARG  44           HE       ARG  44  -5.692   3.010   3.447
  295   HH11  ARG  44          HH11      ARG  44  -7.027   2.046   6.592
  296   HH12  ARG  44          HH12      ARG  44  -8.461   2.998   6.473
  297   HH21  ARG  44          HH21      ARG  44  -7.315   4.726   3.602
  298   HH22  ARG  44          HH22      ARG  44  -8.670   4.512   4.675
  299    H    PHE  45           H        PHE  45  -1.837   2.081   2.646
  300    HA   PHE  45           HA       PHE  45  -0.570   2.544   5.257
  301    HB2  PHE  45           HB2      PHE  45   0.705   2.704   2.530
  302    HB3  PHE  45           HB3      PHE  45   1.193   3.845   3.780
  303    HD1  PHE  45           HD1      PHE  45   2.393   3.188   5.799
  304    HD2  PHE  45           HD2      PHE  45   1.426   0.379   2.672
  305    HE1  PHE  45           HE1      PHE  45   4.097   1.633   6.668
  306    HE2  PHE  45           HE2      PHE  45   3.111  -1.179   3.545
  307    HZ   PHE  45           HZ       PHE  45   4.480  -0.560   5.516
  308    H    ARG  46           H        ARG  46   0.041   4.961   5.199
  309    HA   ARG  46           HA       ARG  46  -2.213   6.545   4.054
  310    HB2  ARG  46           HB2      ARG  46  -1.639   8.069   6.106
  311    HB3  ARG  46           HB3      ARG  46  -2.669   6.661   6.253
  312    HG2  ARG  46           HG2      ARG  46  -1.123   6.873   8.137
  313    HG3  ARG  46           HG3      ARG  46  -0.964   5.341   7.303
  314    HD2  ARG  46           HD2      ARG  46   1.213   6.166   7.936
  315    HD3  ARG  46           HD3      ARG  46   1.121   6.181   6.191
  316    HE   ARG  46           HE       ARG  46   1.010   8.545   6.166
  317   HH11  ARG  46          HH11      ARG  46   1.402   7.297   9.535
  318   HH12  ARG  46          HH12      ARG  46   1.789   8.883  10.119
  319   HH21  ARG  46          HH21      ARG  46   1.484  10.629   7.128
  320   HH22  ARG  46          HH22      ARG  46   1.975  10.631   8.800
  321    H    THR  47           H        THR  47   1.258   6.204   3.919
  322    HA   THR  47           HA       THR  47   1.328   8.401   2.105
  323    HB   THR  47           HB       THR  47   1.504   9.624   4.322
  324    HG1  THR  47           HG1      THR  47   3.595  10.645   3.521
  325   HG21  THR  47          HG21      THR  47   3.420   9.354   5.728
  326   HG22  THR  47          HG22      THR  47   4.281   8.414   4.507
  327   HG23  THR  47          HG23      THR  47   2.966   7.661   5.342
  328    H    ILE  48           H        ILE  48   3.090   8.305   0.760
  329    HA   ILE  48           HA       ILE  48   4.511   5.873   0.547
  330    HB   ILE  48           HB       ILE  48   4.167   7.123  -1.396
  331   HG12  ILE  48          HG12      ILE  48   7.104   7.411  -0.721
  332   HG13  ILE  48          HG13      ILE  48   6.352   5.922  -1.181
  333   HG21  ILE  48          HG21      ILE  48   3.887   9.420  -0.488
  334   HG22  ILE  48          HG22      ILE  48   5.626   9.501  -0.170
  335   HG23  ILE  48          HG23      ILE  48   5.014   9.405  -1.828
  336   HD11  ILE  48          HD11      ILE  48   6.834   8.392  -2.860
  337   HD12  ILE  48          HD12      ILE  48   7.326   6.711  -3.168
  338   HD13  ILE  48          HD13      ILE  48   5.626   7.186  -3.327
  339    H    ASP  49           H        ASP  49   5.135   8.767   2.452
  340    HA   ASP  49           HA       ASP  49   7.928   8.442   2.823
  341    HB2  ASP  49           HB2      ASP  49   6.204   9.512   5.019
  342    HB3  ASP  49           HB3      ASP  49   7.821  10.008   4.540
  343    H    GLU  50           H        GLU  50   5.200   6.856   4.442
  344    HA   GLU  50           HA       GLU  50   6.860   5.635   6.521
  345    HB2  GLU  50           HB2      GLU  50   3.926   5.451   5.714
  346    HB3  GLU  50           HB3      GLU  50   4.630   4.437   6.963
  347    HG2  GLU  50           HG2      GLU  50   4.567   7.485   7.036
  348    HG3  GLU  50           HG3      GLU  50   3.464   6.410   7.900
  349    H    CYS  51           H        CYS  51   5.055   4.834   3.550
  350    HA   CYS  51           HA       CYS  51   5.560   2.094   3.658
  351    HB2  CYS  51           HB2      CYS  51   3.926   2.660   2.164
  352    HB3  CYS  51           HB3      CYS  51   4.898   3.949   1.398
  353    H    ASN  52           H        ASN  52   7.383   4.684   1.972
  354    HA   ASN  52           HA       ASN  52   9.241   2.820   0.913
  355    HB2  ASN  52           HB2      ASN  52  10.242   4.516  -0.232
  356    HB3  ASN  52           HB3      ASN  52   8.690   5.250   0.046
  357   HD21  ASN  52          HD21      ASN  52   8.608   7.040   1.336
  358   HD22  ASN  52          HD22      ASN  52  10.010   7.879   1.946
  359    H    ARG  53           H        ARG  53   9.451   5.070   3.731
  360    HA   ARG  53           HA       ARG  53  11.983   4.134   4.419
  361    HB2  ARG  53           HB2      ARG  53  11.826   5.224   6.425
  362    HB3  ARG  53           HB3      ARG  53  10.718   6.114   5.356
  363    HG2  ARG  53           HG2      ARG  53   8.830   4.856   6.411
  364    HG3  ARG  53           HG3      ARG  53   9.960   4.177   7.584
  365    HD2  ARG  53           HD2      ARG  53   9.512   7.163   7.091
  366    HD3  ARG  53           HD3      ARG  53   8.751   6.256   8.391
  367    HE   ARG  53           HE       ARG  53  11.560   7.086   8.131
  368   HH11  ARG  53          HH11      ARG  53   9.280   5.010   9.940
  369   HH12  ARG  53          HH12      ARG  53  10.313   4.874  11.326
  370   HH21  ARG  53          HH21      ARG  53  12.960   6.775   9.976
  371   HH22  ARG  53          HH22      ARG  53  12.356   5.899  11.371
  372    H    THR  54           H        THR  54   8.968   2.388   4.909
  373    HA   THR  54           HA       THR  54  10.393   0.466   6.631
  374    HB   THR  54           HB       THR  54   8.169   1.502   7.197
  375    HG1  THR  54           HG1      THR  54   7.511  -0.550   8.095
  376   HG21  THR  54          HG21      THR  54   6.192   0.735   6.331
  377   HG22  THR  54          HG22      THR  54   6.901  -0.754   5.640
  378   HG23  THR  54          HG23      THR  54   7.142   0.823   4.858
  379    H    CYS  55           H        CYS  55   9.293   0.636   3.249
  380    HA   CYS  55           HA       CYS  55  10.074  -2.229   2.967
  381    HB2  CYS  55           HB2      CYS  55   7.994  -0.850   1.279
  382    HB3  CYS  55           HB3      CYS  55   8.315  -2.580   1.438
  383    H    VAL  56           H        VAL  56  10.662   0.979   1.758
  384    HA   VAL  56           HA       VAL  56  11.754  -0.080  -0.812
  385    HB   VAL  56           HB       VAL  56  11.337   2.694   0.230
  386   HG11  VAL  56          HG11      VAL  56  13.315   2.950  -1.014
  387   HG12  VAL  56          HG12      VAL  56  12.684   1.955  -2.346
  388   HG13  VAL  56          HG13      VAL  56  11.973   3.546  -1.982
  389   HG21  VAL  56          HG21      VAL  56  10.186   1.208  -2.172
  390   HG22  VAL  56          HG22      VAL  56   9.328   1.416  -0.638
  391   HG23  VAL  56          HG23      VAL  56   9.712   2.826  -1.612
  392    H    GLY  57           H        GLY  57  13.266  -1.381   0.039
  393    HA2  GLY  57           HA2      GLY  57  15.321  -0.482   1.891
  394    HA3  GLY  57           HA3      GLY  57  15.304  -2.007   0.969
  Start of MODEL   10
    1    H1   ARG   1           H        ARG   1  12.426  -5.787   3.747
    2    HA   ARG   1           HA       ARG   1  10.602  -4.350   2.945
    3    HB2  ARG   1           HB2      ARG   1   9.568  -4.863   0.809
    4    HB3  ARG   1           HB3      ARG   1  11.233  -4.330   0.699
    5    HG2  ARG   1           HG2      ARG   1  11.421  -7.170   0.590
    6    HG3  ARG   1           HG3      ARG   1  10.004  -6.725  -0.363
    7    HD2  ARG   1           HD2      ARG   1  11.650  -6.484  -1.989
    8    HD3  ARG   1           HD3      ARG   1  11.552  -4.888  -1.408
    9    HE   ARG   1           HE       ARG   1  13.596  -5.153  -0.167
   10   HH11  ARG   1          HH11      ARG   1  12.910  -7.842  -2.387
   11   HH12  ARG   1          HH12      ARG   1  14.610  -8.142  -2.707
   12   HH21  ARG   1          HH21      ARG   1  15.821  -5.666  -0.524
   13   HH22  ARG   1          HH22      ARG   1  16.232  -7.033  -1.512
   14    HA   PRO   2           HA       PRO   2   8.927  -7.791   5.376
   15    HB2  PRO   2           HB2      PRO   2   6.757  -6.481   6.430
   16    HB3  PRO   2           HB3      PRO   2   8.408  -6.181   7.018
   17    HG2  PRO   2           HG2      PRO   2   6.920  -4.619   4.974
   18    HG3  PRO   2           HG3      PRO   2   7.780  -3.992   6.430
   19    HD2  PRO   2           HD2      PRO   2   9.095  -3.939   4.088
   20    HD3  PRO   2           HD3      PRO   2   9.919  -4.581   5.529
   21    H    ARG   3           H        ARG   3   7.295  -9.317   5.087
   22    HA   ARG   3           HA       ARG   3   6.096  -9.510   2.567
   23    HB2  ARG   3           HB2      ARG   3   4.976 -11.474   3.269
   24    HB3  ARG   3           HB3      ARG   3   6.586 -11.445   3.949
   25    HG2  ARG   3           HG2      ARG   3   5.153 -12.415   5.512
   26    HG3  ARG   3           HG3      ARG   3   5.615 -10.846   6.174
   27    HD2  ARG   3           HD2      ARG   3   3.393  -9.988   5.802
   28    HD3  ARG   3           HD3      ARG   3   2.948 -11.370   4.805
   29    HE   ARG   3           HE       ARG   3   3.006 -11.145   7.722
   30   HH11  ARG   3          HH11      ARG   3   2.822 -13.504   5.009
   31   HH12  ARG   3          HH12      ARG   3   2.382 -14.790   6.099
   32   HH21  ARG   3          HH21      ARG   3   2.091 -12.888   9.001
   33   HH22  ARG   3          HH22      ARG   3   1.916 -14.439   8.263
   34    H    PHE   4           H        PHE   4   4.799  -7.755   5.280
   35    HA   PHE   4           HA       PHE   4   2.063  -8.065   4.378
   36    HB2  PHE   4           HB2      PHE   4   1.464  -6.661   6.078
   37    HB3  PHE   4           HB3      PHE   4   2.867  -7.474   6.724
   38    HD1  PHE   4           HD2      PHE   4   1.612  -4.330   5.201
   39    HD2  PHE   4           HD1      PHE   4   4.825  -6.204   7.344
   40    HE1  PHE   4           HE2      PHE   4   2.395  -2.119   5.935
   41    HE2  PHE   4           HE1      PHE   4   5.802  -3.966   7.826
   42    HZ   PHE   4           HZ       PHE   4   4.580  -1.916   7.170
   43    H    CYS   5           H        CYS   5   4.722  -5.917   3.403
   44    HA   CYS   5           HA       CYS   5   2.987  -3.941   2.223
   45    HB2  CYS   5           HB2      CYS   5   5.951  -4.585   2.138
   46    HB3  CYS   5           HB3      CYS   5   5.239  -3.356   1.095
   47    H    GLU   6           H        GLU   6   4.036  -7.071   1.189
   48    HA   GLU   6           HA       GLU   6   3.619  -6.293  -1.676
   49    HB2  GLU   6           HB2      GLU   6   4.863  -8.141  -2.335
   50    HB3  GLU   6           HB3      GLU   6   5.677  -7.440  -0.943
   51    HG2  GLU   6           HG2      GLU   6   4.066  -9.282   0.315
   52    HG3  GLU   6           HG3      GLU   6   4.250 -10.065  -1.245
   53    H    LEU   7           H        LEU   7   1.485  -6.950   0.516
   54    HA   LEU   7           HA       LEU   7   0.084  -9.236  -0.675
   55    HB2  LEU   7           HB2      LEU   7  -0.981  -7.186   1.274
   56    HB3  LEU   7           HB3      LEU   7  -1.681  -8.766   0.906
   57    HG   LEU   7           HG       LEU   7   0.933  -8.225   2.350
   58   HD11  LEU   7          HD11      LEU   7  -1.161  -7.812   3.623
   59   HD12  LEU   7          HD12      LEU   7  -0.207  -9.141   4.286
   60   HD13  LEU   7          HD13      LEU   7  -1.654  -9.492   3.326
   61   HD21  LEU   7          HD21      LEU   7  -0.298 -10.939   1.815
   62   HD22  LEU   7          HD22      LEU   7   1.129 -10.592   2.829
   63   HD23  LEU   7          HD23      LEU   7   1.214 -10.309   1.093
   64    H    ALA   8           H        ALA   8  -2.289  -8.894  -1.388
   65    HA   ALA   8           HA       ALA   8  -2.315  -6.742  -3.436
   66    HB1  ALA   8           HB1      ALA   8  -4.068  -9.197  -3.150
   67    HB2  ALA   8           HB2      ALA   8  -4.073  -8.011  -4.481
   68    HB3  ALA   8           HB3      ALA   8  -2.652  -9.029  -4.223
   69    HA   PRO   9           HA       PRO   9  -5.068  -4.928  -0.299
   70    HB2  PRO   9           HB2      PRO   9  -5.227  -2.399  -1.230
   71    HB3  PRO   9           HB3      PRO   9  -3.760  -3.041  -0.425
   72    HG2  PRO   9           HG2      PRO   9  -4.295  -2.764  -3.407
   73    HG3  PRO   9           HG3      PRO   9  -2.818  -2.314  -2.487
   74    HD2  PRO   9           HD2      PRO   9  -3.116  -4.697  -3.851
   75    HD3  PRO   9           HD3      PRO   9  -2.102  -4.520  -2.392
   76    H    SER  10           H        SER  10  -6.931  -6.190  -0.778
   77    HA   SER  10           HA       SER  10  -8.586  -6.013  -3.014
   78    HB2  SER  10           HB2      SER  10  -9.570  -6.804  -0.260
   79    HB3  SER  10           HB3      SER  10  -9.928  -7.514  -1.838
   80    HG   SER  10           HG       SER  10  -7.725  -8.265  -1.852
   81    H    ALA  11           H        ALA  11  -8.615  -3.559  -3.128
   82    HA   ALA  11           HA       ALA  11 -10.128  -1.942  -1.335
   83    HB1  ALA  11           HB1      ALA  11 -10.003  -0.308  -3.189
   84    HB2  ALA  11           HB2      ALA  11  -8.436  -1.117  -2.952
   85    HB3  ALA  11           HB3      ALA  11  -9.493  -1.590  -4.298
   86    H    GLY  12           H        GLY  12 -11.338  -4.399  -3.197
   87    HA2  GLY  12           HA2      GLY  12 -13.840  -2.995  -4.006
   88    HA3  GLY  12           HA3      GLY  12 -13.291  -4.557  -4.589
   89    H    SER  13           H        SER  13 -12.751  -5.246  -1.547
   90    HA   SER  13           HA       SER  13 -14.937  -6.836  -1.120
   91    HB2  SER  13           HB2      SER  13 -13.104  -5.561   0.914
   92    HB3  SER  13           HB3      SER  13 -13.967  -7.110   1.095
   93    HG   SER  13           HG       SER  13 -12.383  -8.023   0.072
   94    H    CYS  14           H        CYS  14 -14.337  -3.907   0.956
   95    HA   CYS  14           HA       CYS  14 -17.259  -3.795   1.500
   96    HB2  CYS  14           HB2      CYS  14 -14.858  -2.360   2.699
   97    HB3  CYS  14           HB3      CYS  14 -16.544  -2.109   3.180
   98    H    PHE  15           H        PHE  15 -18.482  -1.906   0.819
   99    HA   PHE  15           HA       PHE  15 -17.162  -0.562  -1.453
  100    HB2  PHE  15           HB2      PHE  15 -19.524  -1.444  -1.519
  101    HB3  PHE  15           HB3      PHE  15 -19.990  -0.139  -0.453
  102    HD1  PHE  15           HD1      PHE  15 -19.071   2.348  -1.334
  103    HD2  PHE  15           HD2      PHE  15 -19.766  -1.130  -3.799
  104    HE1  PHE  15           HE1      PHE  15 -19.171   3.777  -3.326
  105    HE2  PHE  15           HE2      PHE  15 -19.898   0.328  -5.793
  106    HZ   PHE  15           HZ       PHE  15 -19.630   2.785  -5.561
  107    H    ALA  16           H        ALA  16 -15.812   0.997  -0.916
  108    HA   ALA  16           HA       ALA  16 -16.828   3.327   0.468
  109    HB1  ALA  16           HB1      ALA  16 -15.997   2.216   2.394
  110    HB2  ALA  16           HB2      ALA  16 -14.513   1.729   1.569
  111    HB3  ALA  16           HB3      ALA  16 -14.779   3.437   1.972
  112    H    PHE  17           H        PHE  17 -15.140   5.099   0.330
  113    HA   PHE  17           HA       PHE  17 -13.355   4.788  -2.034
  114    HB2  PHE  17           HB2      PHE  17 -15.685   5.782  -2.480
  115    HB3  PHE  17           HB3      PHE  17 -15.163   7.192  -1.597
  116    HD1  PHE  17           HD2      PHE  17 -12.195   6.291  -3.238
  117    HD2  PHE  17           HD1      PHE  17 -16.176   7.731  -4.104
  118    HE1  PHE  17           HE2      PHE  17 -11.401   7.159  -5.357
  119    HE2  PHE  17           HE1      PHE  17 -15.340   8.684  -6.215
  120    HZ   PHE  17           HZ       PHE  17 -12.955   8.457  -6.853
  121    H    VAL  18           H        VAL  18 -11.432   4.831  -0.828
  122    HA   VAL  18           HA       VAL  18 -10.832   7.306   0.624
  123    HB   VAL  18           HB       VAL  18  -9.648   5.897   2.408
  124   HG11  VAL  18          HG11      VAL  18 -12.698   5.975   2.463
  125   HG12  VAL  18          HG12      VAL  18 -11.588   5.956   3.853
  126   HG13  VAL  18          HG13      VAL  18 -11.640   7.358   2.780
  127   HG21  VAL  18          HG21      VAL  18 -11.763   3.847   1.595
  128   HG22  VAL  18          HG22      VAL  18 -10.006   3.637   1.442
  129   HG23  VAL  18          HG23      VAL  18 -10.744   3.779   3.039
  130    HA   PRO  19           HA       PRO  19  -7.503   6.274  -2.262
  131    HB2  PRO  19           HB2      PRO  19  -6.152   8.669  -2.258
  132    HB3  PRO  19           HB3      PRO  19  -7.635   8.359  -3.204
  133    HG2  PRO  19           HG2      PRO  19  -7.360   9.774  -0.553
  134    HG3  PRO  19           HG3      PRO  19  -8.370  10.216  -1.955
  135    HD2  PRO  19           HD2      PRO  19  -9.344   8.884   0.263
  136    HD3  PRO  19           HD3      PRO  19 -10.036   8.655  -1.362
  137    H    SER  20           H        SER  20  -5.846   5.029  -1.572
  138    HA   SER  20           HA       SER  20  -4.251   5.952   0.752
  139    HB2  SER  20           HB2      SER  20  -5.057   3.068   0.385
  140    HB3  SER  20           HB3      SER  20  -4.275   3.832   1.767
  141    HG   SER  20           HG       SER  20  -6.859   4.496   0.826
  142    H    TYR  21           H        TYR  21  -2.144   4.116   0.773
  143    HA   TYR  21           HA       TYR  21  -0.912   4.504  -1.937
  144    HB2  TYR  21           HB2      TYR  21   0.153   4.745   0.829
  145    HB3  TYR  21           HB3      TYR  21   1.241   4.151  -0.404
  146    HD1  TYR  21           HD1      TYR  21  -0.704   7.019   0.755
  147    HD2  TYR  21           HD2      TYR  21   2.044   5.624  -2.298
  148    HE1  TYR  21           HE1      TYR  21  -0.251   9.335   0.095
  149    HE2  TYR  21           HE2      TYR  21   2.388   7.937  -3.026
  150    HH   TYR  21           HH       TYR  21   0.918  10.753  -1.388
  151    H    TYR  22           H        TYR  22   0.104   2.967  -3.006
  152    HA   TYR  22           HA       TYR  22   0.002   0.155  -2.081
  153    HB2  TYR  22           HB2      TYR  22  -1.277   1.052  -4.192
  154    HB3  TYR  22           HB3      TYR  22   0.272   1.285  -4.907
  155    HD1  TYR  22           HD1      TYR  22   1.861  -0.842  -4.991
  156    HD2  TYR  22           HD2      TYR  22  -2.420  -0.868  -4.611
  157    HE1  TYR  22           HE1      TYR  22   1.868  -3.108  -5.871
  158    HE2  TYR  22           HE2      TYR  22  -2.462  -3.199  -5.557
  159    HH   TYR  22           HH       TYR  22   0.504  -4.772  -6.788
  160    H    TYR  23           H        TYR  23   1.942  -0.769  -1.704
  161    HA   TYR  23           HA       TYR  23   4.476   0.582  -2.474
  162    HB2  TYR  23           HB2      TYR  23   4.389  -0.377  -0.278
  163    HB3  TYR  23           HB3      TYR  23   3.797  -1.914  -0.904
  164    HD1  TYR  23           HD1      TYR  23   6.827   0.314  -1.092
  165    HD2  TYR  23           HD2      TYR  23   5.191  -3.665  -1.353
  166    HE1  TYR  23           HE1      TYR  23   9.118  -0.645  -1.210
  167    HE2  TYR  23           HE2      TYR  23   7.472  -4.621  -1.249
  168    HH   TYR  23           HH       TYR  23  10.318  -2.756  -0.785
  169    H    ASN  24           H        ASN  24   5.678   0.002  -4.256
  170    HA   ASN  24           HA       ASN  24   4.899  -2.478  -5.726
  171    HB2  ASN  24           HB2      ASN  24   5.776   0.169  -6.939
  172    HB3  ASN  24           HB3      ASN  24   5.623  -1.359  -7.799
  173   HD21  ASN  24          HD21      ASN  24   3.770   1.286  -6.260
  174   HD22  ASN  24          HD22      ASN  24   2.258   0.807  -7.013
  175    H    GLN  25           H        GLN  25   6.462  -3.777  -4.853
  176    HA   GLN  25           HA       GLN  25   9.140  -2.932  -4.330
  177    HB2  GLN  25           HB2      GLN  25   9.751  -5.163  -3.935
  178    HB3  GLN  25           HB3      GLN  25   8.182  -4.928  -3.232
  179    HG2  GLN  25           HG2      GLN  25   8.731  -6.378  -5.830
  180    HG3  GLN  25           HG3      GLN  25   8.509  -7.135  -4.265
  181   HE21  GLN  25          HE21      GLN  25   6.126  -5.055  -3.656
  182   HE22  GLN  25          HE22      GLN  25   4.876  -5.713  -4.659
  183    H    TYR  26           H        TYR  26   7.584  -4.300  -7.231
  184    HA   TYR  26           HA       TYR  26   9.910  -4.896  -8.678
  185    HB2  TYR  26           HB2      TYR  26   7.188  -3.947  -9.632
  186    HB3  TYR  26           HB3      TYR  26   8.424  -4.603 -10.681
  187    HD1  TYR  26           HD2      TYR  26   9.479  -6.984  -9.562
  188    HD2  TYR  26           HD1      TYR  26   5.466  -5.469  -9.175
  189    HE1  TYR  26           HE2      TYR  26   8.645  -9.291  -9.384
  190    HE2  TYR  26           HE1      TYR  26   4.600  -7.789  -9.009
  191    HH   TYR  26           HH       TYR  26   5.345 -10.120  -9.780
  192    H    SER  27           H        SER  27   8.648  -1.770  -7.837
  193    HA   SER  27           HA       SER  27  10.548  -0.445  -9.724
  194    HB2  SER  27           HB2      SER  27   8.097  -0.186 -10.194
  195    HB3  SER  27           HB3      SER  27   7.921   0.625  -8.635
  196    HG   SER  27           HG       SER  27   8.185   1.992 -10.493
  197    H    ASN  28           H        ASN  28  10.321  -1.452  -6.632
  198    HA   ASN  28           HA       ASN  28  10.839  -0.837  -4.604
  199    HB2  ASN  28           HB2      ASN  28  13.010  -1.205  -5.985
  200    HB3  ASN  28           HB3      ASN  28  13.255   0.528  -5.783
  201   HD21  ASN  28          HD21      ASN  28  14.506   0.907  -3.919
  202   HD22  ASN  28          HD22      ASN  28  14.669  -0.199  -2.565
  203    H    THR  29           H        THR  29   8.870   0.715  -5.212
  204    HA   THR  29           HA       THR  29   9.395   3.098  -3.709
  205    HB   THR  29           HB       THR  29  10.083   3.724  -6.035
  206    HG1  THR  29           HG1      THR  29   9.269   5.158  -4.416
  207   HG21  THR  29          HG21      THR  29   8.395   2.484  -7.358
  208   HG22  THR  29          HG22      THR  29   8.401   4.210  -7.723
  209   HG23  THR  29          HG23      THR  29   7.113   3.536  -6.715
  210    H    CYS  30           H        CYS  30   6.950   4.417  -4.320
  211    HA   CYS  30           HA       CYS  30   4.844   2.432  -3.710
  212    HB2  CYS  30           HB2      CYS  30   5.999   3.868  -1.698
  213    HB3  CYS  30           HB3      CYS  30   4.866   5.073  -2.307
  214    H    HIS  31           H        HIS  31   2.680   3.424  -4.204
  215    HA   HIS  31           HA       HIS  31   2.727   5.965  -5.646
  216    HB2  HIS  31           HB2      HIS  31   3.310   3.938  -7.230
  217    HB3  HIS  31           HB3      HIS  31   1.614   3.490  -6.992
  218    HD1  HIS  31           HD1      HIS  31   0.482   4.253  -9.274
  219    HD2  HIS  31           HD2      HIS  31   3.241   6.956  -7.595
  220    HE1  HIS  31           HE1      HIS  31   0.533   6.244 -10.845
  221    H    SER  32           H        SER  32   0.657   6.979  -5.451
  222    HA   SER  32           HA       SER  32  -1.065   5.782  -3.490
  223    HB2  SER  32           HB2      SER  32  -2.543   7.727  -4.143
  224    HB3  SER  32           HB3      SER  32  -0.992   8.062  -3.369
  225    HG   SER  32           HG       SER  32  -0.554   9.270  -4.986
  226    H    PHE  33           H        PHE  33  -3.033   4.775  -3.724
  227    HA   PHE  33           HA       PHE  33  -4.136   4.228  -6.378
  228    HB2  PHE  33           HB2      PHE  33  -4.191   1.940  -6.170
  229    HB3  PHE  33           HB3      PHE  33  -2.571   2.325  -5.625
  230    HD1  PHE  33           HD2      PHE  33  -2.411   2.651  -2.946
  231    HD2  PHE  33           HD1      PHE  33  -5.470   0.387  -4.958
  232    HE1  PHE  33           HE2      PHE  33  -2.955   1.442  -0.820
  233    HE2  PHE  33           HE1      PHE  33  -5.976  -0.793  -2.879
  234    HZ   PHE  33           HZ       PHE  33  -4.684  -0.218  -0.758
  235    H    THR  34           H        THR  34  -6.344   2.793  -5.676
  236    HA   THR  34           HA       THR  34  -7.818   4.604  -3.807
  237    HB   THR  34           HB       THR  34  -9.744   3.408  -5.189
  238    HG1  THR  34           HG1      THR  34  -8.691   2.091  -6.542
  239   HG21  THR  34          HG21      THR  34  -9.274   5.839  -5.214
  240   HG22  THR  34          HG22      THR  34  -9.713   5.235  -6.819
  241   HG23  THR  34          HG23      THR  34  -8.016   5.583  -6.444
  242    H    TYR  35           H        TYR  35  -8.617   3.740  -1.893
  243    HA   TYR  35           HA       TYR  35  -8.644   0.797  -1.662
  244    HB2  TYR  35           HB2      TYR  35  -6.819   1.964  -0.416
  245    HB3  TYR  35           HB3      TYR  35  -8.059   2.693   0.589
  246    HD1  TYR  35           HD1      TYR  35  -6.988  -0.678  -0.729
  247    HD2  TYR  35           HD2      TYR  35  -8.374   1.614   2.652
  248    HE1  TYR  35           HE1      TYR  35  -6.321  -2.523   0.811
  249    HE2  TYR  35           HE2      TYR  35  -7.845  -0.252   4.152
  250    HH   TYR  35           HH       TYR  35  -7.044  -2.688   4.178
  251    H    SER  36           H        SER  36 -10.008   0.199   0.537
  252    HA   SER  36           HA       SER  36 -12.389   1.875   0.867
  253    HB2  SER  36           HB2      SER  36 -13.772  -0.199   0.768
  254    HB3  SER  36           HB3      SER  36 -13.090   0.291  -0.790
  255    HG   SER  36           HG       SER  36 -12.743  -1.790  -0.665
  256    H    GLY  37           H        GLY  37 -13.433   1.386   3.006
  257    HA2  GLY  37           HA2      GLY  37 -11.787   1.332   5.133
  258    HA3  GLY  37           HA3      GLY  37 -13.469   0.841   5.197
  259    H    CYS  38           H        CYS  38 -13.630  -1.692   4.146
  260    HA   CYS  38           HA       CYS  38 -11.536  -3.229   5.615
  261    HB2  CYS  38           HB2      CYS  38 -13.403  -4.800   6.191
  262    HB3  CYS  38           HB3      CYS  38 -13.316  -3.267   7.032
  263    H    GLY  39           H        GLY  39 -11.441  -5.473   5.158
  264    HA2  GLY  39           HA2      GLY  39 -11.560  -7.379   3.840
  265    HA3  GLY  39           HA3      GLY  39 -12.140  -6.440   2.474
  266    H    GLY  40           H        GLY  40 -10.277  -4.395   2.273
  267    HA2  GLY  40           HA2      GLY  40  -8.206  -5.372   0.818
  268    HA3  GLY  40           HA3      GLY  40  -8.188  -3.817   1.658
  269    H    ASN  41           H        ASN  41  -6.002  -5.690   1.078
  270    HA   ASN  41           HA       ASN  41  -5.234  -6.760   3.691
  271    HB2  ASN  41           HB2      ASN  41  -3.977  -7.011   0.946
  272    HB3  ASN  41           HB3      ASN  41  -3.266  -7.668   2.401
  273   HD21  ASN  41          HD21      ASN  41  -5.382  -8.556  -0.124
  274   HD22  ASN  41          HD22      ASN  41  -6.184  -9.839   0.704
  275    H    ALA  42           H        ALA  42  -3.005  -6.563   4.389
  276    HA   ALA  42           HA       ALA  42  -2.458  -4.048   5.210
  277    HB1  ALA  42           HB1      ALA  42  -0.414  -6.255   5.012
  278    HB2  ALA  42           HB2      ALA  42  -0.463  -4.925   6.182
  279    HB3  ALA  42           HB3      ALA  42  -1.715  -6.184   6.227
  280    H    ASN  43           H        ASN  43  -1.630  -4.891   1.951
  281    HA   ASN  43           HA       ASN  43   0.823  -3.389   1.761
  282    HB2  ASN  43           HB2      ASN  43   0.132  -4.882  -0.004
  283    HB3  ASN  43           HB3      ASN  43  -1.337  -3.941  -0.314
  284   HD21  ASN  43          HD21      ASN  43  -0.570  -3.742  -2.690
  285   HD22  ASN  43          HD22      ASN  43   0.774  -2.679  -2.975
  286    H    ARG  44           H        ARG  44  -2.453  -2.350   2.320
  287    HA   ARG  44           HA       ARG  44  -2.205   0.248   1.127
  288    HB2  ARG  44           HB2      ARG  44  -4.358  -0.561   1.550
  289    HB3  ARG  44           HB3      ARG  44  -4.007  -1.026   3.206
  290    HG2  ARG  44           HG2      ARG  44  -3.852   1.903   2.518
  291    HG3  ARG  44           HG3      ARG  44  -5.431   1.183   2.518
  292    HD2  ARG  44           HD2      ARG  44  -3.535   1.255   4.900
  293    HD3  ARG  44           HD3      ARG  44  -4.983   2.228   4.656
  294    HE   ARG  44           HE       ARG  44  -5.382  -0.665   4.568
  295   HH11  ARG  44          HH11      ARG  44  -5.124   2.071   6.844
  296   HH12  ARG  44          HH12      ARG  44  -6.307   1.428   7.928
  297   HH21  ARG  44          HH21      ARG  44  -6.927  -1.548   6.210
  298   HH22  ARG  44          HH22      ARG  44  -7.226  -0.593   7.608
  299    H    PHE  45           H        PHE  45  -1.404   2.037   1.786
  300    HA   PHE  45           HA       PHE  45  -0.504   2.513   4.566
  301    HB2  PHE  45           HB2      PHE  45   1.095   2.584   2.046
  302    HB3  PHE  45           HB3      PHE  45   1.281   4.009   3.064
  303    HD1  PHE  45           HD1      PHE  45   2.047   3.820   5.454
  304    HD2  PHE  45           HD2      PHE  45   1.818   0.430   2.810
  305    HE1  PHE  45           HE1      PHE  45   3.275   2.441   7.114
  306    HE2  PHE  45           HE2      PHE  45   3.129  -0.902   4.388
  307    HZ   PHE  45           HZ       PHE  45   3.787   0.076   6.614
  308    H    ARG  46           H        ARG  46  -0.022   4.939   4.797
  309    HA   ARG  46           HA       ARG  46  -2.305   6.476   3.648
  310    HB2  ARG  46           HB2      ARG  46  -1.974   7.833   5.834
  311    HB3  ARG  46           HB3      ARG  46  -2.824   6.309   5.856
  312    HG2  ARG  46           HG2      ARG  46  -1.324   6.592   7.779
  313    HG3  ARG  46           HG3      ARG  46  -0.986   5.145   6.867
  314    HD2  ARG  46           HD2      ARG  46   1.072   6.229   7.638
  315    HD3  ARG  46           HD3      ARG  46   1.012   6.236   5.877
  316    HE   ARG  46           HE       ARG  46   0.733   8.561   5.861
  317   HH11  ARG  46          HH11      ARG  46   1.071   7.394   9.251
  318   HH12  ARG  46          HH12      ARG  46   1.197   9.011   9.821
  319   HH21  ARG  46          HH21      ARG  46   0.604  10.625   6.758
  320   HH22  ARG  46          HH22      ARG  46   0.935  10.860   8.424
  321    H    THR  47           H        THR  47   1.118   6.294   3.554
  322    HA   THR  47           HA       THR  47   1.236   8.650   2.008
  323    HB   THR  47           HB       THR  47   1.303   9.642   4.337
  324    HG1  THR  47           HG1      THR  47   2.200  10.786   2.643
  325   HG21  THR  47          HG21      THR  47   3.273   9.404   5.700
  326   HG22  THR  47          HG22      THR  47   4.091   8.458   4.449
  327   HG23  THR  47          HG23      THR  47   2.752   7.748   5.309
  328    H    ILE  48           H        ILE  48   3.187   8.708   0.789
  329    HA   ILE  48           HA       ILE  48   4.399   6.128   0.463
  330    HB   ILE  48           HB       ILE  48   4.188   7.385  -1.484
  331   HG12  ILE  48          HG12      ILE  48   7.133   7.646  -0.788
  332   HG13  ILE  48          HG13      ILE  48   6.355   6.120  -1.123
  333   HG21  ILE  48          HG21      ILE  48   3.976   9.680  -0.575
  334   HG22  ILE  48          HG22      ILE  48   5.715   9.677  -0.166
  335   HG23  ILE  48          HG23      ILE  48   5.170   9.640  -1.850
  336   HD11  ILE  48          HD11      ILE  48   6.726   8.440  -3.041
  337   HD12  ILE  48          HD12      ILE  48   7.409   6.810  -3.132
  338   HD13  ILE  48          HD13      ILE  48   5.668   7.047  -3.383
  339    H    ASP  49           H        ASP  49   5.063   8.968   2.389
  340    HA   ASP  49           HA       ASP  49   7.834   8.693   2.792
  341    HB2  ASP  49           HB2      ASP  49   5.833   9.806   4.768
  342    HB3  ASP  49           HB3      ASP  49   7.566  10.089   4.733
  343    H    GLU  50           H        GLU  50   5.098   7.009   4.315
  344    HA   GLU  50           HA       GLU  50   6.748   5.711   6.348
  345    HB2  GLU  50           HB2      GLU  50   3.839   5.887   5.623
  346    HB3  GLU  50           HB3      GLU  50   4.376   4.388   6.327
  347    HG2  GLU  50           HG2      GLU  50   3.520   5.843   8.023
  348    HG3  GLU  50           HG3      GLU  50   5.220   5.411   8.275
  349    H    CYS  51           H        CYS  51   4.868   4.968   3.476
  350    HA   CYS  51           HA       CYS  51   5.273   2.236   3.260
  351    HB2  CYS  51           HB2      CYS  51   3.717   3.459   1.866
  352    HB3  CYS  51           HB3      CYS  51   5.049   4.387   1.153
  353    H    ASN  52           H        ASN  52   7.334   4.853   1.883
  354    HA   ASN  52           HA       ASN  52   9.194   2.996   0.844
  355    HB2  ASN  52           HB2      ASN  52  10.272   4.711  -0.163
  356    HB3  ASN  52           HB3      ASN  52   8.674   5.444   0.039
  357   HD21  ASN  52          HD21      ASN  52   8.500   7.250   1.317
  358   HD22  ASN  52          HD22      ASN  52   9.878   8.104   1.982
  359    H    ARG  53           H        ARG  53   9.434   5.256   3.669
  360    HA   ARG  53           HA       ARG  53  11.860   4.185   4.446
  361    HB2  ARG  53           HB2      ARG  53  11.726   5.371   6.406
  362    HB3  ARG  53           HB3      ARG  53  10.580   6.232   5.350
  363    HG2  ARG  53           HG2      ARG  53   8.728   4.965   6.485
  364    HG3  ARG  53           HG3      ARG  53   9.919   4.314   7.633
  365    HD2  ARG  53           HD2      ARG  53  10.507   6.569   8.370
  366    HD3  ARG  53           HD3      ARG  53   9.524   7.275   7.094
  367    HE   ARG  53           HE       ARG  53   7.600   6.939   8.229
  368   HH11  ARG  53          HH11      ARG  53  10.226   5.427  10.100
  369   HH12  ARG  53          HH12      ARG  53   9.348   5.431  11.589
  370   HH21  ARG  53          HH21      ARG  53   6.451   6.988  10.199
  371   HH22  ARG  53          HH22      ARG  53   7.158   6.379  11.639
  372    H    THR  54           H        THR  54   8.827   2.552   4.814
  373    HA   THR  54           HA       THR  54   9.979   0.683   6.765
  374    HB   THR  54           HB       THR  54   7.704   1.950   6.834
  375    HG1  THR  54           HG1      THR  54   8.410   0.681   8.428
  376   HG21  THR  54          HG21      THR  54   5.830   0.974   6.008
  377   HG22  THR  54          HG22      THR  54   6.605  -0.636   5.758
  378   HG23  THR  54          HG23      THR  54   6.908   0.744   4.658
  379    H    CYS  55           H        CYS  55   9.033   0.673   3.294
  380    HA   CYS  55           HA       CYS  55   9.869  -2.163   3.191
  381    HB2  CYS  55           HB2      CYS  55   7.509  -0.803   1.849
  382    HB3  CYS  55           HB3      CYS  55   8.059  -2.455   1.500
  383    H    VAL  56           H        VAL  56  10.488   0.949   1.834
  384    HA   VAL  56           HA       VAL  56  11.542  -0.242  -0.679
  385    HB   VAL  56           HB       VAL  56  11.338   2.596   0.329
  386   HG11  VAL  56          HG11      VAL  56  13.400   2.568  -0.856
  387   HG12  VAL  56          HG12      VAL  56  12.611   1.772  -2.245
  388   HG13  VAL  56          HG13      VAL  56  12.135   3.416  -1.744
  389   HG21  VAL  56          HG21      VAL  56   9.261   1.486  -0.619
  390   HG22  VAL  56          HG22      VAL  56   9.811   2.868  -1.564
  391   HG23  VAL  56          HG23      VAL  56  10.159   1.220  -2.122
  392    H    GLY  57           H        GLY  57  13.210  -1.550  -0.162
  393    HA2  GLY  57           HA2      GLY  57  15.173  -0.846   1.882
  394    HA3  GLY  57           HA3      GLY  57  15.167  -2.262   0.796
  Start of MODEL   11
    1    H1   ARG   1           H        ARG   1  12.807  -5.322   2.881
    2    HA   ARG   1           HA       ARG   1  10.561  -4.541   3.116
    3    HB2  ARG   1           HB2      ARG   1  10.272  -6.354   0.724
    4    HB3  ARG   1           HB3      ARG   1   9.792  -4.669   0.996
    5    HG2  ARG   1           HG2      ARG   1  11.554  -4.412  -0.484
    6    HG3  ARG   1           HG3      ARG   1  12.352  -4.164   1.048
    7    HD2  ARG   1           HD2      ARG   1  12.814  -6.817   0.760
    8    HD3  ARG   1           HD3      ARG   1  12.440  -6.444  -0.912
    9    HE   ARG   1           HE       ARG   1  14.787  -5.606   0.671
   10   HH11  ARG   1          HH11      ARG   1  13.085  -5.237  -2.430
   11   HH12  ARG   1          HH12      ARG   1  14.240  -4.129  -3.087
   12   HH21  ARG   1          HH21      ARG   1  16.342  -4.201  -0.206
   13   HH22  ARG   1          HH22      ARG   1  16.119  -3.486  -1.772
   14    HA   PRO   2           HA       PRO   2   8.521  -7.819   5.391
   15    HB2  PRO   2           HB2      PRO   2   6.394  -6.425   6.369
   16    HB3  PRO   2           HB3      PRO   2   8.055  -6.226   6.980
   17    HG2  PRO   2           HG2      PRO   2   6.620  -4.554   4.896
   18    HG3  PRO   2           HG3      PRO   2   7.524  -3.963   6.339
   19    HD2  PRO   2           HD2      PRO   2   8.706  -4.019   3.904
   20    HD3  PRO   2           HD3      PRO   2   9.614  -4.477   5.367
   21    H    ARG   3           H        ARG   3   6.832  -9.260   5.150
   22    HA   ARG   3           HA       ARG   3   5.632  -9.546   2.676
   23    HB2  ARG   3           HB2      ARG   3   4.416 -11.352   3.563
   24    HB3  ARG   3           HB3      ARG   3   5.932 -11.342   4.430
   25    HG2  ARG   3           HG2      ARG   3   3.212 -10.417   5.472
   26    HG3  ARG   3           HG3      ARG   3   4.068 -11.874   5.921
   27    HD2  ARG   3           HD2      ARG   3   4.896  -9.049   6.614
   28    HD3  ARG   3           HD3      ARG   3   4.276 -10.293   7.713
   29    HE   ARG   3           HE       ARG   3   6.368 -11.611   6.766
   30   HH11  ARG   3          HH11      ARG   3   6.217  -8.458   8.387
   31   HH12  ARG   3          HH12      ARG   3   7.938  -8.398   8.626
   32   HH21  ARG   3          HH21      ARG   3   8.536 -11.459   6.945
   33   HH22  ARG   3          HH22      ARG   3   9.295 -10.235   7.914
   34    H    PHE   4           H        PHE   4   4.324  -7.659   5.390
   35    HA   PHE   4           HA       PHE   4   1.645  -7.730   4.432
   36    HB2  PHE   4           HB2      PHE   4   1.182  -6.138   6.045
   37    HB3  PHE   4           HB3      PHE   4   2.510  -7.032   6.741
   38    HD1  PHE   4           HD2      PHE   4   1.561  -3.930   4.918
   39    HD2  PHE   4           HD1      PHE   4   4.494  -5.856   7.398
   40    HE1  PHE   4           HE2      PHE   4   2.666  -1.710   5.389
   41    HE2  PHE   4           HE1      PHE   4   5.632  -3.664   7.769
   42    HZ   PHE   4           HZ       PHE   4   4.683  -1.597   6.781
   43    H    CYS   5           H        CYS   5   4.473  -5.933   3.389
   44    HA   CYS   5           HA       CYS   5   3.006  -3.898   2.010
   45    HB2  CYS   5           HB2      CYS   5   5.738  -4.491   2.742
   46    HB3  CYS   5           HB3      CYS   5   5.693  -4.243   1.013
   47    H    GLU   6           H        GLU   6   3.731  -7.210   1.240
   48    HA   GLU   6           HA       GLU   6   3.588  -6.522  -1.685
   49    HB2  GLU   6           HB2      GLU   6   4.803  -8.387  -2.214
   50    HB3  GLU   6           HB3      GLU   6   5.582  -7.687  -0.800
   51    HG2  GLU   6           HG2      GLU   6   4.155  -9.480   0.515
   52    HG3  GLU   6           HG3      GLU   6   3.991 -10.262  -1.052
   53    H    LEU   7           H        LEU   7   1.306  -7.007   0.463
   54    HA   LEU   7           HA       LEU   7  -0.118  -9.240  -0.712
   55    HB2  LEU   7           HB2      LEU   7  -1.173  -7.033   1.090
   56    HB3  LEU   7           HB3      LEU   7  -1.882  -8.636   0.807
   57    HG   LEU   7           HG       LEU   7   0.690  -7.979   2.280
   58   HD11  LEU   7          HD11      LEU   7  -1.463  -7.556   3.439
   59   HD12  LEU   7          HD12      LEU   7  -0.464  -8.778   4.229
   60   HD13  LEU   7          HD13      LEU   7  -1.869  -9.274   3.258
   61   HD21  LEU   7          HD21      LEU   7   0.855 -10.343   2.870
   62   HD22  LEU   7          HD22      LEU   7   1.075 -10.088   1.146
   63   HD23  LEU   7          HD23      LEU   7  -0.475 -10.734   1.747
   64    H    ALA   8           H        ALA   8  -2.376  -8.907  -1.470
   65    HA   ALA   8           HA       ALA   8  -2.467  -6.811  -3.581
   66    HB1  ALA   8           HB1      ALA   8  -4.193  -8.226  -4.576
   67    HB2  ALA   8           HB2      ALA   8  -2.663  -9.101  -4.375
   68    HB3  ALA   8           HB3      ALA   8  -4.014  -9.391  -3.250
   69    HA   PRO   9           HA       PRO   9  -5.392  -5.203  -0.457
   70    HB2  PRO   9           HB2      PRO   9  -5.734  -2.685  -1.429
   71    HB3  PRO   9           HB3      PRO   9  -4.262  -3.201  -0.555
   72    HG2  PRO   9           HG2      PRO   9  -4.676  -2.957  -3.541
   73    HG3  PRO   9           HG3      PRO   9  -3.269  -2.443  -2.557
   74    HD2  PRO   9           HD2      PRO   9  -3.387  -4.819  -3.962
   75    HD3  PRO   9           HD3      PRO   9  -2.404  -4.601  -2.489
   76    H    SER  10           H        SER  10  -7.167  -6.512  -0.892
   77    HA   SER  10           HA       SER  10  -8.691  -6.431  -3.305
   78    HB2  SER  10           HB2      SER  10  -8.463  -8.407  -1.721
   79    HB3  SER  10           HB3      SER  10  -9.533  -7.562  -0.607
   80    HG   SER  10           HG       SER  10 -10.104  -8.501  -3.238
   81    H    ALA  11           H        ALA  11  -8.902  -4.072  -3.382
   82    HA   ALA  11           HA       ALA  11 -10.429  -2.507  -1.547
   83    HB1  ALA  11           HB1      ALA  11  -9.848  -2.053  -4.510
   84    HB2  ALA  11           HB2      ALA  11 -10.352  -0.824  -3.331
   85    HB3  ALA  11           HB3      ALA  11  -8.768  -1.602  -3.171
   86    H    GLY  12           H        GLY  12 -11.543  -5.021  -3.402
   87    HA2  GLY  12           HA2      GLY  12 -14.187  -3.819  -4.044
   88    HA3  GLY  12           HA3      GLY  12 -13.547  -5.359  -4.634
   89    H    SER  13           H        SER  13 -12.587  -5.625  -1.593
   90    HA   SER  13           HA       SER  13 -14.638  -7.419  -0.785
   91    HB2  SER  13           HB2      SER  13 -12.206  -7.565  -0.310
   92    HB3  SER  13           HB3      SER  13 -12.340  -6.154   0.732
   93    HG   SER  13           HG       SER  13 -13.882  -7.470   1.992
   94    H    CYS  14           H        CYS  14 -14.811  -4.067  -0.712
   95    HA   CYS  14           HA       CYS  14 -17.039  -3.907   1.103
   96    HB2  CYS  14           HB2      CYS  14 -14.852  -3.686   2.525
   97    HB3  CYS  14           HB3      CYS  14 -14.669  -2.133   1.696
   98    H    PHE  15           H        PHE  15 -17.696  -1.357   0.945
   99    HA   PHE  15           HA       PHE  15 -16.724  -0.295  -1.671
  100    HB2  PHE  15           HB2      PHE  15 -18.870  -1.464  -2.066
  101    HB3  PHE  15           HB3      PHE  15 -19.627  -0.531  -0.790
  102    HD1  PHE  15           HD1      PHE  15 -19.431   2.214  -1.135
  103    HD2  PHE  15           HD2      PHE  15 -19.185  -0.755  -4.277
  104    HE1  PHE  15           HE1      PHE  15 -19.806   3.941  -2.778
  105    HE2  PHE  15           HE2      PHE  15 -19.733   0.999  -5.932
  106    HZ   PHE  15           HZ       PHE  15 -20.003   3.359  -5.210
  107    H    ALA  16           H        ALA  16 -15.635   1.375  -0.965
  108    HA   ALA  16           HA       ALA  16 -16.925   3.538   0.387
  109    HB1  ALA  16           HB1      ALA  16 -14.368   2.680   1.704
  110    HB2  ALA  16           HB2      ALA  16 -15.678   3.668   2.338
  111    HB3  ALA  16           HB3      ALA  16 -15.884   1.900   2.220
  112    H    PHE  17           H        PHE  17 -15.314   5.488   0.248
  113    HA   PHE  17           HA       PHE  17 -13.292   5.030  -1.927
  114    HB2  PHE  17           HB2      PHE  17 -15.202   6.097  -2.854
  115    HB3  PHE  17           HB3      PHE  17 -15.278   7.275  -1.542
  116    HD1  PHE  17           HD2      PHE  17 -12.364   6.144  -3.682
  117    HD2  PHE  17           HD1      PHE  17 -14.980   9.389  -2.556
  118    HE1  PHE  17           HE2      PHE  17 -10.902   7.736  -4.881
  119    HE2  PHE  17           HE1      PHE  17 -13.539  10.967  -3.810
  120    HZ   PHE  17           HZ       PHE  17 -11.472  10.145  -4.929
  121    H    VAL  18           H        VAL  18 -11.474   4.889  -0.639
  122    HA   VAL  18           HA       VAL  18 -10.661   7.381   0.710
  123    HB   VAL  18           HB       VAL  18  -9.636   5.923   2.519
  124   HG11  VAL  18          HG11      VAL  18 -11.620   6.125   3.895
  125   HG12  VAL  18          HG12      VAL  18 -11.596   7.487   2.769
  126   HG13  VAL  18          HG13      VAL  18 -12.685   6.126   2.472
  127   HG21  VAL  18          HG21      VAL  18 -10.876   3.881   3.133
  128   HG22  VAL  18          HG22      VAL  18 -11.833   3.981   1.645
  129   HG23  VAL  18          HG23      VAL  18 -10.081   3.671   1.569
  130    HA   PRO  19           HA       PRO  19  -7.549   5.988  -2.327
  131    HB2  PRO  19           HB2      PRO  19  -6.280   8.415  -2.659
  132    HB3  PRO  19           HB3      PRO  19  -7.751   7.900  -3.545
  133    HG2  PRO  19           HG2      PRO  19  -7.577   9.641  -1.074
  134    HG3  PRO  19           HG3      PRO  19  -8.546   9.896  -2.561
  135    HD2  PRO  19           HD2      PRO  19  -9.615   8.844  -0.307
  136    HD3  PRO  19           HD3      PRO  19 -10.119   8.248  -1.922
  137    H    SER  20           H        SER  20  -5.976   4.836  -1.436
  138    HA   SER  20           HA       SER  20  -4.363   5.952   0.795
  139    HB2  SER  20           HB2      SER  20  -5.159   3.065   0.490
  140    HB3  SER  20           HB3      SER  20  -4.331   3.865   1.830
  141    HG   SER  20           HG       SER  20  -6.952   4.507   0.947
  142    H    TYR  21           H        TYR  21  -2.236   4.080   0.848
  143    HA   TYR  21           HA       TYR  21  -0.985   4.546  -1.850
  144    HB2  TYR  21           HB2      TYR  21   0.032   4.871   0.922
  145    HB3  TYR  21           HB3      TYR  21   1.151   4.177  -0.233
  146    HD1  TYR  21           HD2      TYR  21   1.977   5.529  -2.230
  147    HD2  TYR  21           HD1      TYR  21  -0.681   7.163   0.775
  148    HE1  TYR  21           HE2      TYR  21   2.414   7.784  -3.066
  149    HE2  TYR  21           HE1      TYR  21  -0.149   9.427   0.002
  150    HH   TYR  21           HH       TYR  21   2.195  10.106  -2.635
  151    H    TYR  22           H        TYR  22   0.041   2.987  -2.888
  152    HA   TYR  22           HA       TYR  22  -0.074   0.169  -1.923
  153    HB2  TYR  22           HB2      TYR  22  -1.381   1.044  -4.051
  154    HB3  TYR  22           HB3      TYR  22   0.154   1.268  -4.770
  155    HD1  TYR  22           HD1      TYR  22   1.690  -0.930  -4.963
  156    HD2  TYR  22           HD2      TYR  22  -2.569  -0.900  -4.375
  157    HE1  TYR  22           HE1      TYR  22   1.591  -3.177  -5.895
  158    HE2  TYR  22           HE2      TYR  22  -2.710  -3.166  -5.372
  159    HH   TYR  22           HH       TYR  22   0.088  -4.775  -6.862
  160    H    TYR  23           H        TYR  23   1.844  -1.028  -2.197
  161    HA   TYR  23           HA       TYR  23   4.354   0.522  -2.849
  162    HB2  TYR  23           HB2      TYR  23   4.463  -0.166  -0.619
  163    HB3  TYR  23           HB3      TYR  23   3.780  -1.756  -0.973
  164    HD1  TYR  23           HD1      TYR  23   6.858   0.364  -1.231
  165    HD2  TYR  23           HD2      TYR  23   5.161  -3.578  -1.564
  166    HE1  TYR  23           HE1      TYR  23   9.108  -0.632  -1.110
  167    HE2  TYR  23           HE2      TYR  23   7.423  -4.563  -1.270
  168    HH   TYR  23           HH       TYR  23  10.231  -2.743  -0.644
  169    H    ASN  24           H        ASN  24   5.619  -0.068  -4.538
  170    HA   ASN  24           HA       ASN  24   4.987  -2.609  -5.944
  171    HB2  ASN  24           HB2      ASN  24   5.672   0.120  -7.026
  172    HB3  ASN  24           HB3      ASN  24   6.144  -1.346  -7.905
  173   HD21  ASN  24          HD21      ASN  24   4.651  -1.640  -9.581
  174   HD22  ASN  24          HD22      ASN  24   2.911  -1.616  -9.304
  175    H    GLN  25           H        GLN  25   6.397  -3.842  -4.820
  176    HA   GLN  25           HA       GLN  25   9.074  -3.301  -4.110
  177    HB2  GLN  25           HB2      GLN  25   9.390  -5.661  -3.842
  178    HB3  GLN  25           HB3      GLN  25   7.857  -5.208  -3.168
  179    HG2  GLN  25           HG2      GLN  25   8.219  -6.638  -5.798
  180    HG3  GLN  25           HG3      GLN  25   7.810  -7.384  -4.265
  181   HE21  GLN  25          HE21      GLN  25   5.796  -5.056  -3.568
  182   HE22  GLN  25          HE22      GLN  25   4.486  -5.433  -4.686
  183    H    TYR  26           H        TYR  26   7.658  -4.488  -7.179
  184    HA   TYR  26           HA       TYR  26  10.102  -5.218  -8.403
  185    HB2  TYR  26           HB2      TYR  26   7.489  -4.238  -9.601
  186    HB3  TYR  26           HB3      TYR  26   8.799  -4.961 -10.520
  187    HD1  TYR  26           HD2      TYR  26   9.693  -7.326  -9.347
  188    HD2  TYR  26           HD1      TYR  26   5.703  -5.695  -9.205
  189    HE1  TYR  26           HE2      TYR  26   8.787  -9.596  -9.060
  190    HE2  TYR  26           HE1      TYR  26   4.785  -7.971  -8.818
  191    HH   TYR  26           HH       TYR  26   6.876 -10.873  -9.050
  192    H    SER  27           H        SER  27   8.827  -2.068  -7.699
  193    HA   SER  27           HA       SER  27  10.907  -0.854  -9.480
  194    HB2  SER  27           HB2      SER  27   8.532  -0.500 -10.201
  195    HB3  SER  27           HB3      SER  27   8.263   0.397  -8.696
  196    HG   SER  27           HG       SER  27   8.835   1.797 -10.385
  197    H    ASN  28           H        ASN  28  10.378  -1.701  -6.395
  198    HA   ASN  28           HA       ASN  28  10.947  -1.003  -4.341
  199    HB2  ASN  28           HB2      ASN  28  13.141  -1.402  -5.491
  200    HB3  ASN  28           HB3      ASN  28  13.213   0.295  -5.933
  201   HD21  ASN  28          HD21      ASN  28  12.743  -1.605  -2.846
  202   HD22  ASN  28          HD22      ASN  28  14.051  -0.719  -2.052
  203    H    THR  29           H        THR  29   8.865   0.504  -5.190
  204    HA   THR  29           HA       THR  29   9.293   2.998  -3.808
  205    HB   THR  29           HB       THR  29  10.061   3.375  -6.203
  206    HG1  THR  29           HG1      THR  29   9.675   5.291  -5.731
  207   HG21  THR  29          HG21      THR  29   8.444   3.750  -7.938
  208   HG22  THR  29          HG22      THR  29   7.086   3.390  -6.862
  209   HG23  THR  29          HG23      THR  29   8.217   2.105  -7.344
  210    H    CYS  30           H        CYS  30   6.970   4.262  -4.296
  211    HA   CYS  30           HA       CYS  30   4.746   2.297  -4.043
  212    HB2  CYS  30           HB2      CYS  30   5.257   4.694  -2.262
  213    HB3  CYS  30           HB3      CYS  30   3.797   3.725  -2.231
  214    H    HIS  31           H        HIS  31   2.608   3.462  -4.253
  215    HA   HIS  31           HA       HIS  31   2.652   6.099  -5.484
  216    HB2  HIS  31           HB2      HIS  31   3.166   4.131  -7.212
  217    HB3  HIS  31           HB3      HIS  31   1.446   3.813  -7.081
  218    HD1  HIS  31           HD1      HIS  31   0.494   4.834  -9.304
  219    HD2  HIS  31           HD2      HIS  31   3.427   7.149  -7.386
  220    HE1  HIS  31           HE1      HIS  31   0.725   6.949 -10.692
  221    H    SER  32           H        SER  32   0.515   7.019  -5.489
  222    HA   SER  32           HA       SER  32  -1.196   5.896  -3.446
  223    HB2  SER  32           HB2      SER  32  -2.598   7.790  -3.824
  224    HB3  SER  32           HB3      SER  32  -0.909   8.290  -3.689
  225    HG   SER  32           HG       SER  32  -0.908   8.348  -6.101
  226    H    PHE  33           H        PHE  33  -3.136   4.753  -3.639
  227    HA   PHE  33           HA       PHE  33  -4.251   4.172  -6.301
  228    HB2  PHE  33           HB2      PHE  33  -4.247   1.890  -6.097
  229    HB3  PHE  33           HB3      PHE  33  -2.650   2.303  -5.523
  230    HD1  PHE  33           HD2      PHE  33  -2.502   2.593  -2.851
  231    HD2  PHE  33           HD1      PHE  33  -5.550   0.354  -4.885
  232    HE1  PHE  33           HE2      PHE  33  -3.039   1.366  -0.739
  233    HE2  PHE  33           HE1      PHE  33  -6.107  -0.804  -2.805
  234    HZ   PHE  33           HZ       PHE  33  -4.807  -0.249  -0.667
  235    H    THR  34           H        THR  34  -6.443   2.702  -5.669
  236    HA   THR  34           HA       THR  34  -7.926   4.444  -3.740
  237    HB   THR  34           HB       THR  34  -9.923   3.513  -5.069
  238    HG1  THR  34           HG1      THR  34  -9.482   2.246  -6.590
  239   HG21  THR  34          HG21      THR  34  -9.118   5.851  -5.252
  240   HG22  THR  34          HG22      THR  34  -9.700   5.224  -6.800
  241   HG23  THR  34          HG23      THR  34  -7.957   5.350  -6.500
  242    H    TYR  35           H        TYR  35  -8.650   3.605  -1.835
  243    HA   TYR  35           HA       TYR  35  -8.879   0.679  -1.634
  244    HB2  TYR  35           HB2      TYR  35  -6.933   1.712  -0.378
  245    HB3  TYR  35           HB3      TYR  35  -8.111   2.476   0.664
  246    HD1  TYR  35           HD1      TYR  35  -7.363  -0.938  -0.815
  247    HD2  TYR  35           HD2      TYR  35  -8.307   1.354   2.721
  248    HE1  TYR  35           HE1      TYR  35  -7.012  -2.938   0.580
  249    HE2  TYR  35           HE2      TYR  35  -8.045  -0.657   4.101
  250    HH   TYR  35           HH       TYR  35  -7.497  -2.940   4.125
  251    H    SER  36           H        SER  36 -10.417   0.098   0.364
  252    HA   SER  36           HA       SER  36 -12.595   2.097   0.569
  253    HB2  SER  36           HB2      SER  36 -12.821  -0.889   0.125
  254    HB3  SER  36           HB3      SER  36 -14.172   0.198   0.482
  255    HG   SER  36           HG       SER  36 -13.505   1.427  -1.410
  256    H    GLY  37           H        GLY  37 -10.222   1.035   2.377
  257    HA2  GLY  37           HA2      GLY  37  -9.877   1.091   4.664
  258    HA3  GLY  37           HA3      GLY  37 -11.577   1.529   4.879
  259    H    CYS  38           H        CYS  38 -13.160  -0.220   4.638
  260    HA   CYS  38           HA       CYS  38 -12.523  -2.529   6.273
  261    HB2  CYS  38           HB2      CYS  38 -14.930  -3.149   5.411
  262    HB3  CYS  38           HB3      CYS  38 -14.703  -1.800   6.514
  263    H    GLY  39           H        GLY  39 -12.523  -4.813   5.497
  264    HA2  GLY  39           HA2      GLY  39 -12.053  -6.450   3.925
  265    HA3  GLY  39           HA3      GLY  39 -12.575  -5.333   2.653
  266    H    GLY  40           H        GLY  40 -10.672  -6.328   1.517
  267    HA2  GLY  40           HA2      GLY  40  -8.681  -5.955   0.540
  268    HA3  GLY  40           HA3      GLY  40  -8.487  -4.513   1.519
  269    H    ASN  41           H        ASN  41  -6.200  -5.137   1.467
  270    HA   ASN  41           HA       ASN  41  -5.493  -7.041   3.609
  271    HB2  ASN  41           HB2      ASN  41  -4.241  -6.945   0.816
  272    HB3  ASN  41           HB3      ASN  41  -3.402  -7.543   2.208
  273   HD21  ASN  41          HD21      ASN  41  -5.525  -8.629  -0.253
  274   HD22  ASN  41          HD22      ASN  41  -6.026 -10.108   0.542
  275    H    ALA  42           H        ALA  42  -3.330  -6.670   4.405
  276    HA   ALA  42           HA       ALA  42  -2.921  -4.121   5.241
  277    HB1  ALA  42           HB1      ALA  42  -0.869  -4.911   6.222
  278    HB2  ALA  42           HB2      ALA  42  -2.075  -6.206   6.292
  279    HB3  ALA  42           HB3      ALA  42  -0.776  -6.252   5.064
  280    H    ASN  43           H        ASN  43  -2.091  -4.962   1.992
  281    HA   ASN  43           HA       ASN  43   0.292  -3.381   1.726
  282    HB2  ASN  43           HB2      ASN  43  -0.375  -5.026   0.070
  283    HB3  ASN  43           HB3      ASN  43  -1.806  -4.066  -0.354
  284   HD21  ASN  43          HD21      ASN  43  -1.309  -3.378  -2.516
  285   HD22  ASN  43          HD22      ASN  43   0.243  -2.755  -2.955
  286    H    ARG  44           H        ARG  44  -2.747  -2.332   2.674
  287    HA   ARG  44           HA       ARG  44  -2.688   0.231   1.194
  288    HB2  ARG  44           HB2      ARG  44  -4.883  -0.573   1.679
  289    HB3  ARG  44           HB3      ARG  44  -4.487  -0.957   3.351
  290    HG2  ARG  44           HG2      ARG  44  -4.162   1.904   2.486
  291    HG3  ARG  44           HG3      ARG  44  -5.790   1.328   2.549
  292    HD2  ARG  44           HD2      ARG  44  -3.844   1.442   4.879
  293    HD3  ARG  44           HD3      ARG  44  -5.276   2.439   4.610
  294    HE   ARG  44           HE       ARG  44  -5.869  -0.381   4.660
  295   HH11  ARG  44          HH11      ARG  44  -5.049   2.298   6.902
  296   HH12  ARG  44          HH12      ARG  44  -6.050   1.657   8.154
  297   HH21  ARG  44          HH21      ARG  44  -7.113  -1.217   6.516
  298   HH22  ARG  44          HH22      ARG  44  -7.081  -0.288   7.986
  299    H    PHE  45           H        PHE  45  -1.657   1.985   1.919
  300    HA   PHE  45           HA       PHE  45  -0.733   2.149   4.749
  301    HB2  PHE  45           HB2      PHE  45   0.805   3.362   2.465
  302    HB3  PHE  45           HB3      PHE  45   1.375   3.000   4.079
  303    HD1  PHE  45           HD1      PHE  45   0.784   0.197   4.573
  304    HD2  PHE  45           HD2      PHE  45   1.775   2.106   0.826
  305    HE1  PHE  45           HE1      PHE  45   1.425  -1.995   3.593
  306    HE2  PHE  45           HE2      PHE  45   2.401  -0.058  -0.082
  307    HZ   PHE  45           HZ       PHE  45   2.305  -2.099   1.266
  308    H    ARG  46           H        ARG  46  -0.075   4.590   5.169
  309    HA   ARG  46           HA       ARG  46  -2.389   6.225   4.219
  310    HB2  ARG  46           HB2      ARG  46  -1.754   7.646   6.302
  311    HB3  ARG  46           HB3      ARG  46  -2.725   6.197   6.424
  312    HG2  ARG  46           HG2      ARG  46  -1.134   6.379   8.258
  313    HG3  ARG  46           HG3      ARG  46  -0.928   4.907   7.330
  314    HD2  ARG  46           HD2      ARG  46   1.244   5.755   7.925
  315    HD3  ARG  46           HD3      ARG  46   1.065   5.939   6.198
  316    HE   ARG  46           HE       ARG  46   0.965   8.263   6.398
  317   HH11  ARG  46          HH11      ARG  46   1.419   6.744   9.670
  318   HH12  ARG  46          HH12      ARG  46   1.802   8.293  10.354
  319   HH21  ARG  46          HH21      ARG  46   1.297  10.255   7.542
  320   HH22  ARG  46          HH22      ARG  46   1.807  10.198   9.202
  321    H    THR  47           H        THR  47   1.097   6.066   3.981
  322    HA   THR  47           HA       THR  47   0.958   8.280   2.247
  323    HB   THR  47           HB       THR  47   1.130   9.443   4.478
  324    HG1  THR  47           HG1      THR  47   1.915  10.650   2.853
  325   HG21  THR  47          HG21      THR  47   3.992   8.471   4.559
  326   HG22  THR  47          HG22      THR  47   2.753   7.566   5.387
  327   HG23  THR  47          HG23      THR  47   3.074   9.268   5.834
  328    H    ILE  48           H        ILE  48   2.988   8.592   1.122
  329    HA   ILE  48           HA       ILE  48   4.273   6.160   0.573
  330    HB   ILE  48           HB       ILE  48   4.017   7.609  -1.215
  331   HG12  ILE  48          HG12      ILE  48   6.973   7.686  -0.509
  332   HG13  ILE  48          HG13      ILE  48   6.125   6.284  -1.092
  333   HG21  ILE  48          HG21      ILE  48   5.596   9.757   0.255
  334   HG22  ILE  48          HG22      ILE  48   4.952   9.886  -1.388
  335   HG23  ILE  48          HG23      ILE  48   3.842   9.798  -0.035
  336   HD11  ILE  48          HD11      ILE  48   6.577   8.878  -2.596
  337   HD12  ILE  48          HD12      ILE  48   7.183   7.266  -2.995
  338   HD13  ILE  48          HD13      ILE  48   5.451   7.612  -3.149
  339    H    ASP  49           H        ASP  49   4.998   8.909   2.631
  340    HA   ASP  49           HA       ASP  49   7.762   8.461   3.016
  341    HB2  ASP  49           HB2      ASP  49   5.828   9.728   4.966
  342    HB3  ASP  49           HB3      ASP  49   7.583   9.876   4.973
  343    H    GLU  50           H        GLU  50   4.921   6.936   4.543
  344    HA   GLU  50           HA       GLU  50   6.524   5.581   6.557
  345    HB2  GLU  50           HB2      GLU  50   4.030   6.349   6.778
  346    HB3  GLU  50           HB3      GLU  50   3.638   4.996   5.758
  347    HG2  GLU  50           HG2      GLU  50   3.323   4.315   8.017
  348    HG3  GLU  50           HG3      GLU  50   4.761   3.472   7.439
  349    H    CYS  51           H        CYS  51   4.733   4.804   3.518
  350    HA   CYS  51           HA       CYS  51   5.271   2.074   3.654
  351    HB2  CYS  51           HB2      CYS  51   4.335   1.884   1.514
  352    HB3  CYS  51           HB3      CYS  51   3.578   3.365   2.184
  353    H    ASN  52           H        ASN  52   7.164   4.680   2.163
  354    HA   ASN  52           HA       ASN  52   8.976   2.801   1.000
  355    HB2  ASN  52           HB2      ASN  52   9.988   4.497  -0.077
  356    HB3  ASN  52           HB3      ASN  52   8.444   5.262   0.239
  357   HD21  ASN  52          HD21      ASN  52   8.400   6.996   1.591
  358   HD22  ASN  52          HD22      ASN  52   9.805   7.813   2.226
  359    H    ARG  53           H        ARG  53   9.262   5.046   3.818
  360    HA   ARG  53           HA       ARG  53  11.725   4.039   4.629
  361    HB2  ARG  53           HB2      ARG  53  11.526   5.181   6.595
  362    HB3  ARG  53           HB3      ARG  53  10.386   6.034   5.556
  363    HG2  ARG  53           HG2      ARG  53   8.535   4.693   6.625
  364    HG3  ARG  53           HG3      ARG  53   9.709   4.031   7.757
  365    HD2  ARG  53           HD2      ARG  53   9.037   6.983   7.398
  366    HD3  ARG  53           HD3      ARG  53   8.448   5.941   8.708
  367    HE   ARG  53           HE       ARG  53  11.191   5.695   8.842
  368   HH11  ARG  53          HH11      ARG  53   8.849   8.284   9.328
  369   HH12  ARG  53          HH12      ARG  53   9.938   9.339  10.175
  370   HH21  ARG  53          HH21      ARG  53  12.719   7.159   9.692
  371   HH22  ARG  53          HH22      ARG  53  12.206   8.627  10.479
  372    H    THR  54           H        THR  54   8.642   2.369   5.025
  373    HA   THR  54           HA       THR  54   9.947   0.388   6.757
  374    HB   THR  54           HB       THR  54   7.743   1.457   7.255
  375    HG1  THR  54           HG1      THR  54   7.883  -1.352   7.155
  376   HG21  THR  54          HG21      THR  54   6.846   0.858   4.833
  377   HG22  THR  54          HG22      THR  54   5.765   0.787   6.231
  378   HG23  THR  54          HG23      THR  54   6.485  -0.700   5.570
  379    H    CYS  55           H        CYS  55   9.380   0.579   3.309
  380    HA   CYS  55           HA       CYS  55   9.981  -2.326   3.143
  381    HB2  CYS  55           HB2      CYS  55   7.887  -1.029   1.384
  382    HB3  CYS  55           HB3      CYS  55   8.314  -2.746   1.498
  383    H    VAL  56           H        VAL  56  10.369   0.854   1.801
  384    HA   VAL  56           HA       VAL  56  11.579  -0.154  -0.727
  385    HB   VAL  56           HB       VAL  56  11.151   2.629   0.371
  386   HG11  VAL  56          HG11      VAL  56  11.899   3.493  -1.829
  387   HG12  VAL  56          HG12      VAL  56  13.198   2.841  -0.834
  388   HG13  VAL  56          HG13      VAL  56  12.566   1.878  -2.181
  389   HG21  VAL  56          HG21      VAL  56   9.148   1.469  -0.596
  390   HG22  VAL  56          HG22      VAL  56   9.646   2.836  -1.583
  391   HG23  VAL  56          HG23      VAL  56  10.063   1.196  -2.090
  392    H    GLY  57           H        GLY  57  13.034  -1.498   0.261
  393    HA2  GLY  57           HA2      GLY  57  15.099  -0.480   2.094
  394    HA3  GLY  57           HA3      GLY  57  14.932  -2.145   1.468
  Start of MODEL   12
    1    H1   ARG   1           H        ARG   1  12.783  -5.007   1.850
    2    HA   ARG   1           HA       ARG   1  10.655  -4.297   2.758
    3    HB2  ARG   1           HB2      ARG   1   9.203  -4.820   0.804
    4    HB3  ARG   1           HB3      ARG   1  10.696  -4.012   0.489
    5    HG2  ARG   1           HG2      ARG   1  10.824  -6.975   0.089
    6    HG3  ARG   1           HG3      ARG   1   9.762  -6.068  -0.962
    7    HD2  ARG   1           HD2      ARG   1  11.650  -5.917  -2.222
    8    HD3  ARG   1           HD3      ARG   1  11.748  -4.437  -1.348
    9    HE   ARG   1           HE       ARG   1  13.661  -5.178  -0.228
   10   HH11  ARG   1          HH11      ARG   1  12.173  -7.850  -2.025
   11   HH12  ARG   1          HH12      ARG   1  13.615  -8.816  -2.089
   12   HH21  ARG   1          HH21      ARG   1  15.619  -6.466  -0.287
   13   HH22  ARG   1          HH22      ARG   1  15.608  -7.955  -1.184
   14    HA   PRO   2           HA       PRO   2   8.975  -7.637   5.152
   15    HB2  PRO   2           HB2      PRO   2   6.802  -6.317   6.230
   16    HB3  PRO   2           HB3      PRO   2   8.480  -6.071   6.798
   17    HG2  PRO   2           HG2      PRO   2   6.923  -4.427   4.837
   18    HG3  PRO   2           HG3      PRO   2   7.906  -3.841   6.218
   19    HD2  PRO   2           HD2      PRO   2   8.959  -3.835   3.735
   20    HD3  PRO   2           HD3      PRO   2   9.946  -4.345   5.125
   21    H    ARG   3           H        ARG   3   7.302  -9.129   5.022
   22    HA   ARG   3           HA       ARG   3   6.040  -9.408   2.544
   23    HB2  ARG   3           HB2      ARG   3   4.949 -11.383   3.443
   24    HB3  ARG   3           HB3      ARG   3   6.628 -11.294   3.949
   25    HG2  ARG   3           HG2      ARG   3   5.607 -11.988   5.886
   26    HG3  ARG   3           HG3      ARG   3   5.713 -10.254   6.160
   27    HD2  ARG   3           HD2      ARG   3   3.597 -10.774   6.922
   28    HD3  ARG   3           HD3      ARG   3   3.237 -10.177   5.320
   29    HE   ARG   3           HE       ARG   3   2.750 -12.353   4.553
   30   HH11  ARG   3          HH11      ARG   3   3.794 -12.492   7.986
   31   HH12  ARG   3          HH12      ARG   3   2.880 -13.923   8.287
   32   HH21  ARG   3          HH21      ARG   3   1.656 -14.173   4.970
   33   HH22  ARG   3          HH22      ARG   3   1.598 -14.951   6.524
   34    H    PHE   4           H        PHE   4   4.819  -7.636   5.344
   35    HA   PHE   4           HA       PHE   4   2.072  -7.992   4.595
   36    HB2  PHE   4           HB2      PHE   4   1.532  -6.539   6.303
   37    HB3  PHE   4           HB3      PHE   4   2.951  -7.355   6.888
   38    HD1  PHE   4           HD2      PHE   4   1.649  -4.197   5.402
   39    HD2  PHE   4           HD1      PHE   4   4.946  -6.073   7.438
   40    HE1  PHE   4           HE2      PHE   4   2.666  -1.981   5.757
   41    HE2  PHE   4           HE1      PHE   4   6.029  -3.850   7.702
   42    HZ   PHE   4           HZ       PHE   4   4.897  -1.804   6.875
   43    H    CYS   5           H        CYS   5   4.608  -5.778   3.376
   44    HA   CYS   5           HA       CYS   5   2.504  -4.009   2.373
   45    HB2  CYS   5           HB2      CYS   5   4.322  -2.666   1.469
   46    HB3  CYS   5           HB3      CYS   5   4.295  -2.889   3.220
   47    H    GLU   6           H        GLU   6   3.852  -6.874   1.282
   48    HA   GLU   6           HA       GLU   6   3.469  -6.152  -1.607
   49    HB2  GLU   6           HB2      GLU   6   4.747  -8.231  -2.035
   50    HB3  GLU   6           HB3      GLU   6   5.619  -7.049  -1.044
   51    HG2  GLU   6           HG2      GLU   6   5.132  -8.248   0.981
   52    HG3  GLU   6           HG3      GLU   6   4.083  -9.402   0.142
   53    H    LEU   7           H        LEU   7   1.311  -6.748   0.495
   54    HA   LEU   7           HA       LEU   7   0.158  -9.316  -0.443
   55    HB2  LEU   7           HB2      LEU   7  -0.964  -7.291   1.514
   56    HB3  LEU   7           HB3      LEU   7  -1.562  -8.932   1.222
   57    HG   LEU   7           HG       LEU   7   1.091  -8.165   2.473
   58   HD11  LEU   7          HD11      LEU   7  -0.877  -7.875   3.925
   59   HD12  LEU   7          HD12      LEU   7   0.162  -9.188   4.498
   60   HD13  LEU   7          HD13      LEU   7  -1.340  -9.571   3.642
   61   HD21  LEU   7          HD21      LEU   7   1.408 -10.251   1.251
   62   HD22  LEU   7          HD22      LEU   7  -0.027 -10.952   2.058
   63   HD23  LEU   7          HD23      LEU   7   1.432 -10.525   2.989
   64    H    ALA   8           H        ALA   8  -2.484  -9.008  -0.738
   65    HA   ALA   8           HA       ALA   8  -2.686  -7.086  -3.006
   66    HB1  ALA   8           HB1      ALA   8  -3.092  -9.254  -3.732
   67    HB2  ALA   8           HB2      ALA   8  -4.165  -9.614  -2.354
   68    HB3  ALA   8           HB3      ALA   8  -4.665  -8.439  -3.605
   69    HA   PRO   9           HA       PRO   9  -5.280  -4.975   0.082
   70    HB2  PRO   9           HB2      PRO   9  -5.138  -2.449  -0.825
   71    HB3  PRO   9           HB3      PRO   9  -3.725  -3.246  -0.128
   72    HG2  PRO   9           HG2      PRO   9  -4.448  -2.994  -3.078
   73    HG3  PRO   9           HG3      PRO   9  -2.890  -2.599  -2.291
   74    HD2  PRO   9           HD2      PRO   9  -3.366  -4.996  -3.505
   75    HD3  PRO   9           HD3      PRO   9  -2.263  -4.786  -2.119
   76    H    SER  10           H        SER  10  -6.872  -6.573  -1.260
   77    HA   SER  10           HA       SER  10  -8.494  -5.799  -3.359
   78    HB2  SER  10           HB2      SER  10  -8.532  -8.043  -2.356
   79    HB3  SER  10           HB3      SER  10  -9.327  -7.414  -0.911
   80    HG   SER  10           HG       SER  10 -10.316  -8.089  -3.363
   81    H    ALA  11           H        ALA  11  -9.290  -3.774  -3.484
   82    HA   ALA  11           HA       ALA  11 -10.626  -2.547  -1.187
   83    HB1  ALA  11           HB1      ALA  11 -10.096  -1.530  -4.011
   84    HB2  ALA  11           HB2      ALA  11 -10.767  -0.566  -2.686
   85    HB3  ALA  11           HB3      ALA  11  -9.109  -1.212  -2.570
   86    H    GLY  12           H        GLY  12 -11.575  -4.764  -3.492
   87    HA2  GLY  12           HA2      GLY  12 -14.244  -3.633  -4.052
   88    HA3  GLY  12           HA3      GLY  12 -13.560  -5.133  -4.692
   89    H    SER  13           H        SER  13 -12.895  -5.401  -1.526
   90    HA   SER  13           HA       SER  13 -14.959  -7.331  -1.042
   91    HB2  SER  13           HB2      SER  13 -12.942  -5.977   0.762
   92    HB3  SER  13           HB3      SER  13 -13.913  -7.380   1.237
   93    HG   SER  13           HG       SER  13 -12.202  -7.428  -1.057
   94    H    CYS  14           H        CYS  14 -14.460  -3.966   0.112
   95    HA   CYS  14           HA       CYS  14 -17.238  -3.915   1.187
   96    HB2  CYS  14           HB2      CYS  14 -14.729  -2.611   2.306
   97    HB3  CYS  14           HB3      CYS  14 -16.370  -2.421   2.922
   98    H    PHE  15           H        PHE  15 -18.146  -1.581   1.158
   99    HA   PHE  15           HA       PHE  15 -16.969  -0.227  -1.248
  100    HB2  PHE  15           HB2      PHE  15 -19.218  -0.901  -1.696
  101    HB3  PHE  15           HB3      PHE  15 -19.787  -0.199  -0.176
  102    HD1  PHE  15           HD2      PHE  15 -17.401   1.275  -2.734
  103    HD2  PHE  15           HD1      PHE  15 -21.245   1.584  -0.794
  104    HE1  PHE  15           HE2      PHE  15 -17.782   3.426  -3.839
  105    HE2  PHE  15           HE1      PHE  15 -21.663   3.692  -1.964
  106    HZ   PHE  15           HZ       PHE  15 -19.932   4.629  -3.523
  107    H    ALA  16           H        ALA  16 -15.575   1.138  -0.554
  108    HA   ALA  16           HA       ALA  16 -16.347   3.453   0.998
  109    HB1  ALA  16           HB1      ALA  16 -14.223   1.463   1.835
  110    HB2  ALA  16           HB2      ALA  16 -14.033   3.190   2.188
  111    HB3  ALA  16           HB3      ALA  16 -15.422   2.285   2.823
  112    H    PHE  17           H        PHE  17 -14.877   5.198   0.390
  113    HA   PHE  17           HA       PHE  17 -13.118   4.631  -1.961
  114    HB2  PHE  17           HB2      PHE  17 -15.215   5.365  -2.845
  115    HB3  PHE  17           HB3      PHE  17 -15.353   6.653  -1.651
  116    HD1  PHE  17           HD2      PHE  17 -12.582   5.661  -4.017
  117    HD2  PHE  17           HD1      PHE  17 -15.316   8.737  -2.731
  118    HE1  PHE  17           HE2      PHE  17 -11.444   7.279  -5.496
  119    HE2  PHE  17           HE1      PHE  17 -14.260  10.319  -4.301
  120    HZ   PHE  17           HZ       PHE  17 -12.336   9.604  -5.690
  121    H    VAL  18           H        VAL  18 -11.169   4.868  -0.828
  122    HA   VAL  18           HA       VAL  18 -10.629   7.585   0.079
  123    HB   VAL  18           HB       VAL  18  -9.312   6.533   2.007
  124   HG11  VAL  18          HG11      VAL  18 -12.352   6.481   2.230
  125   HG12  VAL  18          HG12      VAL  18 -11.184   6.775   3.530
  126   HG13  VAL  18          HG13      VAL  18 -11.378   7.958   2.203
  127   HG21  VAL  18          HG21      VAL  18  -9.609   4.133   1.396
  128   HG22  VAL  18          HG22      VAL  18 -10.255   4.499   3.012
  129   HG23  VAL  18          HG23      VAL  18 -11.357   4.292   1.645
  130    HA   PRO  19           HA       PRO  19  -7.347   6.236  -2.661
  131    HB2  PRO  19           HB2      PRO  19  -5.712   8.440  -2.620
  132    HB3  PRO  19           HB3      PRO  19  -7.238   8.357  -3.560
  133    HG2  PRO  19           HG2      PRO  19  -6.808   9.588  -0.828
  134    HG3  PRO  19           HG3      PRO  19  -7.655  10.288  -2.238
  135    HD2  PRO  19           HD2      PRO  19  -9.010   9.026  -0.231
  136    HD3  PRO  19           HD3      PRO  19  -9.521   8.854  -1.943
  137    H    SER  20           H        SER  20  -5.656   4.993  -2.063
  138    HA   SER  20           HA       SER  20  -4.252   5.529   0.515
  139    HB2  SER  20           HB2      SER  20  -5.934   3.745   0.712
  140    HB3  SER  20           HB3      SER  20  -5.098   2.875  -0.603
  141    HG   SER  20           HG       SER  20  -3.867   3.616   1.851
  142    H    TYR  21           H        TYR  21  -2.270   3.682   0.349
  143    HA   TYR  21           HA       TYR  21  -0.816   4.504  -2.155
  144    HB2  TYR  21           HB2      TYR  21   0.013   4.622   0.690
  145    HB3  TYR  21           HB3      TYR  21   1.204   4.072  -0.484
  146    HD1  TYR  21           HD2      TYR  21   2.049   5.664  -2.313
  147    HD2  TYR  21           HD1      TYR  21  -0.845   6.870   0.684
  148    HE1  TYR  21           HE2      TYR  21   2.305   8.012  -2.983
  149    HE2  TYR  21           HE1      TYR  21  -0.510   9.205   0.079
  150    HH   TYR  21           HH       TYR  21   0.562  10.696  -1.385
  151    H    TYR  22           H        TYR  22   0.087   3.016  -3.273
  152    HA   TYR  22           HA       TYR  22  -0.149   0.192  -2.412
  153    HB2  TYR  22           HB2      TYR  22  -1.264   1.219  -4.564
  154    HB3  TYR  22           HB3      TYR  22   0.336   1.155  -5.249
  155    HD1  TYR  22           HD1      TYR  22   1.624  -1.200  -4.876
  156    HD2  TYR  22           HD2      TYR  22  -2.648  -0.659  -4.789
  157    HE1  TYR  22           HE1      TYR  22   1.360  -3.583  -4.978
  158    HE2  TYR  22           HE2      TYR  22  -2.954  -3.089  -5.067
  159    HH   TYR  22           HH       TYR  22  -0.166  -5.350  -4.845
  160    H    TYR  23           H        TYR  23   1.695  -0.874  -2.026
  161    HA   TYR  23           HA       TYR  23   4.290   0.471  -2.592
  162    HB2  TYR  23           HB2      TYR  23   3.972  -0.413  -0.373
  163    HB3  TYR  23           HB3      TYR  23   3.541  -1.985  -1.017
  164    HD1  TYR  23           HD1      TYR  23   6.400   0.477  -1.501
  165    HD2  TYR  23           HD2      TYR  23   5.188  -3.618  -0.866
  166    HE1  TYR  23           HE1      TYR  23   8.742  -0.248  -1.672
  167    HE2  TYR  23           HE2      TYR  23   7.535  -4.322  -0.865
  168    HH   TYR  23           HH       TYR  23  10.252  -2.064  -1.462
  169    H    ASN  24           H        ASN  24   5.665  -0.057  -4.266
  170    HA   ASN  24           HA       ASN  24   5.206  -2.624  -5.711
  171    HB2  ASN  24           HB2      ASN  24   5.487   0.147  -6.834
  172    HB3  ASN  24           HB3      ASN  24   6.232  -1.203  -7.685
  173   HD21  ASN  24          HD21      ASN  24   4.925  -1.886  -9.375
  174   HD22  ASN  24          HD22      ASN  24   3.210  -2.166  -9.191
  175    H    GLN  25           H        GLN  25   6.738  -3.637  -4.489
  176    HA   GLN  25           HA       GLN  25   9.386  -2.820  -4.025
  177    HB2  GLN  25           HB2      GLN  25   9.881  -5.098  -3.520
  178    HB3  GLN  25           HB3      GLN  25   8.312  -4.730  -2.866
  179    HG2  GLN  25           HG2      GLN  25   8.865  -6.410  -5.316
  180    HG3  GLN  25           HG3      GLN  25   8.424  -6.975  -3.721
  181   HE21  GLN  25          HE21      GLN  25   6.113  -4.816  -3.360
  182   HE22  GLN  25          HE22      GLN  25   4.997  -5.373  -4.581
  183    H    TYR  26           H        TYR  26   7.879  -4.253  -6.904
  184    HA   TYR  26           HA       TYR  26  10.140  -5.083  -8.300
  185    HB2  TYR  26           HB2      TYR  26   7.639  -3.728  -9.381
  186    HB3  TYR  26           HB3      TYR  26   8.760  -4.706 -10.310
  187    HD1  TYR  26           HD2      TYR  26   9.249  -7.148  -8.983
  188    HD2  TYR  26           HD1      TYR  26   5.605  -4.807  -8.951
  189    HE1  TYR  26           HE2      TYR  26   7.925  -9.204  -8.599
  190    HE2  TYR  26           HE1      TYR  26   4.295  -6.860  -8.539
  191    HH   TYR  26           HH       TYR  26   4.353  -9.138  -8.270
  192    H    SER  27           H        SER  27   8.902  -1.816  -7.761
  193    HA   SER  27           HA       SER  27  11.166  -0.752  -9.418
  194    HB2  SER  27           HB2      SER  27   8.807  -0.366 -10.254
  195    HB3  SER  27           HB3      SER  27   8.571   0.683  -8.842
  196    HG   SER  27           HG       SER  27  10.601   0.919 -10.834
  197    H    ASN  28           H        ASN  28  10.594  -1.412  -6.329
  198    HA   ASN  28           HA       ASN  28  11.188  -0.607  -4.325
  199    HB2  ASN  28           HB2      ASN  28  13.392  -0.957  -5.389
  200    HB3  ASN  28           HB3      ASN  28  13.322   0.615  -6.157
  201   HD21  ASN  28          HD21      ASN  28  13.339  -0.748  -2.788
  202   HD22  ASN  28          HD22      ASN  28  14.539   0.422  -2.253
  203    H    THR  29           H        THR  29   8.993   0.742  -5.176
  204    HA   THR  29           HA       THR  29   9.342   3.305  -3.882
  205    HB   THR  29           HB       THR  29   9.916   3.717  -6.314
  206    HG1  THR  29           HG1      THR  29   8.303   5.530  -6.379
  207   HG21  THR  29          HG21      THR  29   8.207   2.195  -7.323
  208   HG22  THR  29          HG22      THR  29   8.159   3.840  -7.964
  209   HG23  THR  29          HG23      THR  29   6.932   3.316  -6.802
  210    H    CYS  30           H        CYS  30   6.962   4.411  -4.216
  211    HA   CYS  30           HA       CYS  30   4.832   2.430  -3.760
  212    HB2  CYS  30           HB2      CYS  30   6.048   3.542  -1.609
  213    HB3  CYS  30           HB3      CYS  30   4.977   4.879  -2.040
  214    H    HIS  31           H        HIS  31   2.772   3.365  -4.397
  215    HA   HIS  31           HA       HIS  31   2.849   6.079  -5.575
  216    HB2  HIS  31           HB2      HIS  31   3.481   4.116  -7.178
  217    HB3  HIS  31           HB3      HIS  31   1.776   3.673  -7.082
  218    HD1  HIS  31           HD1      HIS  31   0.981   4.362  -9.502
  219    HD2  HIS  31           HD2      HIS  31   3.437   7.156  -7.519
  220    HE1  HIS  31           HE1      HIS  31   1.131   6.354 -11.034
  221    H    SER  32           H        SER  32   0.808   7.084  -5.566
  222    HA   SER  32           HA       SER  32  -1.059   5.997  -3.671
  223    HB2  SER  32           HB2      SER  32  -2.424   7.899  -4.175
  224    HB3  SER  32           HB3      SER  32  -0.745   8.382  -3.912
  225    HG   SER  32           HG       SER  32  -0.534   8.406  -6.268
  226    H    PHE  33           H        PHE  33  -3.037   4.966  -3.947
  227    HA   PHE  33           HA       PHE  33  -4.091   4.495  -6.636
  228    HB2  PHE  33           HB2      PHE  33  -4.041   2.215  -6.681
  229    HB3  PHE  33           HB3      PHE  33  -2.479   2.562  -5.968
  230    HD1  PHE  33           HD2      PHE  33  -2.555   2.699  -3.261
  231    HD2  PHE  33           HD1      PHE  33  -5.306   0.503  -5.759
  232    HE1  PHE  33           HE2      PHE  33  -3.230   1.342  -1.324
  233    HE2  PHE  33           HE1      PHE  33  -5.982  -0.855  -3.792
  234    HZ   PHE  33           HZ       PHE  33  -5.018  -0.350  -1.565
  235    H    THR  34           H        THR  34  -6.333   2.962  -6.034
  236    HA   THR  34           HA       THR  34  -7.762   4.699  -4.055
  237    HB   THR  34           HB       THR  34  -9.777   3.727  -5.326
  238    HG1  THR  34           HG1      THR  34  -9.516   2.763  -7.092
  239   HG21  THR  34          HG21      THR  34  -9.044   6.070  -5.550
  240   HG22  THR  34          HG22      THR  34  -9.622   5.428  -7.093
  241   HG23  THR  34          HG23      THR  34  -7.878   5.603  -6.803
  242    H    TYR  35           H        TYR  35  -8.561   3.799  -2.161
  243    HA   TYR  35           HA       TYR  35  -8.628   0.874  -2.091
  244    HB2  TYR  35           HB2      TYR  35  -6.657   1.614  -1.029
  245    HB3  TYR  35           HB3      TYR  35  -7.596   2.594   0.093
  246    HD1  TYR  35           HD1      TYR  35  -6.811  -1.064  -0.785
  247    HD2  TYR  35           HD2      TYR  35  -8.469   1.724   2.020
  248    HE1  TYR  35           HE1      TYR  35  -6.802  -2.797   0.913
  249    HE2  TYR  35           HE2      TYR  35  -8.668  -0.126   3.710
  250    HH   TYR  35           HH       TYR  35  -7.299  -3.369   3.296
  251    H    SER  36           H        SER  36  -9.908   0.143  -0.049
  252    HA   SER  36           HA       SER  36 -12.379   1.754   0.287
  253    HB2  SER  36           HB2      SER  36 -12.727  -0.152  -1.105
  254    HB3  SER  36           HB3      SER  36 -11.871  -1.228   0.019
  255    HG   SER  36           HG       SER  36 -14.288  -1.132  -0.082
  256    H    GLY  37           H        GLY  37 -12.602  -0.755   2.376
  257    HA2  GLY  37           HA2      GLY  37 -10.961   0.533   4.539
  258    HA3  GLY  37           HA3      GLY  37 -12.680   0.231   4.742
  259    H    CYS  38           H        CYS  38 -13.352  -2.139   4.359
  260    HA   CYS  38           HA       CYS  38 -11.431  -3.880   5.765
  261    HB2  CYS  38           HB2      CYS  38 -13.508  -5.362   5.900
  262    HB3  CYS  38           HB3      CYS  38 -13.400  -3.912   6.870
  263    H    GLY  39           H        GLY  39 -11.547  -6.258   5.126
  264    HA2  GLY  39           HA2      GLY  39 -11.454  -7.961   3.540
  265    HA3  GLY  39           HA3      GLY  39 -11.811  -6.798   2.258
  266    H    GLY  40           H        GLY  40 -10.127  -5.152   1.798
  267    HA2  GLY  40           HA2      GLY  40  -7.888  -6.266   0.740
  268    HA3  GLY  40           HA3      GLY  40  -8.019  -4.554   1.172
  269    H    ASN  41           H        ASN  41  -5.908  -6.857   1.291
  270    HA   ASN  41           HA       ASN  41  -5.165  -7.283   3.990
  271    HB2  ASN  41           HB2      ASN  41  -3.549  -7.331   1.420
  272    HB3  ASN  41           HB3      ASN  41  -3.008  -7.995   2.941
  273   HD21  ASN  41          HD21      ASN  41  -5.700  -9.235   3.754
  274   HD22  ASN  41          HD22      ASN  41  -5.761 -10.613   2.704
  275    H    ALA  42           H        ALA  42  -2.928  -6.813   4.743
  276    HA   ALA  42           HA       ALA  42  -2.633  -4.213   5.553
  277    HB1  ALA  42           HB1      ALA  42  -0.464  -6.319   5.410
  278    HB2  ALA  42           HB2      ALA  42  -0.538  -4.938   6.523
  279    HB3  ALA  42           HB3      ALA  42  -1.739  -6.234   6.658
  280    H    ASN  43           H        ASN  43  -1.916  -5.050   2.389
  281    HA   ASN  43           HA       ASN  43   0.508  -3.571   1.918
  282    HB2  ASN  43           HB2      ASN  43  -0.358  -5.223   0.364
  283    HB3  ASN  43           HB3      ASN  43  -1.803  -4.288   0.086
  284   HD21  ASN  43          HD21      ASN  43  -0.631  -1.648  -0.568
  285   HD22  ASN  43          HD22      ASN  43  -0.011  -2.068  -2.188
  286    H    ARG  44           H        ARG  44  -2.610  -2.562   2.911
  287    HA   ARG  44           HA       ARG  44  -2.687  -0.010   1.700
  288    HB2  ARG  44           HB2      ARG  44  -4.572  -1.274   3.049
  289    HB3  ARG  44           HB3      ARG  44  -3.718  -0.780   4.508
  290    HG2  ARG  44           HG2      ARG  44  -4.008   1.645   3.235
  291    HG3  ARG  44           HG3      ARG  44  -5.414   0.775   2.648
  292    HD2  ARG  44           HD2      ARG  44  -5.576   0.458   5.388
  293    HD3  ARG  44           HD3      ARG  44  -4.897   2.097   5.130
  294    HE   ARG  44           HE       ARG  44  -6.977   1.586   3.285
  295   HH11  ARG  44          HH11      ARG  44  -6.603   2.316   6.781
  296   HH12  ARG  44          HH12      ARG  44  -8.234   2.870   6.966
  297   HH21  ARG  44          HH21      ARG  44  -9.338   2.426   3.685
  298   HH22  ARG  44          HH22      ARG  44  -9.587   3.119   5.238
  299    H    PHE  45           H        PHE  45  -1.905   1.906   2.165
  300    HA   PHE  45           HA       PHE  45  -0.452   2.441   4.673
  301    HB2  PHE  45           HB2      PHE  45   0.557   2.770   1.824
  302    HB3  PHE  45           HB3      PHE  45   1.183   3.764   3.137
  303    HD1  PHE  45           HD1      PHE  45   1.869   2.363   5.359
  304    HD2  PHE  45           HD2      PHE  45   1.785   0.850   1.307
  305    HE1  PHE  45           HE1      PHE  45   3.528   0.657   5.961
  306    HE2  PHE  45           HE2      PHE  45   3.521  -0.781   1.894
  307    HZ   PHE  45           HZ       PHE  45   4.417  -0.895   4.221
  308    H    ARG  46           H        ARG  46  -0.100   4.784   4.865
  309    HA   ARG  46           HA       ARG  46  -2.429   6.336   3.817
  310    HB2  ARG  46           HB2      ARG  46  -1.947   7.778   5.938
  311    HB3  ARG  46           HB3      ARG  46  -2.900   6.317   6.005
  312    HG2  ARG  46           HG2      ARG  46  -1.402   6.525   7.913
  313    HG3  ARG  46           HG3      ARG  46  -1.128   5.046   7.006
  314    HD2  ARG  46           HD2      ARG  46   0.970   5.956   7.756
  315    HD3  ARG  46           HD3      ARG  46   0.916   6.065   6.007
  316    HE   ARG  46           HE       ARG  46   0.733   8.406   6.103
  317   HH11  ARG  46          HH11      ARG  46   1.048   7.015   9.447
  318   HH12  ARG  46          HH12      ARG  46   1.395   8.567  10.096
  319   HH21  ARG  46          HH21      ARG  46   0.994  10.458   7.164
  320   HH22  ARG  46          HH22      ARG  46   1.466  10.458   8.827
  321    H    THR  47           H        THR  47   1.052   6.202   3.712
  322    HA   THR  47           HA       THR  47   1.044   8.471   2.008
  323    HB   THR  47           HB       THR  47   1.110   9.551   4.283
  324    HG1  THR  47           HG1      THR  47   1.883  10.654   2.571
  325   HG21  THR  47          HG21      THR  47   3.081   9.395   5.648
  326   HG22  THR  47          HG22      THR  47   3.935   8.473   4.409
  327   HG23  THR  47          HG23      THR  47   2.639   7.704   5.277
  328    H    ILE  48           H        ILE  48   3.031   8.703   0.901
  329    HA   ILE  48           HA       ILE  48   4.356   6.221   0.396
  330    HB   ILE  48           HB       ILE  48   4.100   7.765  -1.377
  331   HG12  ILE  48          HG12      ILE  48   7.051   7.726  -0.603
  332   HG13  ILE  48          HG13      ILE  48   6.158   6.392  -1.292
  333   HG21  ILE  48          HG21      ILE  48   5.708   9.861   0.144
  334   HG22  ILE  48          HG22      ILE  48   5.034  10.022  -1.486
  335   HG23  ILE  48          HG23      ILE  48   3.948   9.921  -0.130
  336   HD11  ILE  48          HD11      ILE  48   7.310   7.478  -3.111
  337   HD12  ILE  48          HD12      ILE  48   5.569   7.759  -3.291
  338   HD13  ILE  48          HD13      ILE  48   6.632   9.043  -2.677
  339    H    ASP  49           H        ASP  49   4.974   8.989   2.555
  340    HA   ASP  49           HA       ASP  49   7.733   8.551   3.001
  341    HB2  ASP  49           HB2      ASP  49   6.564  10.592   3.624
  342    HB3  ASP  49           HB3      ASP  49   5.668   9.727   4.872
  343    H    GLU  50           H        GLU  50   4.869   7.034   4.503
  344    HA   GLU  50           HA       GLU  50   6.474   5.607   6.462
  345    HB2  GLU  50           HB2      GLU  50   3.530   5.654   5.678
  346    HB3  GLU  50           HB3      GLU  50   4.172   4.484   6.817
  347    HG2  GLU  50           HG2      GLU  50   4.391   7.511   7.157
  348    HG3  GLU  50           HG3      GLU  50   3.218   6.476   7.963
  349    H    CYS  51           H        CYS  51   4.818   5.006   3.376
  350    HA   CYS  51           HA       CYS  51   5.156   2.196   3.339
  351    HB2  CYS  51           HB2      CYS  51   3.565   3.374   1.906
  352    HB3  CYS  51           HB3      CYS  51   4.891   4.283   1.155
  353    H    ASN  52           H        ASN  52   7.174   4.877   2.076
  354    HA   ASN  52           HA       ASN  52   9.052   3.073   0.931
  355    HB2  ASN  52           HB2      ASN  52  10.207   4.842   0.086
  356    HB3  ASN  52           HB3      ASN  52   8.581   5.475   0.183
  357   HD21  ASN  52          HD21      ASN  52   8.389   7.436   1.095
  358   HD22  ASN  52          HD22      ASN  52   9.662   8.279   1.964
  359    H    ARG  53           H        ARG  53   9.223   5.165   3.839
  360    HA   ARG  53           HA       ARG  53  11.663   4.137   4.670
  361    HB2  ARG  53           HB2      ARG  53  11.336   5.083   6.769
  362    HB3  ARG  53           HB3      ARG  53  10.281   6.043   5.704
  363    HG2  ARG  53           HG2      ARG  53   8.395   4.504   6.432
  364    HG3  ARG  53           HG3      ARG  53   9.475   3.859   7.675
  365    HD2  ARG  53           HD2      ARG  53   8.519   6.729   7.356
  366    HD3  ARG  53           HD3      ARG  53   8.027   5.546   8.588
  367    HE   ARG  53           HE       ARG  53  10.845   5.866   8.689
  368   HH11  ARG  53          HH11      ARG  53   7.780   7.447   9.594
  369   HH12  ARG  53          HH12      ARG  53   8.551   8.504  10.750
  370   HH21  ARG  53          HH21      ARG  53  11.831   7.262  10.136
  371   HH22  ARG  53          HH22      ARG  53  10.887   8.257  11.216
  372    H    THR  54           H        THR  54   8.591   2.408   4.977
  373    HA   THR  54           HA       THR  54   9.878   0.415   6.723
  374    HB   THR  54           HB       THR  54   7.637   1.434   7.158
  375    HG1  THR  54           HG1      THR  54   8.191  -1.298   7.110
  376   HG21  THR  54          HG21      THR  54   5.723   0.782   6.075
  377   HG22  THR  54          HG22      THR  54   6.490  -0.647   5.308
  378   HG23  THR  54          HG23      THR  54   6.806   0.995   4.711
  379    H    CYS  55           H        CYS  55   9.407   0.760   3.271
  380    HA   CYS  55           HA       CYS  55  10.119  -2.117   3.018
  381    HB2  CYS  55           HB2      CYS  55   7.976  -0.799   1.321
  382    HB3  CYS  55           HB3      CYS  55   8.540  -2.473   1.264
  383    H    VAL  56           H        VAL  56  10.331   1.110   1.615
  384    HA   VAL  56           HA       VAL  56  11.587   0.182  -0.847
  385    HB   VAL  56           HB       VAL  56  11.269   2.894   0.401
  386   HG11  VAL  56          HG11      VAL  56  12.636   2.332  -2.237
  387   HG12  VAL  56          HG12      VAL  56  12.128   3.916  -1.641
  388   HG13  VAL  56          HG13      VAL  56  13.399   3.024  -0.785
  389   HG21  VAL  56          HG21      VAL  56  10.243   1.582  -2.165
  390   HG22  VAL  56          HG22      VAL  56   9.282   1.765  -0.691
  391   HG23  VAL  56          HG23      VAL  56   9.807   3.191  -1.593
  392    H    GLY  57           H        GLY  57  13.320  -0.918  -0.745
  393    HA2  GLY  57           HA2      GLY  57  15.225  -0.980   1.329
  394    HA3  GLY  57           HA3      GLY  57  15.388  -1.721  -0.280
  Start of MODEL   13
    1    H1   ARG   1           H        ARG   1  12.959  -6.044   4.020
    2    HA   ARG   1           HA       ARG   1  11.195  -4.452   3.502
    3    HB2  ARG   1           HB2      ARG   1   9.936  -4.688   1.422
    4    HB3  ARG   1           HB3      ARG   1  11.624  -4.189   1.266
    5    HG2  ARG   1           HG2      ARG   1  11.868  -6.916   0.788
    6    HG3  ARG   1           HG3      ARG   1  10.252  -6.591   0.211
    7    HD2  ARG   1           HD2      ARG   1  11.392  -6.072  -1.669
    8    HD3  ARG   1           HD3      ARG   1  11.402  -4.491  -0.948
    9    HE   ARG   1           HE       ARG   1  13.700  -5.059  -0.012
   10   HH11  ARG   1          HH11      ARG   1  12.507  -6.434  -3.060
   11   HH12  ARG   1          HH12      ARG   1  14.036  -6.228  -3.874
   12   HH21  ARG   1          HH21      ARG   1  15.796  -5.355  -0.982
   13   HH22  ARG   1          HH22      ARG   1  15.883  -5.663  -2.709
   14    HA   PRO   2           HA       PRO   2   8.968  -7.783   5.519
   15    HB2  PRO   2           HB2      PRO   2   6.750  -6.399   6.312
   16    HB3  PRO   2           HB3      PRO   2   8.341  -6.207   7.105
   17    HG2  PRO   2           HG2      PRO   2   7.091  -4.549   4.944
   18    HG3  PRO   2           HG3      PRO   2   7.864  -3.924   6.425
   19    HD2  PRO   2           HD2      PRO   2   9.261  -3.949   4.127
   20    HD3  PRO   2           HD3      PRO   2  10.040  -4.465   5.649
   21    H    ARG   3           H        ARG   3   7.488  -9.308   4.914
   22    HA   ARG   3           HA       ARG   3   6.331  -9.091   2.355
   23    HB2  ARG   3           HB2      ARG   3   5.694 -11.271   2.475
   24    HB3  ARG   3           HB3      ARG   3   7.144 -11.181   3.445
   25    HG2  ARG   3           HG2      ARG   3   4.266 -11.486   4.363
   26    HG3  ARG   3           HG3      ARG   3   5.590 -12.634   4.531
   27    HD2  ARG   3           HD2      ARG   3   5.402  -9.972   5.993
   28    HD3  ARG   3           HD3      ARG   3   5.023 -11.558   6.675
   29    HE   ARG   3           HE       ARG   3   7.538 -11.944   5.693
   30   HH11  ARG   3          HH11      ARG   3   6.189  -9.743   8.153
   31   HH12  ARG   3          HH12      ARG   3   7.588  -9.843   9.139
   32   HH21  ARG   3          HH21      ARG   3   9.324 -11.977   6.848
   33   HH22  ARG   3          HH22      ARG   3   9.499 -11.181   8.374
   34    H    PHE   4           H        PHE   4   5.095  -7.573   5.099
   35    HA   PHE   4           HA       PHE   4   2.265  -8.148   4.532
   36    HB2  PHE   4           HB2      PHE   4   1.697  -6.704   6.233
   37    HB3  PHE   4           HB3      PHE   4   3.100  -7.548   6.847
   38    HD1  PHE   4           HD2      PHE   4   1.925  -4.344   5.270
   39    HD2  PHE   4           HD1      PHE   4   4.925  -6.262   7.703
   40    HE1  PHE   4           HE2      PHE   4   2.919  -2.137   5.766
   41    HE2  PHE   4           HE1      PHE   4   5.945  -4.040   8.180
   42    HZ   PHE   4           HZ       PHE   4   4.965  -1.974   7.194
   43    H    CYS   5           H        CYS   5   4.743  -5.853   3.395
   44    HA   CYS   5           HA       CYS   5   2.604  -4.058   2.430
   45    HB2  CYS   5           HB2      CYS   5   4.490  -2.772   1.469
   46    HB3  CYS   5           HB3      CYS   5   4.404  -2.925   3.237
   47    H    GLU   6           H        GLU   6   4.071  -6.937   1.230
   48    HA   GLU   6           HA       GLU   6   3.543  -6.106  -1.585
   49    HB2  GLU   6           HB2      GLU   6   4.802  -8.140  -2.150
   50    HB3  GLU   6           HB3      GLU   6   5.695  -7.077  -1.049
   51    HG2  GLU   6           HG2      GLU   6   5.063  -8.451   0.856
   52    HG3  GLU   6           HG3      GLU   6   4.133  -9.538  -0.164
   53    H    LEU   7           H        LEU   7   1.314  -6.553   0.327
   54    HA   LEU   7           HA       LEU   7   0.127  -9.119  -0.603
   55    HB2  LEU   7           HB2      LEU   7  -0.954  -7.039   1.325
   56    HB3  LEU   7           HB3      LEU   7  -1.693  -8.609   0.960
   57    HG   LEU   7           HG       LEU   7   0.938  -8.107   2.379
   58   HD11  LEU   7          HD11      LEU   7  -0.168  -9.104   4.297
   59   HD12  LEU   7          HD12      LEU   7  -1.612  -9.478   3.330
   60   HD13  LEU   7          HD13      LEU   7  -1.182  -7.790   3.680
   61   HD21  LEU   7          HD21      LEU   7   1.103 -10.494   2.756
   62   HD22  LEU   7          HD22      LEU   7   1.285 -10.093   1.063
   63   HD23  LEU   7          HD23      LEU   7  -0.262 -10.775   1.658
   64    H    ALA   8           H        ALA   8  -2.235  -8.991  -1.229
   65    HA   ALA   8           HA       ALA   8  -2.502  -6.951  -3.376
   66    HB1  ALA   8           HB1      ALA   8  -4.157  -8.439  -4.315
   67    HB2  ALA   8           HB2      ALA   8  -2.577  -9.236  -4.157
   68    HB3  ALA   8           HB3      ALA   8  -3.891  -9.599  -2.994
   69    HA   PRO   9           HA       PRO   9  -5.420  -5.482  -0.168
   70    HB2  PRO   9           HB2      PRO   9  -5.817  -2.951  -1.095
   71    HB3  PRO   9           HB3      PRO   9  -4.312  -3.437  -0.263
   72    HG2  PRO   9           HG2      PRO   9  -4.822  -3.279  -3.248
   73    HG3  PRO   9           HG3      PRO   9  -3.465  -2.598  -2.340
   74    HD2  PRO   9           HD2      PRO   9  -3.292  -4.995  -3.604
   75    HD3  PRO   9           HD3      PRO   9  -2.468  -4.711  -2.038
   76    H    SER  10           H        SER  10  -7.266  -6.743  -0.595
   77    HA   SER  10           HA       SER  10  -8.701  -6.507  -3.049
   78    HB2  SER  10           HB2      SER  10  -8.642  -8.582  -1.518
   79    HB3  SER  10           HB3      SER  10  -9.886  -7.752  -0.579
   80    HG   SER  10           HG       SER  10  -9.964  -8.786  -3.200
   81    H    ALA  11           H        ALA  11  -8.931  -4.238  -3.114
   82    HA   ALA  11           HA       ALA  11 -10.509  -2.731  -1.219
   83    HB1  ALA  11           HB1      ALA  11  -8.785  -1.698  -2.674
   84    HB2  ALA  11           HB2      ALA  11  -9.732  -2.142  -4.115
   85    HB3  ALA  11           HB3      ALA  11 -10.380  -0.964  -2.958
   86    H    GLY  12           H        GLY  12 -11.445  -5.136  -3.334
   87    HA2  GLY  12           HA2      GLY  12 -13.957  -3.941  -4.277
   88    HA3  GLY  12           HA3      GLY  12 -13.329  -5.557  -4.611
   89    H    SER  13           H        SER  13 -13.013  -5.302  -1.350
   90    HA   SER  13           HA       SER  13 -14.947  -7.157  -0.637
   91    HB2  SER  13           HB2      SER  13 -12.931  -6.480   0.654
   92    HB3  SER  13           HB3      SER  13 -13.686  -4.927   1.010
   93    HG   SER  13           HG       SER  13 -14.680  -7.478   1.829
   94    H    CYS  14           H        CYS  14 -15.178  -3.557  -0.419
   95    HA   CYS  14           HA       CYS  14 -18.127  -3.710  -0.383
   96    HB2  CYS  14           HB2      CYS  14 -16.557  -1.936   1.483
   97    HB3  CYS  14           HB3      CYS  14 -18.258  -2.335   1.569
   98    H    PHE  15           H        PHE  15 -19.037  -1.568  -0.925
   99    HA   PHE  15           HA       PHE  15 -17.232  -0.074  -2.774
  100    HB2  PHE  15           HB2      PHE  15 -19.332  -0.881  -3.676
  101    HB3  PHE  15           HB3      PHE  15 -20.240  -0.051  -2.454
  102    HD1  PHE  15           HD1      PHE  15 -19.478   2.767  -2.385
  103    HD2  PHE  15           HD2      PHE  15 -19.560   0.075  -5.777
  104    HE1  PHE  15           HE1      PHE  15 -19.466   4.650  -3.878
  105    HE2  PHE  15           HE2      PHE  15 -19.816   2.003  -7.261
  106    HZ   PHE  15           HZ       PHE  15 -19.705   4.310  -6.349
  107    H    ALA  16           H        ALA  16 -16.122   1.440  -1.762
  108    HA   ALA  16           HA       ALA  16 -17.404   3.549  -0.244
  109    HB1  ALA  16           HB1      ALA  16 -15.182   1.831   0.929
  110    HB2  ALA  16           HB2      ALA  16 -15.764   3.356   1.632
  111    HB3  ALA  16           HB3      ALA  16 -16.838   1.947   1.554
  112    H    PHE  17           H        PHE  17 -15.531   5.260   0.097
  113    HA   PHE  17           HA       PHE  17 -13.460   4.988  -2.039
  114    HB2  PHE  17           HB2      PHE  17 -15.554   6.331  -2.640
  115    HB3  PHE  17           HB3      PHE  17 -14.924   7.602  -1.631
  116    HD1  PHE  17           HD2      PHE  17 -11.950   7.370  -2.325
  117    HD2  PHE  17           HD1      PHE  17 -15.465   7.256  -4.806
  118    HE1  PHE  17           HE2      PHE  17 -10.617   8.198  -4.231
  119    HE2  PHE  17           HE1      PHE  17 -14.131   8.128  -6.701
  120    HZ   PHE  17           HZ       PHE  17 -11.703   8.589  -6.415
  121    H    VAL  18           H        VAL  18 -11.662   4.701  -0.697
  122    HA   VAL  18           HA       VAL  18 -10.899   7.061   0.908
  123    HB   VAL  18           HB       VAL  18  -9.929   5.421   2.599
  124   HG11  VAL  18          HG11      VAL  18 -11.961   5.544   3.950
  125   HG12  VAL  18          HG12      VAL  18 -11.735   7.035   3.019
  126   HG13  VAL  18          HG13      VAL  18 -12.939   5.832   2.497
  127   HG21  VAL  18          HG21      VAL  18 -10.428   3.276   1.523
  128   HG22  VAL  18          HG22      VAL  18 -11.310   3.414   3.061
  129   HG23  VAL  18          HG23      VAL  18 -12.166   3.660   1.523
  130    HA   PRO  19           HA       PRO  19  -7.804   5.820  -2.175
  131    HB2  PRO  19           HB2      PRO  19  -6.453   8.201  -2.374
  132    HB3  PRO  19           HB3      PRO  19  -7.952   7.839  -3.265
  133    HG2  PRO  19           HG2      PRO  19  -7.656   9.349  -0.665
  134    HG3  PRO  19           HG3      PRO  19  -8.617   9.800  -2.095
  135    HD2  PRO  19           HD2      PRO  19  -9.726   8.601   0.071
  136    HD3  PRO  19           HD3      PRO  19 -10.269   8.204  -1.597
  137    H    SER  20           H        SER  20  -6.170   4.634  -1.429
  138    HA   SER  20           HA       SER  20  -4.712   5.602   0.990
  139    HB2  SER  20           HB2      SER  20  -5.429   2.735   0.379
  140    HB3  SER  20           HB3      SER  20  -4.573   3.360   1.794
  141    HG   SER  20           HG       SER  20  -7.200   4.173   1.041
  142    H    TYR  21           H        TYR  21  -2.479   3.894   0.970
  143    HA   TYR  21           HA       TYR  21  -1.345   4.366  -1.758
  144    HB2  TYR  21           HB2      TYR  21  -0.113   4.675   0.951
  145    HB3  TYR  21           HB3      TYR  21   0.799   4.211  -0.480
  146    HD1  TYR  21           HD1      TYR  21  -1.530   6.928   0.627
  147    HD2  TYR  21           HD2      TYR  21   1.993   5.838  -1.637
  148    HE1  TYR  21           HE1      TYR  21  -1.123   9.305   0.088
  149    HE2  TYR  21           HE2      TYR  21   2.317   8.177  -2.275
  150    HH   TYR  21           HH       TYR  21   1.537  10.334  -2.083
  151    H    TYR  22           H        TYR  22  -0.183   2.902  -2.681
  152    HA   TYR  22           HA       TYR  22  -0.263   0.092  -1.758
  153    HB2  TYR  22           HB2      TYR  22  -1.367   1.107  -3.971
  154    HB3  TYR  22           HB3      TYR  22   0.270   1.120  -4.573
  155    HD1  TYR  22           HD1      TYR  22   1.516  -1.233  -4.720
  156    HD2  TYR  22           HD2      TYR  22  -2.734  -0.744  -4.176
  157    HE1  TYR  22           HE1      TYR  22   1.212  -3.594  -5.226
  158    HE2  TYR  22           HE2      TYR  22  -3.088  -3.035  -4.957
  159    HH   TYR  22           HH       TYR  22  -2.150  -4.992  -5.581
  160    H    TYR  23           H        TYR  23   1.631  -1.129  -2.489
  161    HA   TYR  23           HA       TYR  23   4.233   0.386  -2.510
  162    HB2  TYR  23           HB2      TYR  23   3.927  -0.631  -0.338
  163    HB3  TYR  23           HB3      TYR  23   3.438  -2.147  -1.069
  164    HD1  TYR  23           HD1      TYR  23   6.418   0.186  -1.413
  165    HD2  TYR  23           HD2      TYR  23   5.014  -3.862  -1.026
  166    HE1  TYR  23           HE1      TYR  23   8.740  -0.606  -1.410
  167    HE2  TYR  23           HE2      TYR  23   7.345  -4.652  -0.841
  168    HH   TYR  23           HH       TYR  23  10.111  -2.617  -0.701
  169    H    ASN  24           H        ASN  24   5.433  -0.021  -4.351
  170    HA   ASN  24           HA       ASN  24   4.840  -2.503  -5.890
  171    HB2  ASN  24           HB2      ASN  24   5.865   0.131  -6.964
  172    HB3  ASN  24           HB3      ASN  24   5.599  -1.342  -7.882
  173   HD21  ASN  24          HD21      ASN  24   4.393   1.540  -7.933
  174   HD22  ASN  24          HD22      ASN  24   2.681   1.290  -7.934
  175    H    GLN  25           H        GLN  25   6.390  -3.666  -4.614
  176    HA   GLN  25           HA       GLN  25   9.022  -2.807  -4.120
  177    HB2  GLN  25           HB2      GLN  25   9.562  -4.939  -3.423
  178    HB3  GLN  25           HB3      GLN  25   7.870  -4.762  -3.018
  179    HG2  GLN  25           HG2      GLN  25   8.962  -6.399  -5.292
  180    HG3  GLN  25           HG3      GLN  25   8.430  -6.999  -3.744
  181   HE21  GLN  25          HE21      GLN  25   5.870  -5.190  -3.673
  182   HE22  GLN  25          HE22      GLN  25   4.888  -5.895  -4.936
  183    H    TYR  26           H        TYR  26   7.579  -4.313  -6.983
  184    HA   TYR  26           HA       TYR  26   9.840  -5.056  -8.405
  185    HB2  TYR  26           HB2      TYR  26   7.427  -3.660  -9.580
  186    HB3  TYR  26           HB3      TYR  26   8.489  -4.777 -10.406
  187    HD1  TYR  26           HD2      TYR  26   8.527  -7.240  -9.471
  188    HD2  TYR  26           HD1      TYR  26   5.391  -4.397  -8.678
  189    HE1  TYR  26           HE2      TYR  26   6.958  -9.104  -9.063
  190    HE2  TYR  26           HE1      TYR  26   3.847  -6.229  -8.152
  191    HH   TYR  26           HH       TYR  26   4.787  -9.694  -8.531
  192    H    SER  27           H        SER  27   8.381  -1.867  -7.981
  193    HA   SER  27           HA       SER  27  10.442  -0.572  -9.670
  194    HB2  SER  27           HB2      SER  27   8.047  -0.238 -10.226
  195    HB3  SER  27           HB3      SER  27   7.786   0.464  -8.637
  196    HG   SER  27           HG       SER  27   9.632   1.926  -9.407
  197    H    ASN  28           H        ASN  28  10.292  -1.478  -6.546
  198    HA   ASN  28           HA       ASN  28  10.915  -0.744  -4.548
  199    HB2  ASN  28           HB2      ASN  28  13.074  -1.118  -5.650
  200    HB3  ASN  28           HB3      ASN  28  13.009   0.441  -6.427
  201   HD21  ASN  28          HD21      ASN  28  13.210  -0.924  -3.030
  202   HD22  ASN  28          HD22      ASN  28  14.416   0.297  -2.592
  203    H    THR  29           H        THR  29   8.733   0.600  -5.050
  204    HA   THR  29           HA       THR  29   9.163   3.138  -3.763
  205    HB   THR  29           HB       THR  29   9.586   3.689  -6.184
  206    HG1  THR  29           HG1      THR  29   8.835   5.270  -4.823
  207   HG21  THR  29          HG21      THR  29   7.974   2.112  -7.220
  208   HG22  THR  29          HG22      THR  29   7.731   3.789  -7.738
  209   HG23  THR  29          HG23      THR  29   6.625   3.071  -6.570
  210    H    CYS  30           H        CYS  30   6.752   4.246  -3.999
  211    HA   CYS  30           HA       CYS  30   4.631   2.260  -3.498
  212    HB2  CYS  30           HB2      CYS  30   5.055   4.656  -1.701
  213    HB3  CYS  30           HB3      CYS  30   4.013   3.279  -1.444
  214    H    HIS  31           H        HIS  31   2.479   3.342  -3.825
  215    HA   HIS  31           HA       HIS  31   2.541   6.076  -4.882
  216    HB2  HIS  31           HB2      HIS  31   3.187   4.360  -6.750
  217    HB3  HIS  31           HB3      HIS  31   1.530   3.784  -6.589
  218    HD1  HIS  31           HD1      HIS  31   0.117   4.917  -8.539
  219    HD2  HIS  31           HD2      HIS  31   3.189   7.273  -6.872
  220    HE1  HIS  31           HE1      HIS  31   0.073   7.117  -9.816
  221    H    SER  32           H        SER  32   0.273   6.926  -5.127
  222    HA   SER  32           HA       SER  32  -1.450   5.739  -3.179
  223    HB2  SER  32           HB2      SER  32  -3.004   7.518  -3.979
  224    HB3  SER  32           HB3      SER  32  -1.446   8.036  -3.297
  225    HG   SER  32           HG       SER  32  -1.867   9.177  -5.157
  226    H    PHE  33           H        PHE  33  -3.485   4.747  -3.474
  227    HA   PHE  33           HA       PHE  33  -4.370   3.960  -6.142
  228    HB2  PHE  33           HB2      PHE  33  -4.323   1.686  -5.872
  229    HB3  PHE  33           HB3      PHE  33  -2.766   2.169  -5.236
  230    HD1  PHE  33           HD2      PHE  33  -2.777   2.554  -2.577
  231    HD2  PHE  33           HD1      PHE  33  -5.538   0.063  -4.705
  232    HE1  PHE  33           HE2      PHE  33  -3.398   1.374  -0.440
  233    HE2  PHE  33           HE1      PHE  33  -6.084  -1.134  -2.650
  234    HZ   PHE  33           HZ       PHE  33  -4.965  -0.493  -0.478
  235    H    THR  34           H        THR  34  -6.536   2.457  -5.526
  236    HA   THR  34           HA       THR  34  -8.123   4.233  -3.701
  237    HB   THR  34           HB       THR  34 -10.083   3.465  -5.024
  238    HG1  THR  34           HG1      THR  34  -9.345   2.814  -7.264
  239   HG21  THR  34          HG21      THR  34  -8.979   5.673  -5.427
  240   HG22  THR  34          HG22      THR  34  -9.759   5.011  -6.863
  241   HG23  THR  34          HG23      THR  34  -8.002   4.919  -6.694
  242    H    TYR  35           H        TYR  35  -8.943   3.388  -1.864
  243    HA   TYR  35           HA       TYR  35  -9.024   0.449  -1.680
  244    HB2  TYR  35           HB2      TYR  35  -7.094   1.551  -0.489
  245    HB3  TYR  35           HB3      TYR  35  -8.277   2.287   0.564
  246    HD1  TYR  35           HD1      TYR  35  -7.091  -1.151  -0.586
  247    HD2  TYR  35           HD2      TYR  35  -8.816   1.227   2.588
  248    HE1  TYR  35           HE1      TYR  35  -6.459  -2.856   1.054
  249    HE2  TYR  35           HE2      TYR  35  -8.383  -0.635   4.173
  250    HH   TYR  35           HH       TYR  35  -6.034  -3.172   3.424
  251    H    SER  36           H        SER  36 -10.681  -0.208   0.140
  252    HA   SER  36           HA       SER  36 -12.937   1.726   0.213
  253    HB2  SER  36           HB2      SER  36 -14.286  -0.439   0.519
  254    HB3  SER  36           HB3      SER  36 -13.643  -0.036  -1.071
  255    HG   SER  36           HG       SER  36 -12.839  -1.875  -1.030
  256    H    GLY  37           H        GLY  37 -10.610   0.320   2.274
  257    HA2  GLY  37           HA2      GLY  37 -10.318   0.623   4.551
  258    HA3  GLY  37           HA3      GLY  37 -11.896   1.405   4.644
  259    H    CYS  38           H        CYS  38 -13.628  -0.325   3.883
  260    HA   CYS  38           HA       CYS  38 -14.285  -2.034   5.952
  261    HB2  CYS  38           HB2      CYS  38 -15.738  -0.952   4.268
  262    HB3  CYS  38           HB3      CYS  38 -15.062  -1.994   3.020
  263    H    GLY  39           H        GLY  39 -11.966  -2.785   3.460
  264    HA2  GLY  39           HA2      GLY  39 -11.778  -5.524   4.392
  265    HA3  GLY  39           HA3      GLY  39 -12.272  -5.353   2.698
  266    H    GLY  40           H        GLY  40 -10.329  -6.317   1.978
  267    HA2  GLY  40           HA2      GLY  40  -8.393  -5.966   0.868
  268    HA3  GLY  40           HA3      GLY  40  -8.164  -4.397   1.641
  269    H    ASN  41           H        ASN  41  -5.916  -5.309   1.611
  270    HA   ASN  41           HA       ASN  41  -5.339  -6.903   4.063
  271    HB2  ASN  41           HB2      ASN  41  -4.114  -7.187   1.282
  272    HB3  ASN  41           HB3      ASN  41  -3.317  -7.765   2.727
  273   HD21  ASN  41          HD21      ASN  41  -4.445  -9.347   4.137
  274   HD22  ASN  41          HD22      ASN  41  -5.591 -10.446   3.399
  275    H    ALA  42           H        ALA  42  -2.984  -6.699   4.657
  276    HA   ALA  42           HA       ALA  42  -2.412  -4.195   5.562
  277    HB1  ALA  42           HB1      ALA  42  -1.604  -6.396   6.437
  278    HB2  ALA  42           HB2      ALA  42  -0.369  -6.390   5.165
  279    HB3  ALA  42           HB3      ALA  42  -0.380  -5.118   6.386
  280    H    ASN  43           H        ASN  43  -1.753  -5.117   2.287
  281    HA   ASN  43           HA       ASN  43   0.648  -3.632   1.819
  282    HB2  ASN  43           HB2      ASN  43  -0.073  -5.135   0.183
  283    HB3  ASN  43           HB3      ASN  43  -1.697  -4.469   0.094
  284   HD21  ASN  43          HD21      ASN  43  -1.880  -2.203  -0.984
  285   HD22  ASN  43          HD22      ASN  43  -0.791  -2.168  -2.381
  286    H    ARG  44           H        ARG  44  -2.527  -2.518   2.683
  287    HA   ARG  44           HA       ARG  44  -2.439   0.034   1.379
  288    HB2  ARG  44           HB2      ARG  44  -4.481  -1.145   2.389
  289    HB3  ARG  44           HB3      ARG  44  -3.802  -0.841   3.990
  290    HG2  ARG  44           HG2      ARG  44  -3.774   1.708   3.016
  291    HG3  ARG  44           HG3      ARG  44  -5.097   1.040   2.069
  292    HD2  ARG  44           HD2      ARG  44  -6.299   0.461   4.132
  293    HD3  ARG  44           HD3      ARG  44  -4.938   0.909   5.117
  294    HE   ARG  44           HE       ARG  44  -6.553   2.759   3.444
  295   HH11  ARG  44          HH11      ARG  44  -4.221   2.408   6.147
  296   HH12  ARG  44          HH12      ARG  44  -4.266   4.087   6.548
  297   HH21  ARG  44          HH21      ARG  44  -6.441   4.893   3.802
  298   HH22  ARG  44          HH22      ARG  44  -5.400   5.594   4.981
  299    H    PHE  45           H        PHE  45  -1.523   1.852   1.995
  300    HA   PHE  45           HA       PHE  45  -0.286   2.288   4.656
  301    HB2  PHE  45           HB2      PHE  45   0.812   2.738   1.843
  302    HB3  PHE  45           HB3      PHE  45   1.367   3.713   3.190
  303    HD1  PHE  45           HD1      PHE  45   2.439   2.637   5.204
  304    HD2  PHE  45           HD2      PHE  45   1.699   0.544   1.498
  305    HE1  PHE  45           HE1      PHE  45   4.071   0.927   5.851
  306    HE2  PHE  45           HE2      PHE  45   3.399  -1.095   2.089
  307    HZ   PHE  45           HZ       PHE  45   4.633  -0.939   4.276
  308    H    ARG  46           H        ARG  46   0.111   4.689   4.844
  309    HA   ARG  46           HA       ARG  46  -2.198   6.247   3.777
  310    HB2  ARG  46           HB2      ARG  46  -1.703   7.682   5.898
  311    HB3  ARG  46           HB3      ARG  46  -2.681   6.244   5.955
  312    HG2  ARG  46           HG2      ARG  46  -1.203   6.421   7.870
  313    HG3  ARG  46           HG3      ARG  46  -0.971   4.938   6.977
  314    HD2  ARG  46           HD2      ARG  46   1.147   5.770   7.739
  315    HD3  ARG  46           HD3      ARG  46   1.110   5.856   5.989
  316    HE   ARG  46           HE       ARG  46   0.958   8.224   6.057
  317   HH11  ARG  46          HH11      ARG  46   1.381   6.849   9.401
  318   HH12  ARG  46          HH12      ARG  46   2.039   8.339   9.943
  319   HH21  ARG  46          HH21      ARG  46   1.485  10.219   7.063
  320   HH22  ARG  46          HH22      ARG  46   2.034  10.211   8.712
  321    H    THR  47           H        THR  47   1.249   6.027   3.664
  322    HA   THR  47           HA       THR  47   1.367   8.276   1.933
  323    HB   THR  47           HB       THR  47   1.444   9.458   4.164
  324    HG1  THR  47           HG1      THR  47   2.497  10.696   2.798
  325   HG21  THR  47          HG21      THR  47   2.836   7.500   5.232
  326   HG22  THR  47          HG22      THR  47   3.331   9.177   5.620
  327   HG23  THR  47          HG23      THR  47   4.191   8.212   4.423
  328    H    ILE  48           H        ILE  48   3.378   8.445   0.905
  329    HA   ILE  48           HA       ILE  48   4.717   5.905   0.492
  330    HB   ILE  48           HB       ILE  48   4.345   7.252  -1.388
  331   HG12  ILE  48          HG12      ILE  48   7.291   7.493  -0.686
  332   HG13  ILE  48          HG13      ILE  48   6.521   6.016  -1.200
  333   HG21  ILE  48          HG21      ILE  48   4.107   9.512  -0.375
  334   HG22  ILE  48          HG22      ILE  48   5.853   9.548  -0.049
  335   HG23  ILE  48          HG23      ILE  48   5.235   9.551  -1.708
  336   HD11  ILE  48          HD11      ILE  48   7.552   6.895  -3.133
  337   HD12  ILE  48          HD12      ILE  48   5.831   7.246  -3.342
  338   HD13  ILE  48          HD13      ILE  48   6.945   8.528  -2.831
  339    H    ASP  49           H        ASP  49   5.210   8.752   2.512
  340    HA   ASP  49           HA       ASP  49   8.005   8.472   2.946
  341    HB2  ASP  49           HB2      ASP  49   5.943   9.535   4.886
  342    HB3  ASP  49           HB3      ASP  49   7.678   9.834   4.916
  343    H    GLU  50           H        GLU  50   5.194   6.874   4.447
  344    HA   GLU  50           HA       GLU  50   6.724   5.569   6.572
  345    HB2  GLU  50           HB2      GLU  50   3.883   5.634   5.533
  346    HB3  GLU  50           HB3      GLU  50   4.351   4.243   6.450
  347    HG2  GLU  50           HG2      GLU  50   4.790   7.070   7.487
  348    HG3  GLU  50           HG3      GLU  50   3.303   6.174   7.726
  349    H    CYS  51           H        CYS  51   5.122   4.748   3.507
  350    HA   CYS  51           HA       CYS  51   5.684   1.997   3.608
  351    HB2  CYS  51           HB2      CYS  51   3.988   2.864   2.252
  352    HB3  CYS  51           HB3      CYS  51   5.127   3.935   1.394
  353    H    ASN  52           H        ASN  52   7.489   4.659   1.969
  354    HA   ASN  52           HA       ASN  52   9.361   2.823   0.931
  355    HB2  ASN  52           HB2      ASN  52  10.368   4.543  -0.150
  356    HB3  ASN  52           HB3      ASN  52   8.805   5.263   0.098
  357   HD21  ASN  52          HD21      ASN  52   8.656   7.037   1.488
  358   HD22  ASN  52          HD22      ASN  52  10.073   7.897   2.071
  359    H    ARG  53           H        ARG  53   9.505   5.033   3.782
  360    HA   ARG  53           HA       ARG  53  12.017   4.087   4.543
  361    HB2  ARG  53           HB2      ARG  53  11.818   5.201   6.523
  362    HB3  ARG  53           HB3      ARG  53  10.662   6.066   5.488
  363    HG2  ARG  53           HG2      ARG  53   8.835   4.679   6.556
  364    HG3  ARG  53           HG3      ARG  53  10.028   4.015   7.672
  365    HD2  ARG  53           HD2      ARG  53   9.153   6.911   7.362
  366    HD3  ARG  53           HD3      ARG  53   8.804   5.850   8.729
  367    HE   ARG  53           HE       ARG  53  11.142   7.440   8.225
  368   HH11  ARG  53          HH11      ARG  53  10.360   4.229   9.658
  369   HH12  ARG  53          HH12      ARG  53  11.582   4.366  10.858
  370   HH21  ARG  53          HH21      ARG  53  12.756   7.534   9.930
  371   HH22  ARG  53          HH22      ARG  53  12.953   6.203  11.010
  372    H    THR  54           H        THR  54   8.975   2.340   4.921
  373    HA   THR  54           HA       THR  54  10.314   0.411   6.671
  374    HB   THR  54           HB       THR  54   8.122   1.418   7.242
  375    HG1  THR  54           HG1      THR  54   8.353  -1.389   7.093
  376   HG21  THR  54          HG21      THR  54   7.063   0.941   4.926
  377   HG22  THR  54          HG22      THR  54   6.125   0.613   6.378
  378   HG23  THR  54          HG23      THR  54   6.892  -0.719   5.488
  379    H    CYS  55           H        CYS  55   9.558   0.555   3.231
  380    HA   CYS  55           HA       CYS  55  10.315  -2.306   3.044
  381    HB2  CYS  55           HB2      CYS  55   8.065  -1.048   1.431
  382    HB3  CYS  55           HB3      CYS  55   8.630  -2.726   1.436
  383    H    VAL  56           H        VAL  56  10.832   0.871   1.842
  384    HA   VAL  56           HA       VAL  56  11.853  -0.149  -0.787
  385    HB   VAL  56           HB       VAL  56  11.422   2.622   0.295
  386   HG11  VAL  56          HG11      VAL  56  12.148   3.635  -1.697
  387   HG12  VAL  56          HG12      VAL  56  13.490   2.680  -1.053
  388   HG13  VAL  56          HG13      VAL  56  12.544   2.084  -2.437
  389   HG21  VAL  56          HG21      VAL  56  10.289   1.138  -2.129
  390   HG22  VAL  56          HG22      VAL  56   9.420   1.376  -0.602
  391   HG23  VAL  56          HG23      VAL  56   9.830   2.774  -1.614
  392    H    GLY  57           H        GLY  57  13.631  -1.285  -0.353
  393    HA2  GLY  57           HA2      GLY  57  15.513  -0.704   1.748
  394    HA3  GLY  57           HA3      GLY  57  15.736  -1.803   0.357
  Start of MODEL   14
    1    H1   ARG   1           H        ARG   1  12.799  -4.774   1.559
    2    HA   ARG   1           HA       ARG   1  10.772  -4.110   2.904
    3    HB2  ARG   1           HB2      ARG   1   9.258  -4.476   1.096
    4    HB3  ARG   1           HB3      ARG   1  10.830  -4.000   0.522
    5    HG2  ARG   1           HG2      ARG   1  10.581  -6.919   0.401
    6    HG3  ARG   1           HG3      ARG   1   9.290  -6.094  -0.445
    7    HD2  ARG   1           HD2      ARG   1  10.796  -6.233  -2.137
    8    HD3  ARG   1           HD3      ARG   1  11.170  -4.622  -1.529
    9    HE   ARG   1           HE       ARG   1  13.219  -5.327  -0.767
   10   HH11  ARG   1          HH11      ARG   1  11.289  -8.190  -1.733
   11   HH12  ARG   1          HH12      ARG   1  12.705  -9.172  -2.010
   12   HH21  ARG   1          HH21      ARG   1  15.019  -6.627  -1.242
   13   HH22  ARG   1          HH22      ARG   1  14.864  -8.320  -1.610
   14    HA   PRO   2           HA       PRO   2   9.083  -7.575   5.269
   15    HB2  PRO   2           HB2      PRO   2   6.986  -6.334   6.444
   16    HB3  PRO   2           HB3      PRO   2   8.659  -5.972   6.921
   17    HG2  PRO   2           HG2      PRO   2   6.856  -4.431   5.060
   18    HG3  PRO   2           HG3      PRO   2   7.922  -3.775   6.342
   19    HD2  PRO   2           HD2      PRO   2   8.601  -3.850   3.669
   20    HD3  PRO   2           HD3      PRO   2   9.823  -3.985   4.984
   21    H    ARG   3           H        ARG   3   7.710  -9.116   4.744
   22    HA   ARG   3           HA       ARG   3   6.301  -9.031   2.352
   23    HB2  ARG   3           HB2      ARG   3   5.909 -11.199   2.580
   24    HB3  ARG   3           HB3      ARG   3   7.142 -11.053   3.816
   25    HG2  ARG   3           HG2      ARG   3   4.135 -11.203   4.209
   26    HG3  ARG   3           HG3      ARG   3   5.315 -12.460   4.482
   27    HD2  ARG   3           HD2      ARG   3   5.166  -9.911   6.114
   28    HD3  ARG   3           HD3      ARG   3   4.461 -11.454   6.579
   29    HE   ARG   3           HE       ARG   3   7.179 -10.613   6.815
   30   HH11  ARG   3          HH11      ARG   3   5.184 -13.573   6.362
   31   HH12  ARG   3          HH12      ARG   3   6.350 -14.608   7.111
   32   HH21  ARG   3          HH21      ARG   3   8.714 -12.084   7.800
   33   HH22  ARG   3          HH22      ARG   3   8.265 -13.750   7.953
   34    H    PHE   4           H        PHE   4   5.057  -7.704   5.307
   35    HA   PHE   4           HA       PHE   4   2.285  -8.190   4.529
   36    HB2  PHE   4           HB2      PHE   4   1.639  -6.862   6.330
   37    HB3  PHE   4           HB3      PHE   4   3.045  -7.749   6.890
   38    HD1  PHE   4           HD2      PHE   4   1.841  -4.460   5.601
   39    HD2  PHE   4           HD1      PHE   4   4.990  -6.538   7.694
   40    HE1  PHE   4           HE2      PHE   4   2.817  -2.302   6.268
   41    HE2  PHE   4           HE1      PHE   4   6.037  -4.359   8.266
   42    HZ   PHE   4           HZ       PHE   4   4.960  -2.234   7.566
   43    H    CYS   5           H        CYS   5   4.751  -5.855   3.596
   44    HA   CYS   5           HA       CYS   5   2.956  -3.813   2.688
   45    HB2  CYS   5           HB2      CYS   5   5.312  -3.736   3.645
   46    HB3  CYS   5           HB3      CYS   5   5.889  -4.290   2.080
   47    H    GLU   6           H        GLU   6   3.993  -6.840   1.334
   48    HA   GLU   6           HA       GLU   6   3.463  -5.890  -1.451
   49    HB2  GLU   6           HB2      GLU   6   4.883  -7.566  -2.263
   50    HB3  GLU   6           HB3      GLU   6   5.682  -6.770  -0.924
   51    HG2  GLU   6           HG2      GLU   6   4.527  -8.836   0.415
   52    HG3  GLU   6           HG3      GLU   6   4.633  -9.583  -1.158
   53    H    LEU   7           H        LEU   7   1.369  -6.590   0.556
   54    HA   LEU   7           HA       LEU   7   0.242  -9.104  -0.487
   55    HB2  LEU   7           HB2      LEU   7  -0.927  -7.094   1.465
   56    HB3  LEU   7           HB3      LEU   7  -1.583  -8.690   1.059
   57    HG   LEU   7           HG       LEU   7   1.057  -8.140   2.456
   58   HD11  LEU   7          HD11      LEU   7  -1.061  -7.760   3.745
   59   HD12  LEU   7          HD12      LEU   7  -0.042  -9.038   4.421
   60   HD13  LEU   7          HD13      LEU   7  -1.489  -9.456   3.478
   61   HD21  LEU   7          HD21      LEU   7  -0.228 -10.831   1.911
   62   HD22  LEU   7          HD22      LEU   7   1.243 -10.522   2.843
   63   HD23  LEU   7          HD23      LEU   7   1.256 -10.200   1.125
   64    H    ALA   8           H        ALA   8  -2.232  -8.877  -1.047
   65    HA   ALA   8           HA       ALA   8  -2.350  -6.981  -3.339
   66    HB1  ALA   8           HB1      ALA   8  -2.578  -9.312  -3.957
   67    HB2  ALA   8           HB2      ALA   8  -3.894  -9.520  -2.767
   68    HB3  ALA   8           HB3      ALA   8  -4.117  -8.466  -4.166
   69    HA   PRO   9           HA       PRO   9  -5.208  -5.064  -0.461
   70    HB2  PRO   9           HB2      PRO   9  -5.803  -2.759  -1.782
   71    HB3  PRO   9           HB3      PRO   9  -4.267  -3.032  -0.931
   72    HG2  PRO   9           HG2      PRO   9  -4.818  -3.287  -3.899
   73    HG3  PRO   9           HG3      PRO   9  -3.412  -2.543  -3.085
   74    HD2  PRO   9           HD2      PRO   9  -3.429  -5.117  -4.102
   75    HD3  PRO   9           HD3      PRO   9  -2.405  -4.620  -2.726
   76    H    SER  10           H        SER  10  -7.127  -6.319  -0.546
   77    HA   SER  10           HA       SER  10  -8.772  -6.643  -2.886
   78    HB2  SER  10           HB2      SER  10  -8.488  -8.274  -0.931
   79    HB3  SER  10           HB3      SER  10  -9.558  -7.211  -0.016
   80    HG   SER  10           HG       SER  10 -10.169  -8.582  -2.457
   81    H    ALA  11           H        ALA  11  -8.900  -4.368  -3.414
   82    HA   ALA  11           HA       ALA  11 -10.248  -2.419  -1.778
   83    HB1  ALA  11           HB1      ALA  11  -9.670  -2.453  -4.774
   84    HB2  ALA  11           HB2      ALA  11 -10.109  -1.029  -3.810
   85    HB3  ALA  11           HB3      ALA  11  -8.566  -1.851  -3.514
   86    H    GLY  12           H        GLY  12 -11.533  -5.061  -3.491
   87    HA2  GLY  12           HA2      GLY  12 -14.061  -3.679  -4.213
   88    HA3  GLY  12           HA3      GLY  12 -13.558  -5.292  -4.685
   89    H    SER  13           H        SER  13 -13.011  -5.324  -1.348
   90    HA   SER  13           HA       SER  13 -15.106  -7.065  -0.864
   91    HB2  SER  13           HB2      SER  13 -13.760  -5.345   1.216
   92    HB3  SER  13           HB3      SER  13 -14.512  -6.934   1.450
   93    HG   SER  13           HG       SER  13 -12.415  -7.441   1.172
   94    H    CYS  14           H        CYS  14 -15.080  -3.537   0.036
   95    HA   CYS  14           HA       CYS  14 -18.041  -3.632   0.151
   96    HB2  CYS  14           HB2      CYS  14 -16.302  -2.076   2.109
   97    HB3  CYS  14           HB3      CYS  14 -18.051  -2.083   1.995
   98    H    PHE  15           H        PHE  15 -18.962  -1.597  -0.461
   99    HA   PHE  15           HA       PHE  15 -17.221  -0.180  -2.373
  100    HB2  PHE  15           HB2      PHE  15 -19.524  -0.986  -2.929
  101    HB3  PHE  15           HB3      PHE  15 -20.165   0.126  -1.736
  102    HD1  PHE  15           HD1      PHE  15 -19.330   2.764  -2.118
  103    HD2  PHE  15           HD2      PHE  15 -19.523  -0.328  -5.141
  104    HE1  PHE  15           HE1      PHE  15 -19.319   4.463  -3.868
  105    HE2  PHE  15           HE2      PHE  15 -19.703   1.413  -6.888
  106    HZ   PHE  15           HZ       PHE  15 -19.575   3.810  -6.260
  107    H    ALA  16           H        ALA  16 -15.962   1.291  -1.493
  108    HA   ALA  16           HA       ALA  16 -16.997   3.530   0.039
  109    HB1  ALA  16           HB1      ALA  16 -16.296   2.327   1.941
  110    HB2  ALA  16           HB2      ALA  16 -15.009   1.481   1.068
  111    HB3  ALA  16           HB3      ALA  16 -14.828   3.193   1.487
  112    H    PHE  17           H        PHE  17 -15.300   5.236  -0.018
  113    HA   PHE  17           HA       PHE  17 -13.291   4.832  -2.171
  114    HB2  PHE  17           HB2      PHE  17 -15.515   5.909  -2.812
  115    HB3  PHE  17           HB3      PHE  17 -15.038   7.297  -1.860
  116    HD1  PHE  17           HD2      PHE  17 -12.077   5.983  -3.533
  117    HD2  PHE  17           HD1      PHE  17 -15.744   8.173  -4.205
  118    HE1  PHE  17           HE2      PHE  17 -11.156   6.878  -5.586
  119    HE2  PHE  17           HE1      PHE  17 -14.797   9.086  -6.291
  120    HZ   PHE  17           HZ       PHE  17 -12.489   8.476  -6.995
  121    H    VAL  18           H        VAL  18 -11.455   4.767  -0.856
  122    HA   VAL  18           HA       VAL  18 -10.806   7.299   0.522
  123    HB   VAL  18           HB       VAL  18  -9.715   5.881   2.347
  124   HG11  VAL  18          HG11      VAL  18 -11.720   5.944   3.715
  125   HG12  VAL  18          HG12      VAL  18 -11.677   7.371   2.677
  126   HG13  VAL  18          HG13      VAL  18 -12.755   6.019   2.280
  127   HG21  VAL  18          HG21      VAL  18 -11.829   3.868   1.451
  128   HG22  VAL  18          HG22      VAL  18 -10.074   3.619   1.377
  129   HG23  VAL  18          HG23      VAL  18 -10.874   3.786   2.949
  130    HA   PRO  19           HA       PRO  19  -7.433   6.218  -2.274
  131    HB2  PRO  19           HB2      PRO  19  -5.975   8.569  -2.093
  132    HB3  PRO  19           HB3      PRO  19  -7.347   8.306  -3.193
  133    HG2  PRO  19           HG2      PRO  19  -7.288   9.744  -0.556
  134    HG3  PRO  19           HG3      PRO  19  -8.241  10.120  -2.017
  135    HD2  PRO  19           HD2      PRO  19  -9.251   8.826   0.235
  136    HD3  PRO  19           HD3      PRO  19  -9.943   8.636  -1.397
  137    H    SER  20           H        SER  20  -5.867   4.876  -1.520
  138    HA   SER  20           HA       SER  20  -4.356   5.654   0.925
  139    HB2  SER  20           HB2      SER  20  -5.278   2.944   0.120
  140    HB3  SER  20           HB3      SER  20  -4.314   3.328   1.573
  141    HG   SER  20           HG       SER  20  -6.820   4.528   1.036
  142    H    TYR  21           H        TYR  21  -2.271   3.752   0.800
  143    HA   TYR  21           HA       TYR  21  -1.030   4.390  -1.852
  144    HB2  TYR  21           HB2      TYR  21   0.044   4.538   0.900
  145    HB3  TYR  21           HB3      TYR  21   1.118   3.955  -0.361
  146    HD1  TYR  21           HD1      TYR  21  -0.979   6.806   0.732
  147    HD2  TYR  21           HD2      TYR  21   2.060   5.513  -2.083
  148    HE1  TYR  21           HE1      TYR  21  -0.604   9.140   0.055
  149    HE2  TYR  21           HE2      TYR  21   2.355   7.812  -2.812
  150    HH   TYR  21           HH       TYR  21   1.832  10.047  -2.431
  151    H    TYR  22           H        TYR  22  -0.062   2.928  -2.957
  152    HA   TYR  22           HA       TYR  22  -0.254   0.069  -2.194
  153    HB2  TYR  22           HB2      TYR  22  -1.566   1.028  -4.242
  154    HB3  TYR  22           HB3      TYR  22  -0.023   1.296  -4.984
  155    HD1  TYR  22           HD1      TYR  22   1.615  -0.925  -4.934
  156    HD2  TYR  22           HD2      TYR  22  -2.693  -0.865  -4.924
  157    HE1  TYR  22           HE1      TYR  22   1.646  -3.231  -5.688
  158    HE2  TYR  22           HE2      TYR  22  -2.696  -3.197  -5.835
  159    HH   TYR  22           HH       TYR  22   0.248  -4.844  -6.878
  160    H    TYR  23           H        TYR  23   1.660  -0.905  -1.987
  161    HA   TYR  23           HA       TYR  23   4.174   0.542  -2.672
  162    HB2  TYR  23           HB2      TYR  23   4.038  -0.394  -0.456
  163    HB3  TYR  23           HB3      TYR  23   3.585  -1.963  -1.124
  164    HD1  TYR  23           HD1      TYR  23   6.413   0.542  -1.316
  165    HD2  TYR  23           HD2      TYR  23   5.201  -3.601  -1.274
  166    HE1  TYR  23           HE1      TYR  23   8.765  -0.162  -1.262
  167    HE2  TYR  23           HE2      TYR  23   7.559  -4.288  -1.082
  168    HH   TYR  23           HH       TYR  23   9.798  -3.507  -0.978
  169    H    ASN  24           H        ASN  24   5.460   0.017  -4.392
  170    HA   ASN  24           HA       ASN  24   4.943  -2.584  -5.801
  171    HB2  ASN  24           HB2      ASN  24   5.769   0.051  -7.068
  172    HB3  ASN  24           HB3      ASN  24   5.801  -1.511  -7.856
  173   HD21  ASN  24          HD21      ASN  24   4.038  -1.949  -9.121
  174   HD22  ASN  24          HD22      ASN  24   2.431  -1.348  -8.851
  175    H    GLN  25           H        GLN  25   6.491  -3.790  -4.858
  176    HA   GLN  25           HA       GLN  25   9.080  -2.854  -4.136
  177    HB2  GLN  25           HB2      GLN  25   9.717  -5.051  -3.683
  178    HB3  GLN  25           HB3      GLN  25   8.076  -4.884  -3.115
  179    HG2  GLN  25           HG2      GLN  25   8.922  -6.332  -5.656
  180    HG3  GLN  25           HG3      GLN  25   8.631  -7.080  -4.106
  181   HE21  GLN  25          HE21      GLN  25   6.088  -5.065  -3.775
  182   HE22  GLN  25          HE22      GLN  25   4.954  -5.814  -4.831
  183    H    TYR  26           H        TYR  26   7.824  -4.310  -7.151
  184    HA   TYR  26           HA       TYR  26  10.236  -4.852  -8.445
  185    HB2  TYR  26           HB2      TYR  26   7.831  -3.589  -9.784
  186    HB3  TYR  26           HB3      TYR  26   8.989  -4.693 -10.496
  187    HD1  TYR  26           HD2      TYR  26   9.041  -7.132  -9.199
  188    HD2  TYR  26           HD1      TYR  26   5.710  -4.385  -9.314
  189    HE1  TYR  26           HE2      TYR  26   7.454  -9.020  -8.909
  190    HE2  TYR  26           HE1      TYR  26   4.151  -6.243  -8.993
  191    HH   TYR  26           HH       TYR  26   5.230  -9.658  -8.723
  192    H    SER  27           H        SER  27   8.474  -1.778  -8.078
  193    HA   SER  27           HA       SER  27  10.564  -0.314  -9.572
  194    HB2  SER  27           HB2      SER  27   8.156  -0.084 -10.148
  195    HB3  SER  27           HB3      SER  27   7.868   0.644  -8.557
  196    HG   SER  27           HG       SER  27   8.357   2.020 -10.546
  197    H    ASN  28           H        ASN  28  10.246  -1.329  -6.451
  198    HA   ASN  28           HA       ASN  28  10.862  -0.677  -4.446
  199    HB2  ASN  28           HB2      ASN  28  12.981  -1.002  -5.723
  200    HB3  ASN  28           HB3      ASN  28  13.009   0.715  -6.118
  201   HD21  ASN  28          HD21      ASN  28  12.939  -1.476  -3.187
  202   HD22  ASN  28          HD22      ASN  28  14.031  -0.418  -2.313
  203    H    THR  29           H        THR  29   8.705   0.835  -5.264
  204    HA   THR  29           HA       THR  29   9.084   3.215  -3.690
  205    HB   THR  29           HB       THR  29   9.788   3.908  -6.035
  206    HG1  THR  29           HG1      THR  29   8.546   5.859  -5.860
  207   HG21  THR  29          HG21      THR  29   8.068   2.662  -7.318
  208   HG22  THR  29          HG22      THR  29   8.035   4.401  -7.662
  209   HG23  THR  29          HG23      THR  29   6.800   3.700  -6.623
  210    H    CYS  30           H        CYS  30   6.778   4.523  -3.925
  211    HA   CYS  30           HA       CYS  30   4.597   2.526  -3.636
  212    HB2  CYS  30           HB2      CYS  30   5.886   3.725  -1.514
  213    HB3  CYS  30           HB3      CYS  30   4.639   4.913  -1.890
  214    H    HIS  31           H        HIS  31   2.535   3.344  -4.314
  215    HA   HIS  31           HA       HIS  31   2.467   6.114  -5.326
  216    HB2  HIS  31           HB2      HIS  31   3.142   4.295  -7.073
  217    HB3  HIS  31           HB3      HIS  31   1.479   3.723  -6.942
  218    HD1  HIS  31           HD1      HIS  31  -0.047   4.956  -8.747
  219    HD2  HIS  31           HD2      HIS  31   3.241   7.147  -7.306
  220    HE1  HIS  31           HE1      HIS  31  -0.118   7.198  -9.962
  221    H    SER  32           H        SER  32   0.302   7.046  -5.247
  222    HA   SER  32           HA       SER  32  -1.356   5.703  -3.330
  223    HB2  SER  32           HB2      SER  32  -2.882   7.641  -3.842
  224    HB3  SER  32           HB3      SER  32  -1.331   7.958  -3.061
  225    HG   SER  32           HG       SER  32  -1.765   9.416  -4.756
  226    H    PHE  33           H        PHE  33  -3.281   4.679  -3.559
  227    HA   PHE  33           HA       PHE  33  -4.455   4.306  -6.231
  228    HB2  PHE  33           HB2      PHE  33  -4.415   2.017  -6.187
  229    HB3  PHE  33           HB3      PHE  33  -2.798   2.420  -5.594
  230    HD1  PHE  33           HD2      PHE  33  -2.699   2.637  -2.907
  231    HD2  PHE  33           HD1      PHE  33  -5.624   0.354  -5.087
  232    HE1  PHE  33           HE2      PHE  33  -3.151   1.281  -0.908
  233    HE2  PHE  33           HE1      PHE  33  -6.095  -0.972  -3.092
  234    HZ   PHE  33           HZ       PHE  33  -4.770  -0.518  -0.959
  235    H    THR  34           H        THR  34  -6.626   2.840  -5.696
  236    HA   THR  34           HA       THR  34  -8.041   4.453  -3.619
  237    HB   THR  34           HB       THR  34 -10.111   3.691  -4.756
  238    HG1  THR  34           HG1      THR  34  -9.957   2.196  -6.142
  239   HG21  THR  34          HG21      THR  34  -8.150   5.076  -6.632
  240   HG22  THR  34          HG22      THR  34  -9.013   5.875  -5.293
  241   HG23  THR  34          HG23      THR  34  -9.914   5.181  -6.660
  242    H    TYR  35           H        TYR  35  -8.766   3.560  -1.743
  243    HA   TYR  35           HA       TYR  35  -8.636   0.620  -1.560
  244    HB2  TYR  35           HB2      TYR  35  -6.943   1.766  -0.298
  245    HB3  TYR  35           HB3      TYR  35  -8.185   2.577   0.649
  246    HD1  TYR  35           HD1      TYR  35  -6.592  -0.781  -0.064
  247    HD2  TYR  35           HD2      TYR  35  -9.226   1.463   2.542
  248    HE1  TYR  35           HE1      TYR  35  -6.177  -2.375   1.721
  249    HE2  TYR  35           HE2      TYR  35  -8.974  -0.317   4.258
  250    HH   TYR  35           HH       TYR  35  -8.247  -2.872   4.208
  251    H    SER  36           H        SER  36 -10.200  -0.272   0.225
  252    HA   SER  36           HA       SER  36 -12.854   0.962  -0.038
  253    HB2  SER  36           HB2      SER  36 -13.520  -1.381   0.775
  254    HB3  SER  36           HB3      SER  36 -12.812  -1.238  -0.832
  255    HG   SER  36           HG       SER  36 -11.686  -2.888   0.084
  256    H    GLY  37           H        GLY  37 -11.407  -1.046   2.584
  257    HA2  GLY  37           HA2      GLY  37 -11.002   0.523   4.703
  258    HA3  GLY  37           HA3      GLY  37 -12.760   0.689   4.587
  259    H    CYS  38           H        CYS  38 -14.030  -1.386   4.410
  260    HA   CYS  38           HA       CYS  38 -13.515  -3.059   6.609
  261    HB2  CYS  38           HB2      CYS  38 -15.375  -4.273   5.972
  262    HB3  CYS  38           HB3      CYS  38 -15.705  -2.691   5.290
  263    H    GLY  39           H        GLY  39 -12.671  -3.374   3.249
  264    HA2  GLY  39           HA2      GLY  39 -11.352  -6.006   3.620
  265    HA3  GLY  39           HA3      GLY  39 -11.913  -5.318   2.085
  266    H    GLY  40           H        GLY  40  -9.684  -6.053   1.652
  267    HA2  GLY  40           HA2      GLY  40  -7.823  -4.964   0.653
  268    HA3  GLY  40           HA3      GLY  40  -7.917  -3.710   1.859
  269    H    ASN  41           H        ASN  41  -5.503  -5.155   1.343
  270    HA   ASN  41           HA       ASN  41  -5.264  -6.955   3.715
  271    HB2  ASN  41           HB2      ASN  41  -3.810  -6.760   1.055
  272    HB3  ASN  41           HB3      ASN  41  -3.051  -7.474   2.449
  273   HD21  ASN  41          HD21      ASN  41  -6.595  -8.116   2.210
  274   HD22  ASN  41          HD22      ASN  41  -6.322  -9.754   1.717
  275    H    ALA  42           H        ALA  42  -2.993  -6.882   4.610
  276    HA   ALA  42           HA       ALA  42  -2.535  -4.443   5.874
  277    HB1  ALA  42           HB1      ALA  42  -1.736  -6.764   6.582
  278    HB2  ALA  42           HB2      ALA  42  -0.398  -6.553   5.407
  279    HB3  ALA  42           HB3      ALA  42  -0.562  -5.445   6.766
  280    H    ASN  43           H        ASN  43  -1.766  -5.044   2.514
  281    HA   ASN  43           HA       ASN  43   0.717  -3.557   2.556
  282    HB2  ASN  43           HB2      ASN  43   0.733  -3.703   0.237
  283    HB3  ASN  43           HB3      ASN  43   0.022  -5.213   0.764
  284   HD21  ASN  43          HD21      ASN  43  -0.358  -2.411  -1.171
  285   HD22  ASN  43          HD22      ASN  43  -1.959  -2.778  -1.745
  286    H    ARG  44           H        ARG  44  -2.345  -2.446   3.351
  287    HA   ARG  44           HA       ARG  44  -2.408  -0.019   1.828
  288    HB2  ARG  44           HB2      ARG  44  -4.421  -0.899   2.861
  289    HB3  ARG  44           HB3      ARG  44  -3.669  -1.044   4.436
  290    HG2  ARG  44           HG2      ARG  44  -3.683   1.271   4.866
  291    HG3  ARG  44           HG3      ARG  44  -3.813   1.695   3.174
  292    HD2  ARG  44           HD2      ARG  44  -6.086   0.696   3.130
  293    HD3  ARG  44           HD3      ARG  44  -6.024   0.546   4.894
  294    HE   ARG  44           HE       ARG  44  -6.187   2.932   3.179
  295   HH11  ARG  44          HH11      ARG  44  -5.322   1.722   6.434
  296   HH12  ARG  44          HH12      ARG  44  -5.534   3.254   7.211
  297   HH21  ARG  44          HH21      ARG  44  -6.281   5.095   4.363
  298   HH22  ARG  44          HH22      ARG  44  -6.200   5.051   6.093
  299    H    PHE  45           H        PHE  45  -1.491   1.877   2.215
  300    HA   PHE  45           HA       PHE  45  -0.326   2.530   4.847
  301    HB2  PHE  45           HB2      PHE  45   1.090   2.517   2.196
  302    HB3  PHE  45           HB3      PHE  45   1.432   3.841   3.296
  303    HD1  PHE  45           HD1      PHE  45   2.301   3.448   5.609
  304    HD2  PHE  45           HD2      PHE  45   1.799   0.233   2.782
  305    HE1  PHE  45           HE1      PHE  45   3.606   1.936   7.082
  306    HE2  PHE  45           HE2      PHE  45   3.185  -1.234   4.194
  307    HZ   PHE  45           HZ       PHE  45   4.052  -0.381   6.388
  308    H    ARG  46           H        ARG  46   0.057   4.867   5.008
  309    HA   ARG  46           HA       ARG  46  -2.247   6.389   3.896
  310    HB2  ARG  46           HB2      ARG  46  -1.619   7.954   5.912
  311    HB3  ARG  46           HB3      ARG  46  -2.611   6.529   6.103
  312    HG2  ARG  46           HG2      ARG  46  -1.030   6.819   7.950
  313    HG3  ARG  46           HG3      ARG  46  -0.868   5.275   7.134
  314    HD2  ARG  46           HD2      ARG  46   1.309   6.037   7.691
  315    HD3  ARG  46           HD3      ARG  46   1.170   6.141   5.953
  316    HE   ARG  46           HE       ARG  46   1.058   8.516   6.048
  317   HH11  ARG  46          HH11      ARG  46   1.825   7.031   9.241
  318   HH12  ARG  46          HH12      ARG  46   2.565   8.472   9.820
  319   HH21  ARG  46          HH21      ARG  46   1.903  10.451   7.009
  320   HH22  ARG  46          HH22      ARG  46   2.883  10.305   8.440
  321    H    THR  47           H        THR  47   1.251   6.227   3.727
  322    HA   THR  47           HA       THR  47   1.180   8.365   1.899
  323    HB   THR  47           HB       THR  47   1.346   9.652   4.063
  324    HG1  THR  47           HG1      THR  47   2.200  10.839   2.502
  325   HG21  THR  47          HG21      THR  47   4.202   8.650   4.175
  326   HG22  THR  47          HG22      THR  47   2.976   7.843   5.115
  327   HG23  THR  47          HG23      THR  47   3.341   9.586   5.370
  328    H    ILE  48           H        ILE  48   3.160   8.552   0.744
  329    HA   ILE  48           HA       ILE  48   4.486   6.062   0.270
  330    HB   ILE  48           HB       ILE  48   4.216   7.610  -1.485
  331   HG12  ILE  48          HG12      ILE  48   7.178   7.560  -0.797
  332   HG13  ILE  48          HG13      ILE  48   6.284   6.237  -1.491
  333   HG21  ILE  48          HG21      ILE  48   4.110   9.798  -0.310
  334   HG22  ILE  48          HG22      ILE  48   5.832   9.674   0.103
  335   HG23  ILE  48          HG23      ILE  48   5.354   9.892  -1.553
  336   HD11  ILE  48          HD11      ILE  48   6.856   8.908  -2.820
  337   HD12  ILE  48          HD12      ILE  48   7.381   7.308  -3.330
  338   HD13  ILE  48          HD13      ILE  48   5.674   7.748  -3.457
  339    H    ASP  49           H        ASP  49   5.133   8.910   2.284
  340    HA   ASP  49           HA       ASP  49   7.885   8.490   2.688
  341    HB2  ASP  49           HB2      ASP  49   5.922  10.351   3.495
  342    HB3  ASP  49           HB3      ASP  49   6.542   9.658   4.986
  343    H    GLU  50           H        GLU  50   5.096   7.075   4.321
  344    HA   GLU  50           HA       GLU  50   6.787   5.823   6.351
  345    HB2  GLU  50           HB2      GLU  50   4.420   6.673   6.757
  346    HB3  GLU  50           HB3      GLU  50   3.864   5.317   5.778
  347    HG2  GLU  50           HG2      GLU  50   3.745   4.701   8.129
  348    HG3  GLU  50           HG3      GLU  50   5.029   3.748   7.379
  349    H    CYS  51           H        CYS  51   4.918   5.004   3.383
  350    HA   CYS  51           HA       CYS  51   5.284   2.229   3.473
  351    HB2  CYS  51           HB2      CYS  51   3.668   3.259   2.036
  352    HB3  CYS  51           HB3      CYS  51   4.916   4.248   1.252
  353    H    ASN  52           H        ASN  52   7.355   4.823   2.078
  354    HA   ASN  52           HA       ASN  52   9.182   2.923   0.967
  355    HB2  ASN  52           HB2      ASN  52  10.335   4.609  -0.010
  356    HB3  ASN  52           HB3      ASN  52   8.711   5.273   0.060
  357   HD21  ASN  52          HD21      ASN  52   8.632   7.387   0.768
  358   HD22  ASN  52          HD22      ASN  52   9.955   8.171   1.624
  359    H    ARG  53           H        ARG  53   9.451   5.202   3.703
  360    HA   ARG  53           HA       ARG  53  11.879   4.206   4.619
  361    HB2  ARG  53           HB2      ARG  53  11.620   5.438   6.552
  362    HB3  ARG  53           HB3      ARG  53  10.584   6.260   5.367
  363    HG2  ARG  53           HG2      ARG  53   8.647   4.982   6.327
  364    HG3  ARG  53           HG3      ARG  53   9.677   4.449   7.645
  365    HD2  ARG  53           HD2      ARG  53   9.322   7.395   6.915
  366    HD3  ARG  53           HD3      ARG  53   8.247   6.589   8.042
  367    HE   ARG  53           HE       ARG  53  10.956   7.472   8.463
  368   HH11  ARG  53          HH11      ARG  53   8.353   5.331   9.665
  369   HH12  ARG  53          HH12      ARG  53   9.054   5.105  11.232
  370   HH21  ARG  53          HH21      ARG  53  11.955   7.091  10.579
  371   HH22  ARG  53          HH22      ARG  53  11.222   5.987  11.686
  372    H    THR  54           H        THR  54   8.763   2.573   5.014
  373    HA   THR  54           HA       THR  54  10.030   0.660   6.867
  374    HB   THR  54           HB       THR  54   7.790   1.754   7.325
  375    HG1  THR  54           HG1      THR  54   8.151  -1.047   7.340
  376   HG21  THR  54          HG21      THR  54   6.585  -0.531   5.755
  377   HG22  THR  54          HG22      THR  54   6.954   0.973   4.895
  378   HG23  THR  54          HG23      THR  54   5.890   1.032   6.294
  379    H    CYS  55           H        CYS  55   9.413   0.819   3.419
  380    HA   CYS  55           HA       CYS  55   9.769  -2.141   3.346
  381    HB2  CYS  55           HB2      CYS  55   8.062  -0.611   1.385
  382    HB3  CYS  55           HB3      CYS  55   8.225  -2.356   1.571
  383    H    VAL  56           H        VAL  56  10.099   0.804   1.317
  384    HA   VAL  56           HA       VAL  56  11.529  -0.324  -0.781
  385    HB   VAL  56           HB       VAL  56  11.510   2.416   0.488
  386   HG11  VAL  56          HG11      VAL  56  12.665   3.437  -1.241
  387   HG12  VAL  56          HG12      VAL  56  13.727   2.128  -0.750
  388   HG13  VAL  56          HG13      VAL  56  12.731   1.956  -2.220
  389   HG21  VAL  56          HG21      VAL  56   9.449   1.728  -0.660
  390   HG22  VAL  56          HG22      VAL  56  10.253   2.969  -1.611
  391   HG23  VAL  56          HG23      VAL  56  10.375   1.274  -2.096
  392    H    GLY  57           H        GLY  57  13.103  -1.765  -0.549
  393    HA2  GLY  57           HA2      GLY  57  15.679  -1.549  -0.300
  394    HA3  GLY  57           HA3      GLY  57  15.279  -1.455   1.417
  Start of MODEL   15
    1    H1   ARG   1           H        ARG   1  12.834  -4.996   2.507
    2    HA   ARG   1           HA       ARG   1  10.654  -4.220   3.106
    3    HB2  ARG   1           HB2      ARG   1   9.392  -4.537   1.029
    4    HB3  ARG   1           HB3      ARG   1  11.014  -3.951   0.825
    5    HG2  ARG   1           HG2      ARG   1  10.921  -6.883   0.451
    6    HG3  ARG   1           HG3      ARG   1   9.796  -6.032  -0.570
    7    HD2  ARG   1           HD2      ARG   1  11.657  -5.971  -1.932
    8    HD3  ARG   1           HD3      ARG   1  11.790  -4.421  -1.139
    9    HE   ARG   1           HE       ARG   1  13.686  -5.070  -0.013
   10   HH11  ARG   1          HH11      ARG   1  12.368  -7.876  -1.714
   11   HH12  ARG   1          HH12      ARG   1  13.900  -8.705  -1.820
   12   HH21  ARG   1          HH21      ARG   1  15.543  -6.085   0.030
   13   HH22  ARG   1          HH22      ARG   1  15.866  -7.564  -0.845
   14    HA   PRO   2           HA       PRO   2   8.635  -7.587   5.194
   15    HB2  PRO   2           HB2      PRO   2   6.572  -6.238   6.327
   16    HB3  PRO   2           HB3      PRO   2   8.252  -6.073   6.899
   17    HG2  PRO   2           HG2      PRO   2   6.757  -4.252   4.999
   18    HG3  PRO   2           HG3      PRO   2   7.748  -3.800   6.428
   19    HD2  PRO   2           HD2      PRO   2   8.735  -3.752   3.888
   20    HD3  PRO   2           HD3      PRO   2   9.761  -4.210   5.281
   21    H    ARG   3           H        ARG   3   6.804  -8.877   4.956
   22    HA   ARG   3           HA       ARG   3   5.703  -8.962   2.348
   23    HB2  ARG   3           HB2      ARG   3   4.852 -10.399   4.913
   24    HB3  ARG   3           HB3      ARG   3   4.189 -10.742   3.306
   25    HG2  ARG   3           HG2      ARG   3   5.858 -12.279   3.461
   26    HG3  ARG   3           HG3      ARG   3   6.579 -10.952   2.513
   27    HD2  ARG   3           HD2      ARG   3   7.935 -10.249   4.263
   28    HD3  ARG   3           HD3      ARG   3   6.989 -11.093   5.505
   29    HE   ARG   3           HE       ARG   3   9.114 -12.094   3.790
   30   HH11  ARG   3          HH11      ARG   3   6.313 -13.123   5.823
   31   HH12  ARG   3          HH12      ARG   3   7.001 -14.699   6.096
   32   HH21  ARG   3          HH21      ARG   3   9.736 -14.320   3.999
   33   HH22  ARG   3          HH22      ARG   3   8.918 -15.363   5.159
   34    H    PHE   4           H        PHE   4   4.596  -7.528   5.170
   35    HA   PHE   4           HA       PHE   4   1.784  -7.394   4.520
   36    HB2  PHE   4           HB2      PHE   4   1.459  -5.958   6.217
   37    HB3  PHE   4           HB3      PHE   4   2.899  -6.773   6.775
   38    HD1  PHE   4           HD2      PHE   4   1.566  -3.714   5.144
   39    HD2  PHE   4           HD1      PHE   4   4.839  -5.468   7.283
   40    HE1  PHE   4           HE2      PHE   4   2.530  -1.439   5.536
   41    HE2  PHE   4           HE1      PHE   4   5.891  -3.214   7.524
   42    HZ   PHE   4           HZ       PHE   4   4.748  -1.219   6.644
   43    H    CYS   5           H        CYS   5   4.603  -5.502   3.501
   44    HA   CYS   5           HA       CYS   5   3.043  -3.507   2.196
   45    HB2  CYS   5           HB2      CYS   5   5.875  -4.123   2.655
   46    HB3  CYS   5           HB3      CYS   5   5.631  -3.650   0.996
   47    H    GLU   6           H        GLU   6   4.025  -6.776   1.355
   48    HA   GLU   6           HA       GLU   6   3.650  -6.194  -1.534
   49    HB2  GLU   6           HB2      GLU   6   4.816  -8.044  -2.038
   50    HB3  GLU   6           HB3      GLU   6   5.585  -7.571  -0.546
   51    HG2  GLU   6           HG2      GLU   6   5.106  -9.510   0.481
   52    HG3  GLU   6           HG3      GLU   6   3.432  -9.558  -0.059
   53    H    LEU   7           H        LEU   7   1.369  -6.604   0.755
   54    HA   LEU   7           HA       LEU   7  -0.035  -8.871  -0.366
   55    HB2  LEU   7           HB2      LEU   7  -1.008  -6.641   1.441
   56    HB3  LEU   7           HB3      LEU   7  -1.856  -8.164   1.107
   57    HG   LEU   7           HG       LEU   7   0.714  -7.723   2.645
   58   HD11  LEU   7          HD11      LEU   7  -0.475  -8.688   4.497
   59   HD12  LEU   7          HD12      LEU   7  -1.844  -9.143   3.464
   60   HD13  LEU   7          HD13      LEU   7  -1.497  -7.435   3.776
   61   HD21  LEU   7          HD21      LEU   7   1.178  -9.732   1.394
   62   HD22  LEU   7          HD22      LEU   7  -0.429 -10.404   1.791
   63   HD23  LEU   7          HD23      LEU   7   0.799 -10.176   3.050
   64    H    ALA   8           H        ALA   8  -2.237  -8.639  -1.131
   65    HA   ALA   8           HA       ALA   8  -2.377  -6.629  -3.329
   66    HB1  ALA   8           HB1      ALA   8  -2.480  -9.012  -4.025
   67    HB2  ALA   8           HB2      ALA   8  -3.880  -9.243  -2.950
   68    HB3  ALA   8           HB3      ALA   8  -3.995  -8.149  -4.340
   69    HA   PRO   9           HA       PRO   9  -5.189  -5.005  -0.196
   70    HB2  PRO   9           HB2      PRO   9  -6.171  -2.816  -1.476
   71    HB3  PRO   9           HB3      PRO   9  -4.540  -2.902  -0.751
   72    HG2  PRO   9           HG2      PRO   9  -5.312  -3.311  -3.662
   73    HG3  PRO   9           HG3      PRO   9  -3.951  -2.360  -3.001
   74    HD2  PRO   9           HD2      PRO   9  -3.663  -4.910  -3.937
   75    HD3  PRO   9           HD3      PRO   9  -2.667  -4.270  -2.588
   76    H    SER  10           H        SER  10  -7.075  -6.257   0.084
   77    HA   SER  10           HA       SER  10  -8.781  -6.884  -2.156
   78    HB2  SER  10           HB2      SER  10  -8.243  -8.484  -0.313
   79    HB3  SER  10           HB3      SER  10  -9.230  -7.510   0.784
   80    HG   SER  10           HG       SER  10 -10.093  -8.750  -1.647
   81    H    ALA  11           H        ALA  11  -8.866  -4.391  -2.399
   82    HA   ALA  11           HA       ALA  11 -10.609  -2.824  -0.755
   83    HB1  ALA  11           HB1      ALA  11  -8.789  -1.874  -2.140
   84    HB2  ALA  11           HB2      ALA  11  -9.649  -2.381  -3.614
   85    HB3  ALA  11           HB3      ALA  11 -10.356  -1.150  -2.546
   86    H    GLY  12           H        GLY  12 -11.436  -5.324  -2.821
   87    HA2  GLY  12           HA2      GLY  12 -13.901  -4.144  -3.953
   88    HA3  GLY  12           HA3      GLY  12 -13.292  -5.788  -4.168
   89    H    SER  13           H        SER  13 -13.107  -4.994  -0.943
   90    HA   SER  13           HA       SER  13 -14.823  -6.871   0.112
   91    HB2  SER  13           HB2      SER  13 -14.170  -5.532   2.185
   92    HB3  SER  13           HB3      SER  13 -12.831  -6.052   1.156
   93    HG   SER  13           HG       SER  13 -12.869  -3.724   1.865
   94    H    CYS  14           H        CYS  14 -15.194  -3.299   0.125
   95    HA   CYS  14           HA       CYS  14 -18.137  -3.515   0.230
   96    HB2  CYS  14           HB2      CYS  14 -16.421  -1.978   2.227
   97    HB3  CYS  14           HB3      CYS  14 -18.141  -1.725   1.971
   98    H    PHE  15           H        PHE  15 -19.130  -1.460  -0.329
   99    HA   PHE  15           HA       PHE  15 -17.526  -0.111  -2.377
  100    HB2  PHE  15           HB2      PHE  15 -19.896  -0.935  -2.670
  101    HB3  PHE  15           HB3      PHE  15 -20.418   0.335  -1.569
  102    HD1  PHE  15           HD1      PHE  15 -19.717   2.823  -2.204
  103    HD2  PHE  15           HD2      PHE  15 -19.714  -0.504  -4.951
  104    HE1  PHE  15           HE1      PHE  15 -19.641   4.382  -4.094
  105    HE2  PHE  15           HE2      PHE  15 -19.864   1.072  -6.851
  106    HZ   PHE  15           HZ       PHE  15 -19.841   3.518  -6.436
  107    H    ALA  16           H        ALA  16 -16.192   1.425  -1.674
  108    HA   ALA  16           HA       ALA  16 -17.245   3.762  -0.313
  109    HB1  ALA  16           HB1      ALA  16 -14.914   2.219   0.877
  110    HB2  ALA  16           HB2      ALA  16 -15.537   3.780   1.447
  111    HB3  ALA  16           HB3      ALA  16 -16.528   2.312   1.588
  112    H    PHE  17           H        PHE  17 -15.531   5.505  -0.403
  113    HA   PHE  17           HA       PHE  17 -13.476   4.993  -2.500
  114    HB2  PHE  17           HB2      PHE  17 -15.553   6.109  -3.383
  115    HB3  PHE  17           HB3      PHE  17 -15.222   7.476  -2.333
  116    HD1  PHE  17           HD2      PHE  17 -12.919   5.375  -4.489
  117    HD2  PHE  17           HD1      PHE  17 -14.717   9.251  -3.860
  118    HE1  PHE  17           HE2      PHE  17 -11.406   6.332  -6.157
  119    HE2  PHE  17           HE1      PHE  17 -13.300  10.177  -5.675
  120    HZ   PHE  17           HZ       PHE  17 -11.625   8.740  -6.804
  121    H    VAL  18           H        VAL  18 -11.706   4.954  -1.172
  122    HA   VAL  18           HA       VAL  18 -10.998   7.444   0.197
  123    HB   VAL  18           HB       VAL  18 -10.039   6.021   2.094
  124   HG11  VAL  18          HG11      VAL  18 -13.070   6.306   1.945
  125   HG12  VAL  18          HG12      VAL  18 -12.045   6.301   3.398
  126   HG13  VAL  18          HG13      VAL  18 -11.941   7.641   2.254
  127   HG21  VAL  18          HG21      VAL  18 -12.250   4.103   1.210
  128   HG22  VAL  18          HG22      VAL  18 -10.506   3.767   1.144
  129   HG23  VAL  18          HG23      VAL  18 -11.297   3.996   2.703
  130    HA   PRO  19           HA       PRO  19  -7.618   6.018  -2.395
  131    HB2  PRO  19           HB2      PRO  19  -6.105   8.291  -2.499
  132    HB3  PRO  19           HB3      PRO  19  -7.630   8.099  -3.407
  133    HG2  PRO  19           HG2      PRO  19  -7.184   9.558  -0.807
  134    HG3  PRO  19           HG3      PRO  19  -8.173  10.031  -2.221
  135    HD2  PRO  19           HD2      PRO  19  -9.180   8.814   0.088
  136    HD3  PRO  19           HD3      PRO  19  -9.956   8.687  -1.510
  137    H    SER  20           H        SER  20  -5.952   4.839  -1.738
  138    HA   SER  20           HA       SER  20  -4.366   5.823   0.560
  139    HB2  SER  20           HB2      SER  20  -5.784   4.034   1.397
  140    HB3  SER  20           HB3      SER  20  -5.074   2.907   0.229
  141    HG   SER  20           HG       SER  20  -3.824   4.140   2.434
  142    H    TYR  21           H        TYR  21  -2.315   4.108   0.551
  143    HA   TYR  21           HA       TYR  21  -0.880   4.594  -2.017
  144    HB2  TYR  21           HB2      TYR  21  -0.253   4.974   0.877
  145    HB3  TYR  21           HB3      TYR  21   0.996   4.395  -0.147
  146    HD1  TYR  21           HD2      TYR  21   1.786   6.036  -2.270
  147    HD2  TYR  21           HD1      TYR  21  -0.981   7.217   0.894
  148    HE1  TYR  21           HE2      TYR  21   2.121   8.309  -2.844
  149    HE2  TYR  21           HE1      TYR  21  -0.545   9.575   0.328
  150    HH   TYR  21           HH       TYR  21   1.627  10.521  -2.377
  151    H    TYR  22           H        TYR  22   0.006   2.931  -2.990
  152    HA   TYR  22           HA       TYR  22  -0.085   0.166  -1.805
  153    HB2  TYR  22           HB2      TYR  22  -1.242   0.975  -3.940
  154    HB3  TYR  22           HB3      TYR  22   0.331   1.106  -4.662
  155    HD1  TYR  22           HD1      TYR  22   1.815  -0.844  -5.082
  156    HD2  TYR  22           HD2      TYR  22  -2.350  -1.158  -4.041
  157    HE1  TYR  22           HE1      TYR  22   1.793  -3.107  -6.018
  158    HE2  TYR  22           HE2      TYR  22  -2.387  -3.460  -5.015
  159    HH   TYR  22           HH       TYR  22   0.473  -4.921  -6.621
  160    H    TYR  23           H        TYR  23   1.874  -1.140  -1.899
  161    HA   TYR  23           HA       TYR  23   4.384   0.417  -2.505
  162    HB2  TYR  23           HB2      TYR  23   4.384  -0.391  -0.308
  163    HB3  TYR  23           HB3      TYR  23   3.758  -1.949  -0.785
  164    HD1  TYR  23           HD1      TYR  23   6.749   0.231  -0.665
  165    HD2  TYR  23           HD2      TYR  23   5.214  -3.676  -1.686
  166    HE1  TYR  23           HE1      TYR  23   9.042  -0.638  -0.726
  167    HE2  TYR  23           HE2      TYR  23   7.499  -4.548  -1.689
  168    HH   TYR  23           HH       TYR  23   9.687  -4.088  -1.401
  169    H    ASN  24           H        ASN  24   5.898  -0.225  -4.055
  170    HA   ASN  24           HA       ASN  24   5.265  -2.682  -5.625
  171    HB2  ASN  24           HB2      ASN  24   6.069   0.061  -6.660
  172    HB3  ASN  24           HB3      ASN  24   6.189  -1.416  -7.597
  173   HD21  ASN  24          HD21      ASN  24   4.207   1.201  -7.189
  174   HD22  ASN  24          HD22      ASN  24   2.673   0.477  -7.617
  175    H    GLN  25           H        GLN  25   6.918  -3.924  -4.509
  176    HA   GLN  25           HA       GLN  25   9.585  -3.048  -4.140
  177    HB2  GLN  25           HB2      GLN  25  10.242  -5.491  -4.241
  178    HB3  GLN  25           HB3      GLN  25   9.141  -5.057  -2.981
  179    HG2  GLN  25           HG2      GLN  25   8.155  -6.299  -5.583
  180    HG3  GLN  25           HG3      GLN  25   8.784  -7.256  -4.230
  181   HE21  GLN  25          HE21      GLN  25   5.893  -5.675  -5.380
  182   HE22  GLN  25          HE22      GLN  25   5.023  -5.781  -3.891
  183    H    TYR  26           H        TYR  26   7.969  -4.278  -7.047
  184    HA   TYR  26           HA       TYR  26  10.144  -4.982  -8.626
  185    HB2  TYR  26           HB2      TYR  26   7.555  -3.573  -9.379
  186    HB3  TYR  26           HB3      TYR  26   8.645  -4.332 -10.523
  187    HD1  TYR  26           HD2      TYR  26   9.168  -6.863 -10.179
  188    HD2  TYR  26           HD1      TYR  26   5.781  -4.842  -8.452
  189    HE1  TYR  26           HE2      TYR  26   8.003  -9.034  -9.967
  190    HE2  TYR  26           HE1      TYR  26   4.620  -7.019  -8.178
  191    HH   TYR  26           HH       TYR  26   5.539  -9.866  -9.761
  192    H    SER  27           H        SER  27   8.902  -1.704  -7.875
  193    HA   SER  27           HA       SER  27  11.111  -0.525  -9.459
  194    HB2  SER  27           HB2      SER  27   8.810   0.009 -10.186
  195    HB3  SER  27           HB3      SER  27   8.473   0.661  -8.581
  196    HG   SER  27           HG       SER  27   9.799   1.772 -10.729
  197    H    ASN  28           H        ASN  28  10.484  -1.358  -6.305
  198    HA   ASN  28           HA       ASN  28  11.223  -0.693  -4.293
  199    HB2  ASN  28           HB2      ASN  28  13.366  -1.130  -5.383
  200    HB3  ASN  28           HB3      ASN  28  13.413   0.464  -6.092
  201   HD21  ASN  28          HD21      ASN  28  13.280  -0.937  -2.705
  202   HD22  ASN  28          HD22      ASN  28  14.569   0.127  -2.161
  203    H    THR  29           H        THR  29   9.094   0.775  -5.040
  204    HA   THR  29           HA       THR  29   9.432   3.262  -3.622
  205    HB   THR  29           HB       THR  29  10.030   3.921  -5.962
  206    HG1  THR  29           HG1      THR  29   8.299   5.603  -6.045
  207   HG21  THR  29          HG21      THR  29   7.124   3.251  -6.624
  208   HG22  THR  29          HG22      THR  29   8.558   2.385  -7.217
  209   HG23  THR  29          HG23      THR  29   8.282   4.069  -7.674
  210    H    CYS  30           H        CYS  30   6.875   4.368  -3.975
  211    HA   CYS  30           HA       CYS  30   4.955   2.181  -3.749
  212    HB2  CYS  30           HB2      CYS  30   4.772   4.423  -1.794
  213    HB3  CYS  30           HB3      CYS  30   4.240   2.741  -1.732
  214    H    HIS  31           H        HIS  31   2.802   2.987  -4.393
  215    HA   HIS  31           HA       HIS  31   2.742   5.686  -5.540
  216    HB2  HIS  31           HB2      HIS  31   3.497   3.716  -7.155
  217    HB3  HIS  31           HB3      HIS  31   1.793   3.272  -7.115
  218    HD1  HIS  31           HD1      HIS  31   1.268   4.017  -9.664
  219    HD2  HIS  31           HD2      HIS  31   3.203   6.907  -7.268
  220    HE1  HIS  31           HE1      HIS  31   1.195   6.144 -10.967
  221    H    SER  32           H        SER  32   0.594   6.577  -5.576
  222    HA   SER  32           HA       SER  32  -1.199   5.571  -3.627
  223    HB2  SER  32           HB2      SER  32  -1.630   7.407  -5.890
  224    HB3  SER  32           HB3      SER  32  -2.697   7.306  -4.469
  225    HG   SER  32           HG       SER  32  -1.431   8.989  -4.050
  226    H    PHE  33           H        PHE  33  -3.160   4.528  -3.806
  227    HA   PHE  33           HA       PHE  33  -4.183   3.587  -6.394
  228    HB2  PHE  33           HB2      PHE  33  -4.129   1.351  -5.934
  229    HB3  PHE  33           HB3      PHE  33  -2.571   1.877  -5.320
  230    HD1  PHE  33           HD2      PHE  33  -2.512   2.354  -2.721
  231    HD2  PHE  33           HD1      PHE  33  -5.621   0.086  -4.608
  232    HE1  PHE  33           HE2      PHE  33  -3.016   1.237  -0.540
  233    HE2  PHE  33           HE1      PHE  33  -6.266  -0.841  -2.454
  234    HZ   PHE  33           HZ       PHE  33  -4.906  -0.329  -0.368
  235    H    THR  34           H        THR  34  -6.393   2.201  -5.641
  236    HA   THR  34           HA       THR  34  -7.951   4.178  -4.011
  237    HB   THR  34           HB       THR  34  -9.875   3.039  -5.236
  238    HG1  THR  34           HG1      THR  34  -9.279   1.385  -6.280
  239   HG21  THR  34          HG21      THR  34  -9.146   5.265  -5.868
  240   HG22  THR  34          HG22      THR  34  -9.586   4.337  -7.303
  241   HG23  THR  34          HG23      THR  34  -7.874   4.595  -6.908
  242    H    TYR  35           H        TYR  35  -8.761   3.580  -2.013
  243    HA   TYR  35           HA       TYR  35  -8.847   0.682  -1.453
  244    HB2  TYR  35           HB2      TYR  35  -7.130   2.062  -0.197
  245    HB3  TYR  35           HB3      TYR  35  -8.460   2.769   0.672
  246    HD1  TYR  35           HD1      TYR  35  -7.241  -0.685  -0.396
  247    HD2  TYR  35           HD2      TYR  35  -8.897   1.757   2.764
  248    HE1  TYR  35           HE1      TYR  35  -6.722  -2.438   1.231
  249    HE2  TYR  35           HE2      TYR  35  -8.504  -0.047   4.369
  250    HH   TYR  35           HH       TYR  35  -7.650  -2.390   4.608
  251    H    SER  36           H        SER  36 -10.395   0.414   0.734
  252    HA   SER  36           HA       SER  36 -12.805   2.049   0.489
  253    HB2  SER  36           HB2      SER  36 -14.182  -0.091   0.509
  254    HB3  SER  36           HB3      SER  36 -13.366   0.323  -1.004
  255    HG   SER  36           HG       SER  36 -12.896  -1.726  -0.748
  256    H    GLY  37           H        GLY  37 -14.405   1.100   2.417
  257    HA2  GLY  37           HA2      GLY  37 -12.929   1.674   4.807
  258    HA3  GLY  37           HA3      GLY  37 -14.640   1.261   4.686
  259    H    CYS  38           H        CYS  38 -15.072  -1.112   4.180
  260    HA   CYS  38           HA       CYS  38 -13.757  -2.674   6.244
  261    HB2  CYS  38           HB2      CYS  38 -15.521  -4.065   6.108
  262    HB3  CYS  38           HB3      CYS  38 -16.261  -2.652   5.392
  263    H    GLY  39           H        GLY  39 -13.267  -5.100   5.650
  264    HA2  GLY  39           HA2      GLY  39 -11.789  -6.580   4.775
  265    HA3  GLY  39           HA3      GLY  39 -12.285  -5.999   3.193
  266    H    GLY  40           H        GLY  40 -10.571  -5.636   1.969
  267    HA2  GLY  40           HA2      GLY  40  -8.617  -4.745   1.238
  268    HA3  GLY  40           HA3      GLY  40  -8.618  -3.714   2.659
  269    H    ASN  41           H        ASN  41  -6.175  -4.419   2.095
  270    HA   ASN  41           HA       ASN  41  -5.513  -6.562   4.028
  271    HB2  ASN  41           HB2      ASN  41  -4.164  -6.354   1.278
  272    HB3  ASN  41           HB3      ASN  41  -3.588  -7.297   2.616
  273   HD21  ASN  41          HD21      ASN  41  -4.206  -9.453   2.741
  274   HD22  ASN  41          HD22      ASN  41  -5.668 -10.044   1.962
  275    H    ALA  42           H        ALA  42  -3.195  -6.452   4.660
  276    HA   ALA  42           HA       ALA  42  -2.617  -3.990   5.758
  277    HB1  ALA  42           HB1      ALA  42  -0.560  -4.878   6.499
  278    HB2  ALA  42           HB2      ALA  42  -1.724  -6.218   6.489
  279    HB3  ALA  42           HB3      ALA  42  -0.508  -6.071   5.188
  280    H    ASN  43           H        ASN  43  -2.066  -4.772   2.429
  281    HA   ASN  43           HA       ASN  43   0.229  -3.175   1.869
  282    HB2  ASN  43           HB2      ASN  43  -0.353  -4.608   0.180
  283    HB3  ASN  43           HB3      ASN  43  -2.088  -4.321   0.334
  284   HD21  ASN  43          HD21      ASN  43   0.667  -3.543  -1.616
  285   HD22  ASN  43          HD22      ASN  43  -0.326  -2.512  -2.609
  286    H    ARG  44           H        ARG  44  -2.968  -2.200   2.880
  287    HA   ARG  44           HA       ARG  44  -2.882   0.419   1.609
  288    HB2  ARG  44           HB2      ARG  44  -5.004  -0.345   2.120
  289    HB3  ARG  44           HB3      ARG  44  -4.578  -0.936   3.727
  290    HG2  ARG  44           HG2      ARG  44  -4.338   2.012   3.295
  291    HG3  ARG  44           HG3      ARG  44  -5.957   1.393   3.231
  292    HD2  ARG  44           HD2      ARG  44  -4.000   1.000   5.537
  293    HD3  ARG  44           HD3      ARG  44  -5.237   2.259   5.421
  294    HE   ARG  44           HE       ARG  44  -6.118  -0.505   5.057
  295   HH11  ARG  44          HH11      ARG  44  -5.675   2.178   7.363
  296   HH12  ARG  44          HH12      ARG  44  -7.000   1.700   8.397
  297   HH21  ARG  44          HH21      ARG  44  -7.807  -1.248   6.726
  298   HH22  ARG  44          HH22      ARG  44  -8.153  -0.132   8.019
  299    H    PHE  45           H        PHE  45  -2.079   2.248   2.407
  300    HA   PHE  45           HA       PHE  45  -0.765   2.302   5.088
  301    HB2  PHE  45           HB2      PHE  45   0.316   3.604   2.577
  302    HB3  PHE  45           HB3      PHE  45   1.126   3.446   4.095
  303    HD1  PHE  45           HD1      PHE  45   0.712   0.416   4.636
  304    HD2  PHE  45           HD2      PHE  45   1.679   2.621   1.056
  305    HE1  PHE  45           HE1      PHE  45   1.589  -1.644   3.572
  306    HE2  PHE  45           HE2      PHE  45   2.571   0.614   0.053
  307    HZ   PHE  45           HZ       PHE  45   2.546  -1.556   1.280
  308    H    ARG  46           H        ARG  46   0.140   4.879   5.144
  309    HA   ARG  46           HA       ARG  46  -2.304   6.548   4.805
  310    HB2  ARG  46           HB2      ARG  46  -1.198   7.823   6.795
  311    HB3  ARG  46           HB3      ARG  46  -2.225   6.426   7.051
  312    HG2  ARG  46           HG2      ARG  46  -0.314   6.449   8.540
  313    HG3  ARG  46           HG3      ARG  46  -0.362   4.996   7.563
  314    HD2  ARG  46           HD2      ARG  46   1.316   7.339   6.658
  315    HD3  ARG  46           HD3      ARG  46   1.907   6.398   7.998
  316    HE   ARG  46           HE       ARG  46   2.260   5.764   5.348
  317   HH11  ARG  46          HH11      ARG  46   1.589   4.150   8.486
  318   HH12  ARG  46          HH12      ARG  46   2.238   2.626   7.931
  319   HH21  ARG  46          HH21      ARG  46   3.337   3.727   4.815
  320   HH22  ARG  46          HH22      ARG  46   3.269   2.453   5.981
  321    H    THR  47           H        THR  47   1.134   6.258   4.167
  322    HA   THR  47           HA       THR  47   1.063   8.424   2.375
  323    HB   THR  47           HB       THR  47   1.275   9.633   4.598
  324    HG1  THR  47           HG1      THR  47   2.353  11.077   3.585
  325   HG21  THR  47          HG21      THR  47   4.133   8.633   4.498
  326   HG22  THR  47          HG22      THR  47   2.970   7.993   5.634
  327   HG23  THR  47          HG23      THR  47   3.415   9.709   5.704
  328    H    ILE  48           H        ILE  48   2.952   8.554   1.073
  329    HA   ILE  48           HA       ILE  48   4.237   6.014   0.661
  330    HB   ILE  48           HB       ILE  48   3.930   7.297  -1.281
  331   HG12  ILE  48          HG12      ILE  48   6.909   7.438  -0.567
  332   HG13  ILE  48          HG13      ILE  48   6.030   6.001  -1.075
  333   HG21  ILE  48          HG21      ILE  48   5.531   9.619  -0.116
  334   HG22  ILE  48          HG22      ILE  48   4.786   9.540  -1.714
  335   HG23  ILE  48          HG23      ILE  48   3.761   9.603  -0.295
  336   HD11  ILE  48          HD11      ILE  48   7.164   6.800  -2.979
  337   HD12  ILE  48          HD12      ILE  48   5.455   7.181  -3.207
  338   HD13  ILE  48          HD13      ILE  48   6.591   8.467  -2.741
  339    H    ASP  49           H        ASP  49   5.103   9.093   2.178
  340    HA   ASP  49           HA       ASP  49   7.801   8.831   2.613
  341    HB2  ASP  49           HB2      ASP  49   5.819  10.019   4.543
  342    HB3  ASP  49           HB3      ASP  49   7.558  10.298   4.513
  343    H    GLU  50           H        GLU  50   5.168   7.195   4.512
  344    HA   GLU  50           HA       GLU  50   7.190   6.159   6.360
  345    HB2  GLU  50           HB2      GLU  50   5.094   6.937   7.257
  346    HB3  GLU  50           HB3      GLU  50   4.245   5.897   6.124
  347    HG2  GLU  50           HG2      GLU  50   4.210   4.920   8.363
  348    HG3  GLU  50           HG3      GLU  50   5.130   3.880   7.286
  349    H    CYS  51           H        CYS  51   4.995   5.177   3.695
  350    HA   CYS  51           HA       CYS  51   5.410   2.395   3.778
  351    HB2  CYS  51           HB2      CYS  51   3.786   3.210   2.237
  352    HB3  CYS  51           HB3      CYS  51   4.962   4.281   1.451
  353    H    ASN  52           H        ASN  52   7.378   4.918   2.235
  354    HA   ASN  52           HA       ASN  52   9.194   3.007   1.116
  355    HB2  ASN  52           HB2      ASN  52  10.332   4.692   0.109
  356    HB3  ASN  52           HB3      ASN  52   8.686   5.322   0.158
  357   HD21  ASN  52          HD21      ASN  52   8.394   7.309   1.074
  358   HD22  ASN  52          HD22      ASN  52   9.640   8.191   1.937
  359    H    ARG  53           H        ARG  53   9.517   5.352   3.879
  360    HA   ARG  53           HA       ARG  53  12.006   4.345   4.614
  361    HB2  ARG  53           HB2      ARG  53  11.883   5.637   6.503
  362    HB3  ARG  53           HB3      ARG  53  10.666   6.399   5.455
  363    HG2  ARG  53           HG2      ARG  53   8.903   5.219   6.624
  364    HG3  ARG  53           HG3      ARG  53  10.039   4.473   7.729
  365    HD2  ARG  53           HD2      ARG  53   9.883   7.495   7.407
  366    HD3  ARG  53           HD3      ARG  53   8.809   6.621   8.509
  367    HE   ARG  53           HE       ARG  53  11.075   5.613   9.356
  368   HH11  ARG  53          HH11      ARG  53  10.615   9.077   8.545
  369   HH12  ARG  53          HH12      ARG  53  11.520   9.622   9.924
  370   HH21  ARG  53          HH21      ARG  53  12.185   6.367  11.162
  371   HH22  ARG  53          HH22      ARG  53  12.512   8.048  11.383
  372    H    THR  54           H        THR  54   8.898   2.848   5.312
  373    HA   THR  54           HA       THR  54  10.096   0.884   7.103
  374    HB   THR  54           HB       THR  54   7.819   2.217   7.149
  375    HG1  THR  54           HG1      THR  54   7.109   0.839   8.621
  376   HG21  THR  54          HG21      THR  54   6.808  -0.386   5.980
  377   HG22  THR  54          HG22      THR  54   6.974   1.095   5.017
  378   HG23  THR  54          HG23      THR  54   5.895   1.095   6.412
  379    H    CYS  55           H        CYS  55   9.614   0.922   3.639
  380    HA   CYS  55           HA       CYS  55   9.946  -2.027   3.605
  381    HB2  CYS  55           HB2      CYS  55   8.056  -0.463   1.814
  382    HB3  CYS  55           HB3      CYS  55   8.406  -2.184   1.716
  383    H    VAL  56           H        VAL  56  10.121   0.920   1.525
  384    HA   VAL  56           HA       VAL  56  11.574  -0.190  -0.556
  385    HB   VAL  56           HB       VAL  56  11.387   2.589   0.557
  386   HG11  VAL  56          HG11      VAL  56  12.729   1.982  -2.063
  387   HG12  VAL  56          HG12      VAL  56  12.365   3.554  -1.350
  388   HG13  VAL  56          HG13      VAL  56  13.572   2.516  -0.590
  389   HG21  VAL  56          HG21      VAL  56  10.303   1.239  -1.952
  390   HG22  VAL  56          HG22      VAL  56   9.362   1.564  -0.486
  391   HG23  VAL  56          HG23      VAL  56   9.973   2.900  -1.446
  392    H    GLY  57           H        GLY  57  13.356  -1.234  -0.611
  393    HA2  GLY  57           HA2      GLY  57  15.262  -1.408   1.518
  394    HA3  GLY  57           HA3      GLY  57  15.436  -2.063  -0.127
  Start of MODEL   16
    1    H1   ARG   1           H        ARG   1  12.542  -5.330   2.019
    2    HA   ARG   1           HA       ARG   1  10.506  -4.438   3.130
    3    HB2  ARG   1           HB2      ARG   1   8.825  -5.437   1.290
    4    HB3  ARG   1           HB3      ARG   1   9.940  -4.161   0.970
    5    HG2  ARG   1           HG2      ARG   1  10.580  -7.070   0.334
    6    HG3  ARG   1           HG3      ARG   1   9.761  -5.979  -0.757
    7    HD2  ARG   1           HD2      ARG   1  11.636  -5.023  -1.459
    8    HD3  ARG   1           HD3      ARG   1  12.132  -4.607   0.156
    9    HE   ARG   1           HE       ARG   1  13.683  -6.257   0.091
   10   HH11  ARG   1          HH11      ARG   1  11.331  -6.958  -2.468
   11   HH12  ARG   1          HH12      ARG   1  12.456  -7.832  -3.465
   12   HH21  ARG   1          HH21      ARG   1  14.972  -7.881  -0.950
   13   HH22  ARG   1          HH22      ARG   1  14.420  -8.582  -2.441
   14    HA   PRO   2           HA       PRO   2   8.709  -7.723   5.577
   15    HB2  PRO   2           HB2      PRO   2   6.542  -6.406   6.605
   16    HB3  PRO   2           HB3      PRO   2   8.207  -6.101   7.154
   17    HG2  PRO   2           HG2      PRO   2   6.614  -4.541   5.104
   18    HG3  PRO   2           HG3      PRO   2   7.564  -3.892   6.490
   19    HD2  PRO   2           HD2      PRO   2   8.602  -3.966   3.991
   20    HD3  PRO   2           HD3      PRO   2   9.612  -4.338   5.418
   21    H    ARG   3           H        ARG   3   7.024  -9.241   5.325
   22    HA   ARG   3           HA       ARG   3   5.856  -9.541   2.817
   23    HB2  ARG   3           HB2      ARG   3   4.777 -11.453   3.638
   24    HB3  ARG   3           HB3      ARG   3   6.289 -11.352   4.509
   25    HG2  ARG   3           HG2      ARG   3   3.491 -10.696   5.550
   26    HG3  ARG   3           HG3      ARG   3   4.498 -12.058   6.006
   27    HD2  ARG   3           HD2      ARG   3   5.039  -9.148   6.625
   28    HD3  ARG   3           HD3      ARG   3   4.482 -10.381   7.772
   29    HE   ARG   3           HE       ARG   3   6.743 -11.556   6.927
   30   HH11  ARG   3          HH11      ARG   3   6.222  -8.457   8.547
   31   HH12  ARG   3          HH12      ARG   3   7.932  -8.181   8.746
   32   HH21  ARG   3          HH21      ARG   3   8.873 -11.168   7.127
   33   HH22  ARG   3          HH22      ARG   3   9.517  -9.742   7.880
   34    H    PHE   4           H        PHE   4   4.545  -7.545   5.413
   35    HA   PHE   4           HA       PHE   4   1.822  -7.818   4.464
   36    HB2  PHE   4           HB2      PHE   4   1.238  -6.246   6.052
   37    HB3  PHE   4           HB3      PHE   4   2.582  -7.081   6.791
   38    HD1  PHE   4           HD2      PHE   4   1.538  -3.975   5.029
   39    HD2  PHE   4           HD1      PHE   4   4.568  -5.885   7.400
   40    HE1  PHE   4           HE2      PHE   4   2.602  -1.736   5.527
   41    HE2  PHE   4           HE1      PHE   4   5.664  -3.675   7.787
   42    HZ   PHE   4           HZ       PHE   4   4.651  -1.611   6.873
   43    H    CYS   5           H        CYS   5   4.623  -5.853   3.437
   44    HA   CYS   5           HA       CYS   5   3.039  -3.859   2.117
   45    HB2  CYS   5           HB2      CYS   5   5.821  -4.429   2.764
   46    HB3  CYS   5           HB3      CYS   5   5.695  -4.070   1.058
   47    H    GLU   6           H        GLU   6   3.873  -7.137   1.310
   48    HA   GLU   6           HA       GLU   6   3.678  -6.446  -1.611
   49    HB2  GLU   6           HB2      GLU   6   4.797  -8.496  -2.074
   50    HB3  GLU   6           HB3      GLU   6   5.637  -7.513  -0.861
   51    HG2  GLU   6           HG2      GLU   6   5.978  -9.572  -0.036
   52    HG3  GLU   6           HG3      GLU   6   4.643  -9.021   0.916
   53    H    LEU   7           H        LEU   7   1.372  -6.960   0.557
   54    HA   LEU   7           HA       LEU   7  -0.047  -9.148  -0.701
   55    HB2  LEU   7           HB2      LEU   7  -1.131  -6.974   1.111
   56    HB3  LEU   7           HB3      LEU   7  -1.890  -8.532   0.743
   57    HG   LEU   7           HG       LEU   7   0.563  -7.984   2.441
   58   HD11  LEU   7          HD11      LEU   7  -0.702  -8.991   4.224
   59   HD12  LEU   7          HD12      LEU   7  -2.000  -9.479   3.108
   60   HD13  LEU   7          HD13      LEU   7  -1.719  -7.769   3.448
   61   HD21  LEU   7          HD21      LEU   7  -0.428 -10.729   1.597
   62   HD22  LEU   7          HD22      LEU   7   0.793 -10.379   2.859
   63   HD23  LEU   7          HD23      LEU   7   1.130  -9.969   1.196
   64    H    ALA   8           H        ALA   8  -2.202  -8.834  -1.646
   65    HA   ALA   8           HA       ALA   8  -2.203  -6.592  -3.613
   66    HB1  ALA   8           HB1      ALA   8  -3.779  -9.168  -3.677
   67    HB2  ALA   8           HB2      ALA   8  -3.679  -7.940  -4.949
   68    HB3  ALA   8           HB3      ALA   8  -2.244  -8.904  -4.543
   69    HA   PRO   9           HA       PRO   9  -5.322  -5.336  -0.565
   70    HB2  PRO   9           HB2      PRO   9  -5.962  -2.874  -1.517
   71    HB3  PRO   9           HB3      PRO   9  -4.425  -3.230  -0.670
   72    HG2  PRO   9           HG2      PRO   9  -4.907  -3.037  -3.659
   73    HG3  PRO   9           HG3      PRO   9  -3.553  -2.355  -2.698
   74    HD2  PRO   9           HD2      PRO   9  -3.393  -4.727  -4.082
   75    HD3  PRO   9           HD3      PRO   9  -2.467  -4.408  -2.582
   76    H    SER  10           H        SER  10  -7.062  -6.627  -0.752
   77    HA   SER  10           HA       SER  10  -8.783  -6.796  -3.060
   78    HB2  SER  10           HB2      SER  10  -8.313  -8.702  -1.531
   79    HB3  SER  10           HB3      SER  10  -9.095  -7.825  -0.212
   80    HG   SER  10           HG       SER  10 -10.984  -7.787  -1.520
   81    H    ALA  11           H        ALA  11  -8.739  -4.139  -2.586
   82    HA   ALA  11           HA       ALA  11 -10.529  -3.017  -0.725
   83    HB1  ALA  11           HB1      ALA  11  -8.922  -1.706  -2.075
   84    HB2  ALA  11           HB2      ALA  11  -9.874  -2.062  -3.537
   85    HB3  ALA  11           HB3      ALA  11 -10.578  -1.075  -2.243
   86    H    GLY  12           H        GLY  12 -11.176  -4.553  -3.830
   87    HA2  GLY  12           HA2      GLY  12 -13.804  -3.735  -4.302
   88    HA3  GLY  12           HA3      GLY  12 -13.073  -5.250  -4.834
   89    H    SER  13           H        SER  13 -12.814  -5.615  -1.600
   90    HA   SER  13           HA       SER  13 -15.055  -7.396  -1.426
   91    HB2  SER  13           HB2      SER  13 -12.875  -7.712  -0.284
   92    HB3  SER  13           HB3      SER  13 -13.233  -6.321   0.748
   93    HG   SER  13           HG       SER  13 -13.822  -8.169   1.852
   94    H    CYS  14           H        CYS  14 -14.647  -3.955  -0.682
   95    HA   CYS  14           HA       CYS  14 -17.504  -3.780   0.093
   96    HB2  CYS  14           HB2      CYS  14 -15.100  -2.812   1.697
   97    HB3  CYS  14           HB3      CYS  14 -16.625  -1.935   1.705
   98    H    PHE  15           H        PHE  15 -18.434  -1.974  -0.895
   99    HA   PHE  15           HA       PHE  15 -16.625  -0.422  -2.647
  100    HB2  PHE  15           HB2      PHE  15 -18.553  -1.012  -3.809
  101    HB3  PHE  15           HB3      PHE  15 -19.597  -0.769  -2.416
  102    HD1  PHE  15           HD2      PHE  15 -17.045   1.716  -3.763
  103    HD2  PHE  15           HD1      PHE  15 -21.209   0.696  -3.244
  104    HE1  PHE  15           HE2      PHE  15 -17.707   4.046  -4.264
  105    HE2  PHE  15           HE1      PHE  15 -21.837   2.995  -3.802
  106    HZ   PHE  15           HZ       PHE  15 -20.072   4.699  -4.317
  107    H    ALA  16           H        ALA  16 -15.556   1.129  -1.658
  108    HA   ALA  16           HA       ALA  16 -16.959   3.221  -0.255
  109    HB1  ALA  16           HB1      ALA  16 -16.380   1.758   1.619
  110    HB2  ALA  16           HB2      ALA  16 -14.709   1.643   1.056
  111    HB3  ALA  16           HB3      ALA  16 -15.331   3.189   1.656
  112    H    PHE  17           H        PHE  17 -15.153   4.982   0.188
  113    HA   PHE  17           HA       PHE  17 -13.104   4.916  -1.966
  114    HB2  PHE  17           HB2      PHE  17 -15.258   6.083  -2.653
  115    HB3  PHE  17           HB3      PHE  17 -14.804   7.376  -1.546
  116    HD1  PHE  17           HD2      PHE  17 -11.598   6.809  -2.483
  117    HD2  PHE  17           HD1      PHE  17 -15.330   7.782  -4.428
  118    HE1  PHE  17           HE2      PHE  17 -10.363   7.800  -4.338
  119    HE2  PHE  17           HE1      PHE  17 -14.055   8.836  -6.278
  120    HZ   PHE  17           HZ       PHE  17 -11.572   8.851  -6.240
  121    H    VAL  18           H        VAL  18 -11.371   4.764  -0.641
  122    HA   VAL  18           HA       VAL  18 -10.710   7.064   1.035
  123    HB   VAL  18           HB       VAL  18  -9.698   5.449   2.727
  124   HG11  VAL  18          HG11      VAL  18 -11.600   6.990   3.138
  125   HG12  VAL  18          HG12      VAL  18 -12.737   5.733   2.604
  126   HG13  VAL  18          HG13      VAL  18 -11.746   5.487   4.061
  127   HG21  VAL  18          HG21      VAL  18 -11.855   3.595   1.618
  128   HG22  VAL  18          HG22      VAL  18 -10.103   3.309   1.567
  129   HG23  VAL  18          HG23      VAL  18 -10.937   3.349   3.125
  130    HA   PRO  19           HA       PRO  19  -7.615   5.908  -2.117
  131    HB2  PRO  19           HB2      PRO  19  -6.298   8.312  -2.296
  132    HB3  PRO  19           HB3      PRO  19  -7.851   7.974  -3.119
  133    HG2  PRO  19           HG2      PRO  19  -7.432   9.353  -0.441
  134    HG3  PRO  19           HG3      PRO  19  -8.419   9.914  -1.818
  135    HD2  PRO  19           HD2      PRO  19  -9.493   8.586   0.277
  136    HD3  PRO  19           HD3      PRO  19 -10.091   8.268  -1.383
  137    H    SER  20           H        SER  20  -5.874   4.771  -1.527
  138    HA   SER  20           HA       SER  20  -4.189   5.723   0.722
  139    HB2  SER  20           HB2      SER  20  -5.560   3.902   1.531
  140    HB3  SER  20           HB3      SER  20  -4.992   2.847   0.239
  141    HG   SER  20           HG       SER  20  -3.549   3.837   2.423
  142    H    TYR  21           H        TYR  21  -2.161   3.962   0.573
  143    HA   TYR  21           HA       TYR  21  -0.733   4.570  -1.985
  144    HB2  TYR  21           HB2      TYR  21   0.059   4.768   0.898
  145    HB3  TYR  21           HB3      TYR  21   1.273   4.249  -0.267
  146    HD1  TYR  21           HD2      TYR  21   1.941   5.761  -2.193
  147    HD2  TYR  21           HD1      TYR  21  -0.648   7.068   1.012
  148    HE1  TYR  21           HE2      TYR  21   2.239   8.097  -2.908
  149    HE2  TYR  21           HE1      TYR  21  -0.264   9.414   0.358
  150    HH   TYR  21           HH       TYR  21   1.752  10.351  -2.448
  151    H    TYR  22           H        TYR  22   0.124   2.937  -2.954
  152    HA   TYR  22           HA       TYR  22  -0.012   0.162  -1.887
  153    HB2  TYR  22           HB2      TYR  22  -1.237   1.008  -4.023
  154    HB3  TYR  22           HB3      TYR  22   0.323   1.293  -4.714
  155    HD1  TYR  22           HD1      TYR  22   1.945  -0.715  -4.977
  156    HD2  TYR  22           HD2      TYR  22  -2.323  -1.031  -4.438
  157    HE1  TYR  22           HE1      TYR  22   2.007  -2.928  -5.972
  158    HE2  TYR  22           HE2      TYR  22  -2.274  -3.286  -5.498
  159    HH   TYR  22           HH       TYR  22  -0.827  -5.062  -6.424
  160    H    TYR  23           H        TYR  23   1.945  -1.095  -1.993
  161    HA   TYR  23           HA       TYR  23   4.481   0.427  -2.481
  162    HB2  TYR  23           HB2      TYR  23   4.419  -0.488  -0.289
  163    HB3  TYR  23           HB3      TYR  23   3.810  -2.027  -0.861
  164    HD1  TYR  23           HD1      TYR  23   6.835   0.200  -0.835
  165    HD2  TYR  23           HD2      TYR  23   5.266  -3.747  -1.519
  166    HE1  TYR  23           HE1      TYR  23   9.135  -0.701  -0.902
  167    HE2  TYR  23           HE2      TYR  23   7.559  -4.674  -1.389
  168    HH   TYR  23           HH       TYR  23  10.540  -2.734  -1.215
  169    H    ASN  24           H        ASN  24   5.599   0.043  -4.294
  170    HA   ASN  24           HA       ASN  24   4.959  -2.366  -5.948
  171    HB2  ASN  24           HB2      ASN  24   5.992   0.391  -6.748
  172    HB3  ASN  24           HB3      ASN  24   5.951  -1.012  -7.816
  173   HD21  ASN  24          HD21      ASN  24   4.449   1.614  -7.992
  174   HD22  ASN  24          HD22      ASN  24   2.761   1.154  -8.071
  175    H    GLN  25           H        GLN  25   6.472  -3.735  -4.800
  176    HA   GLN  25           HA       GLN  25   9.162  -3.005  -4.274
  177    HB2  GLN  25           HB2      GLN  25   9.741  -5.294  -4.046
  178    HB3  GLN  25           HB3      GLN  25   8.194  -5.042  -3.301
  179    HG2  GLN  25           HG2      GLN  25   8.666  -6.427  -5.948
  180    HG3  GLN  25           HG3      GLN  25   8.326  -7.188  -4.409
  181   HE21  GLN  25          HE21      GLN  25   6.101  -5.100  -3.662
  182   HE22  GLN  25          HE22      GLN  25   4.848  -5.527  -4.796
  183    H    TYR  26           H        TYR  26   7.649  -4.262  -7.247
  184    HA   TYR  26           HA       TYR  26   9.922  -4.849  -8.732
  185    HB2  TYR  26           HB2      TYR  26   7.342  -3.572  -9.706
  186    HB3  TYR  26           HB3      TYR  26   8.524  -4.394 -10.705
  187    HD1  TYR  26           HD2      TYR  26   9.138  -6.919  -9.745
  188    HD2  TYR  26           HD1      TYR  26   5.410  -4.795  -9.171
  189    HE1  TYR  26           HE2      TYR  26   7.909  -9.088  -9.545
  190    HE2  TYR  26           HE1      TYR  26   4.224  -6.922  -8.941
  191    HH   TYR  26           HH       TYR  26   4.388  -9.213  -8.880
  192    H    SER  27           H        SER  27   8.720  -1.689  -7.796
  193    HA   SER  27           HA       SER  27  10.788  -0.453  -9.551
  194    HB2  SER  27           HB2      SER  27   8.357  -0.092 -10.188
  195    HB3  SER  27           HB3      SER  27   8.221   0.921  -8.746
  196    HG   SER  27           HG       SER  27  10.330   1.318 -10.592
  197    H    ASN  28           H        ASN  28  10.266  -1.367  -6.462
  198    HA   ASN  28           HA       ASN  28  10.958  -0.812  -4.481
  199    HB2  ASN  28           HB2      ASN  28  13.074  -0.970  -6.085
  200    HB3  ASN  28           HB3      ASN  28  13.251   0.737  -5.696
  201   HD21  ASN  28          HD21      ASN  28  14.398   1.075  -3.754
  202   HD22  ASN  28          HD22      ASN  28  14.574  -0.088  -2.438
  203    H    THR  29           H        THR  29   8.877   0.747  -5.122
  204    HA   THR  29           HA       THR  29   9.352   3.111  -3.569
  205    HB   THR  29           HB       THR  29  10.055   3.697  -5.942
  206    HG1  THR  29           HG1      THR  29   9.644   5.585  -5.405
  207   HG21  THR  29          HG21      THR  29   7.071   3.726  -6.551
  208   HG22  THR  29          HG22      THR  29   8.234   2.534  -7.178
  209   HG23  THR  29          HG23      THR  29   8.396   4.242  -7.601
  210    H    CYS  30           H        CYS  30   6.936   4.415  -3.992
  211    HA   CYS  30           HA       CYS  30   4.829   2.369  -3.694
  212    HB2  CYS  30           HB2      CYS  30   5.069   4.808  -1.927
  213    HB3  CYS  30           HB3      CYS  30   3.934   3.486  -1.774
  214    H    HIS  31           H        HIS  31   2.690   3.334  -4.151
  215    HA   HIS  31           HA       HIS  31   2.698   6.007  -5.397
  216    HB2  HIS  31           HB2      HIS  31   3.424   4.115  -7.064
  217    HB3  HIS  31           HB3      HIS  31   1.754   3.571  -6.960
  218    HD1  HIS  31           HD1      HIS  31   0.681   4.430  -9.196
  219    HD2  HIS  31           HD2      HIS  31   3.427   7.064  -7.395
  220    HE1  HIS  31           HE1      HIS  31   0.839   6.436 -10.747
  221    H    SER  32           H        SER  32   0.554   6.933  -5.386
  222    HA   SER  32           HA       SER  32  -1.214   5.747  -3.498
  223    HB2  SER  32           HB2      SER  32  -2.760   7.518  -4.260
  224    HB3  SER  32           HB3      SER  32  -1.215   8.058  -3.594
  225    HG   SER  32           HG       SER  32  -1.701   7.807  -6.389
  226    H    PHE  33           H        PHE  33  -3.076   4.618  -3.691
  227    HA   PHE  33           HA       PHE  33  -4.172   3.863  -6.326
  228    HB2  PHE  33           HB2      PHE  33  -4.159   1.599  -5.969
  229    HB3  PHE  33           HB3      PHE  33  -2.570   2.073  -5.417
  230    HD1  PHE  33           HD2      PHE  33  -2.413   2.464  -2.764
  231    HD2  PHE  33           HD1      PHE  33  -5.527   0.191  -4.654
  232    HE1  PHE  33           HE2      PHE  33  -2.877   1.298  -0.610
  233    HE2  PHE  33           HE1      PHE  33  -6.062  -0.858  -2.533
  234    HZ   PHE  33           HZ       PHE  33  -4.675  -0.328  -0.427
  235    H    THR  34           H        THR  34  -6.379   2.453  -5.589
  236    HA   THR  34           HA       THR  34  -7.852   4.291  -3.691
  237    HB   THR  34           HB       THR  34  -9.884   3.451  -4.929
  238    HG1  THR  34           HG1      THR  34  -8.036   2.748  -6.952
  239   HG21  THR  34          HG21      THR  34  -9.636   5.006  -6.809
  240   HG22  THR  34          HG22      THR  34  -7.882   5.076  -6.546
  241   HG23  THR  34          HG23      THR  34  -8.993   5.702  -5.316
  242    H    TYR  35           H        TYR  35  -8.612   3.484  -1.780
  243    HA   TYR  35           HA       TYR  35  -8.725   0.569  -1.564
  244    HB2  TYR  35           HB2      TYR  35  -6.834   1.606  -0.353
  245    HB3  TYR  35           HB3      TYR  35  -7.982   2.423   0.681
  246    HD1  TYR  35           HD1      TYR  35  -7.066  -1.039  -0.602
  247    HD2  TYR  35           HD2      TYR  35  -8.488   1.349   2.711
  248    HE1  TYR  35           HE1      TYR  35  -6.576  -2.878   0.939
  249    HE2  TYR  35           HE2      TYR  35  -8.189  -0.572   4.215
  250    HH   TYR  35           HH       TYR  35  -6.916  -2.531   4.450
  251    H    SER  36           H        SER  36 -10.195  -0.043   0.438
  252    HA   SER  36           HA       SER  36 -12.581   1.692   0.674
  253    HB2  SER  36           HB2      SER  36 -12.430  -1.323   0.259
  254    HB3  SER  36           HB3      SER  36 -13.906  -0.422   0.636
  255    HG   SER  36           HG       SER  36 -13.610  -0.763  -1.598
  256    H    GLY  37           H        GLY  37 -13.940   0.764   2.807
  257    HA2  GLY  37           HA2      GLY  37 -11.922   0.799   4.943
  258    HA3  GLY  37           HA3      GLY  37 -13.644   0.986   5.129
  259    H    CYS  38           H        CYS  38 -14.949  -1.115   4.602
  260    HA   CYS  38           HA       CYS  38 -13.993  -3.113   6.466
  261    HB2  CYS  38           HB2      CYS  38 -16.184  -4.186   5.998
  262    HB3  CYS  38           HB3      CYS  38 -16.227  -2.558   6.621
  263    H    GLY  39           H        GLY  39 -12.323  -3.032   4.000
  264    HA2  GLY  39           HA2      GLY  39 -12.222  -5.906   3.520
  265    HA3  GLY  39           HA3      GLY  39 -12.677  -4.917   2.104
  266    H    GLY  40           H        GLY  40 -10.516  -6.011   1.454
  267    HA2  GLY  40           HA2      GLY  40  -8.548  -5.163   0.509
  268    HA3  GLY  40           HA3      GLY  40  -8.485  -3.914   1.722
  269    H    ASN  41           H        ASN  41  -6.157  -4.792   1.374
  270    HA   ASN  41           HA       ASN  41  -5.614  -6.775   3.484
  271    HB2  ASN  41           HB2      ASN  41  -4.177  -6.688   0.797
  272    HB3  ASN  41           HB3      ASN  41  -3.752  -7.691   2.163
  273   HD21  ASN  41          HD21      ASN  41  -4.839  -9.666   2.541
  274   HD22  ASN  41          HD22      ASN  41  -6.179 -10.164   1.552
  275    H    ALA  42           H        ALA  42  -3.327  -6.680   4.214
  276    HA   ALA  42           HA       ALA  42  -2.775  -4.229   5.242
  277    HB1  ALA  42           HB1      ALA  42  -0.760  -5.121   6.104
  278    HB2  ALA  42           HB2      ALA  42  -1.945  -6.439   6.063
  279    HB3  ALA  42           HB3      ALA  42  -0.661  -6.341   4.818
  280    H    ASN  43           H        ASN  43  -1.950  -4.945   1.890
  281    HA   ASN  43           HA       ASN  43   0.363  -3.250   1.753
  282    HB2  ASN  43           HB2      ASN  43  -0.168  -4.893   0.075
  283    HB3  ASN  43           HB3      ASN  43  -1.623  -3.997  -0.398
  284   HD21  ASN  43          HD21      ASN  43  -0.895  -3.688  -2.591
  285   HD22  ASN  43          HD22      ASN  43   0.516  -2.743  -2.964
  286    H    ARG  44           H        ARG  44  -2.645  -2.325   2.730
  287    HA   ARG  44           HA       ARG  44  -2.745   0.297   1.354
  288    HB2  ARG  44           HB2      ARG  44  -4.865  -0.708   1.827
  289    HB3  ARG  44           HB3      ARG  44  -4.451  -1.075   3.490
  290    HG2  ARG  44           HG2      ARG  44  -4.161   1.749   3.092
  291    HG3  ARG  44           HG3      ARG  44  -5.690   1.331   2.401
  292    HD2  ARG  44           HD2      ARG  44  -5.664   2.200   4.696
  293    HD3  ARG  44           HD3      ARG  44  -6.342   0.563   4.690
  294    HE   ARG  44           HE       ARG  44  -3.917  -0.127   5.089
  295   HH11  ARG  44          HH11      ARG  44  -5.232   2.851   6.473
  296   HH12  ARG  44          HH12      ARG  44  -4.068   2.980   7.750
  297   HH21  ARG  44          HH21      ARG  44  -2.578  -0.172   6.867
  298   HH22  ARG  44          HH22      ARG  44  -2.617   1.048   8.112
  299    H    PHE  45           H        PHE  45  -1.815   2.103   2.230
  300    HA   PHE  45           HA       PHE  45  -0.789   2.047   5.040
  301    HB2  PHE  45           HB2      PHE  45   0.611   3.387   2.711
  302    HB3  PHE  45           HB3      PHE  45   1.278   3.060   4.301
  303    HD1  PHE  45           HD1      PHE  45   0.723   0.190   4.774
  304    HD2  PHE  45           HD2      PHE  45   1.700   2.209   1.085
  305    HE1  PHE  45           HE1      PHE  45   1.408  -1.965   3.737
  306    HE2  PHE  45           HE2      PHE  45   2.411   0.089   0.129
  307    HZ   PHE  45           HZ       PHE  45   2.339  -1.991   1.432
  308    H    ARG  46           H        ARG  46   0.160   4.584   5.169
  309    HA   ARG  46           HA       ARG  46  -2.256   6.294   4.615
  310    HB2  ARG  46           HB2      ARG  46  -1.535   7.640   6.682
  311    HB3  ARG  46           HB3      ARG  46  -2.484   6.175   6.818
  312    HG2  ARG  46           HG2      ARG  46  -0.773   6.391   8.570
  313    HG3  ARG  46           HG3      ARG  46  -0.692   4.903   7.664
  314    HD2  ARG  46           HD2      ARG  46   1.542   5.682   8.078
  315    HD3  ARG  46           HD3      ARG  46   1.254   5.849   6.360
  316    HE   ARG  46           HE       ARG  46   1.166   8.218   6.567
  317   HH11  ARG  46          HH11      ARG  46   2.248   6.625   9.619
  318   HH12  ARG  46          HH12      ARG  46   2.423   8.157  10.413
  319   HH21  ARG  46          HH21      ARG  46   1.378  10.191   7.774
  320   HH22  ARG  46          HH22      ARG  46   1.956  10.128   9.397
  321    H    THR  47           H        THR  47   1.208   6.087   4.120
  322    HA   THR  47           HA       THR  47   1.026   8.343   2.413
  323    HB   THR  47           HB       THR  47   1.213   9.484   4.645
  324    HG1  THR  47           HG1      THR  47   1.769  10.636   2.892
  325   HG21  THR  47          HG21      THR  47   3.288   9.470   5.835
  326   HG22  THR  47          HG22      THR  47   4.086   8.586   4.529
  327   HG23  THR  47          HG23      THR  47   2.932   7.746   5.512
  328    H    ILE  48           H        ILE  48   3.047   8.666   1.205
  329    HA   ILE  48           HA       ILE  48   4.364   6.172   0.642
  330    HB   ILE  48           HB       ILE  48   4.024   7.668  -1.140
  331   HG12  ILE  48          HG12      ILE  48   7.010   7.739  -0.535
  332   HG13  ILE  48          HG13      ILE  48   6.142   6.318  -1.051
  333   HG21  ILE  48          HG21      ILE  48   5.668   9.813   0.275
  334   HG22  ILE  48          HG22      ILE  48   4.967   9.929  -1.342
  335   HG23  ILE  48          HG23      ILE  48   3.903   9.855   0.041
  336   HD11  ILE  48          HD11      ILE  48   7.127   7.290  -3.019
  337   HD12  ILE  48          HD12      ILE  48   5.376   7.513  -3.110
  338   HD13  ILE  48          HD13      ILE  48   6.433   8.874  -2.665
  339    H    ASP  49           H        ASP  49   5.082   8.968   2.689
  340    HA   ASP  49           HA       ASP  49   7.876   8.612   3.030
  341    HB2  ASP  49           HB2      ASP  49   6.576  10.588   3.715
  342    HB3  ASP  49           HB3      ASP  49   5.860   9.638   5.026
  343    H    GLU  50           H        GLU  50   5.079   7.084   4.623
  344    HA   GLU  50           HA       GLU  50   6.632   5.674   6.602
  345    HB2  GLU  50           HB2      GLU  50   4.250   6.534   6.883
  346    HB3  GLU  50           HB3      GLU  50   3.732   5.324   5.721
  347    HG2  GLU  50           HG2      GLU  50   3.320   4.348   7.826
  348    HG3  GLU  50           HG3      GLU  50   4.794   3.560   7.273
  349    H    CYS  51           H        CYS  51   4.729   4.929   3.629
  350    HA   CYS  51           HA       CYS  51   5.182   2.209   3.546
  351    HB2  CYS  51           HB2      CYS  51   3.559   3.154   2.132
  352    HB3  CYS  51           HB3      CYS  51   4.723   4.246   1.363
  353    H    ASN  52           H        ASN  52   7.213   4.797   2.126
  354    HA   ASN  52           HA       ASN  52   9.026   2.897   1.040
  355    HB2  ASN  52           HB2      ASN  52  10.115   4.591   0.030
  356    HB3  ASN  52           HB3      ASN  52   8.549   5.345   0.265
  357   HD21  ASN  52          HD21      ASN  52   8.485   7.235   1.405
  358   HD22  ASN  52          HD22      ASN  52   9.941   8.018   2.038
  359    H    ARG  53           H        ARG  53   9.354   5.177   3.814
  360    HA   ARG  53           HA       ARG  53  11.752   4.029   4.627
  361    HB2  ARG  53           HB2      ARG  53  11.722   5.353   6.473
  362    HB3  ARG  53           HB3      ARG  53  10.603   6.169   5.359
  363    HG2  ARG  53           HG2      ARG  53   8.701   5.226   6.631
  364    HG3  ARG  53           HG3      ARG  53   9.805   4.482   7.765
  365    HD2  ARG  53           HD2      ARG  53   8.740   6.721   8.442
  366    HD3  ARG  53           HD3      ARG  53  10.478   6.549   8.697
  367    HE   ARG  53           HE       ARG  53   9.040   8.303   6.843
  368   HH11  ARG  53          HH11      ARG  53  12.296   7.173   7.837
  369   HH12  ARG  53          HH12      ARG  53  13.101   8.383   6.908
  370   HH21  ARG  53          HH21      ARG  53  10.146  10.005   5.817
  371   HH22  ARG  53          HH22      ARG  53  11.878  10.109   5.907
  372    H    THR  54           H        THR  54   8.664   2.532   5.117
  373    HA   THR  54           HA       THR  54   9.791   0.655   7.090
  374    HB   THR  54           HB       THR  54   7.529   1.974   7.108
  375    HG1  THR  54           HG1      THR  54   6.865   0.733   8.600
  376   HG21  THR  54          HG21      THR  54   6.510  -0.590   5.839
  377   HG22  THR  54          HG22      THR  54   6.822   0.855   4.869
  378   HG23  THR  54          HG23      THR  54   5.648   0.942   6.176
  379    H    CYS  55           H        CYS  55   9.413   0.701   3.596
  380    HA   CYS  55           HA       CYS  55   9.853  -2.230   3.576
  381    HB2  CYS  55           HB2      CYS  55   7.907  -0.738   1.774
  382    HB3  CYS  55           HB3      CYS  55   8.277  -2.457   1.704
  383    H    VAL  56           H        VAL  56  10.285   0.872   1.858
  384    HA   VAL  56           HA       VAL  56  11.559  -0.305  -0.450
  385    HB   VAL  56           HB       VAL  56  11.337   2.527   0.599
  386   HG11  VAL  56          HG11      VAL  56  12.621   1.732  -2.014
  387   HG12  VAL  56          HG12      VAL  56  12.257   3.375  -1.451
  388   HG13  VAL  56          HG13      VAL  56  13.480   2.411  -0.604
  389   HG21  VAL  56          HG21      VAL  56   9.901   2.805  -1.391
  390   HG22  VAL  56          HG22      VAL  56  10.244   1.146  -1.902
  391   HG23  VAL  56          HG23      VAL  56   9.298   1.449  -0.438
  392    H    GLY  57           H        GLY  57  13.188  -1.488  -0.164
  393    HA2  GLY  57           HA2      GLY  57  15.193  -1.234   1.916
  394    HA3  GLY  57           HA3      GLY  57  15.055  -2.476   0.666
  Start of MODEL   17
    1    H1   ARG   1           H        ARG   1  12.847  -4.912   2.245
    2    HA   ARG   1           HA       ARG   1  10.626  -4.387   3.056
    3    HB2  ARG   1           HB2      ARG   1   9.227  -5.541   1.113
    4    HB3  ARG   1           HB3      ARG   1  10.197  -4.165   0.870
    5    HG2  ARG   1           HG2      ARG   1  11.251  -6.935   0.231
    6    HG3  ARG   1           HG3      ARG   1  10.186  -6.059  -0.832
    7    HD2  ARG   1           HD2      ARG   1  12.075  -5.339  -1.792
    8    HD3  ARG   1           HD3      ARG   1  11.983  -4.097  -0.563
    9    HE   ARG   1           HE       ARG   1  13.874  -4.900   0.434
   10   HH11  ARG   1          HH11      ARG   1  12.771  -7.343  -1.927
   11   HH12  ARG   1          HH12      ARG   1  14.276  -8.209  -1.898
   12   HH21  ARG   1          HH21      ARG   1  15.824  -6.111   0.471
   13   HH22  ARG   1          HH22      ARG   1  15.959  -7.582  -0.470
   14    HA   PRO   2           HA       PRO   2   8.722  -7.848   5.177
   15    HB2  PRO   2           HB2      PRO   2   6.488  -6.622   6.138
   16    HB3  PRO   2           HB3      PRO   2   8.096  -6.313   6.842
   17    HG2  PRO   2           HG2      PRO   2   6.584  -4.680   4.815
   18    HG3  PRO   2           HG3      PRO   2   7.444  -4.092   6.255
   19    HD2  PRO   2           HD2      PRO   2   8.682  -3.986   3.800
   20    HD3  PRO   2           HD3      PRO   2   9.545  -4.414   5.296
   21    H    ARG   3           H        ARG   3   6.669  -9.142   4.804
   22    HA   ARG   3           HA       ARG   3   5.883  -8.889   1.965
   23    HB2  ARG   3           HB2      ARG   3   4.534 -10.802   3.881
   24    HB3  ARG   3           HB3      ARG   3   4.685 -10.905   2.128
   25    HG2  ARG   3           HG2      ARG   3   6.754 -11.235   4.249
   26    HG3  ARG   3           HG3      ARG   3   6.138 -12.458   3.077
   27    HD2  ARG   3           HD2      ARG   3   7.076 -10.962   1.238
   28    HD3  ARG   3           HD3      ARG   3   7.766  -9.948   2.494
   29    HE   ARG   3           HE       ARG   3   8.776 -12.447   1.473
   30   HH11  ARG   3          HH11      ARG   3   8.825 -10.536   4.501
   31   HH12  ARG   3          HH12      ARG   3  10.537 -10.478   4.572
   32   HH21  ARG   3          HH21      ARG   3  10.993 -12.536   1.707
   33   HH22  ARG   3          HH22      ARG   3  11.854 -11.855   3.058
   34    H    PHE   4           H        PHE   4   4.658  -8.034   4.905
   35    HA   PHE   4           HA       PHE   4   1.846  -8.076   4.331
   36    HB2  PHE   4           HB2      PHE   4   1.398  -6.770   6.125
   37    HB3  PHE   4           HB3      PHE   4   2.731  -7.779   6.649
   38    HD1  PHE   4           HD2      PHE   4   1.743  -4.332   5.492
   39    HD2  PHE   4           HD1      PHE   4   4.649  -6.706   7.636
   40    HE1  PHE   4           HE2      PHE   4   2.915  -2.279   6.176
   41    HE2  PHE   4           HE1      PHE   4   5.831  -4.645   8.308
   42    HZ   PHE   4           HZ       PHE   4   5.012  -2.421   7.514
   43    H    CYS   5           H        CYS   5   4.388  -5.866   3.347
   44    HA   CYS   5           HA       CYS   5   2.320  -3.876   2.730
   45    HB2  CYS   5           HB2      CYS   5   4.144  -2.523   1.725
   46    HB3  CYS   5           HB3      CYS   5   4.166  -2.841   3.459
   47    H    GLU   6           H        GLU   6   3.825  -6.457   1.120
   48    HA   GLU   6           HA       GLU   6   3.089  -5.404  -1.578
   49    HB2  GLU   6           HB2      GLU   6   4.458  -7.171  -2.480
   50    HB3  GLU   6           HB3      GLU   6   5.338  -6.224  -1.254
   51    HG2  GLU   6           HG2      GLU   6   5.152  -7.897   0.362
   52    HG3  GLU   6           HG3      GLU   6   3.989  -8.856  -0.579
   53    H    LEU   7           H        LEU   7   1.253  -6.637   0.654
   54    HA   LEU   7           HA       LEU   7   0.121  -8.973  -0.592
   55    HB2  LEU   7           HB2      LEU   7  -1.081  -7.044   1.432
   56    HB3  LEU   7           HB3      LEU   7  -1.756  -8.623   0.978
   57    HG   LEU   7           HG       LEU   7   0.814  -8.045   2.437
   58   HD11  LEU   7          HD11      LEU   7  -1.665  -9.596   3.293
   59   HD12  LEU   7          HD12      LEU   7  -1.308  -7.910   3.720
   60   HD13  LEU   7          HD13      LEU   7  -0.251  -9.204   4.299
   61   HD21  LEU   7          HD21      LEU   7  -0.155 -10.808   1.650
   62   HD22  LEU   7          HD22      LEU   7   1.238 -10.429   2.700
   63   HD23  LEU   7          HD23      LEU   7   1.300  -9.983   1.020
   64    H    ALA   8           H        ALA   8  -2.303  -8.832  -1.091
   65    HA   ALA   8           HA       ALA   8  -2.578  -6.904  -3.358
   66    HB1  ALA   8           HB1      ALA   8  -4.372  -8.444  -4.105
   67    HB2  ALA   8           HB2      ALA   8  -2.768  -9.198  -4.020
   68    HB3  ALA   8           HB3      ALA   8  -3.980  -9.529  -2.747
   69    HA   PRO   9           HA       PRO   9  -5.257  -5.064  -0.171
   70    HB2  PRO   9           HB2      PRO   9  -5.835  -2.707  -1.375
   71    HB3  PRO   9           HB3      PRO   9  -4.296  -3.044  -0.528
   72    HG2  PRO   9           HG2      PRO   9  -4.856  -3.279  -3.510
   73    HG3  PRO   9           HG3      PRO   9  -3.490  -2.462  -2.726
   74    HD2  PRO   9           HD2      PRO   9  -3.212  -4.963  -3.648
   75    HD3  PRO   9           HD3      PRO   9  -2.471  -4.493  -2.101
   76    H    SER  10           H        SER  10  -7.144  -6.296  -0.212
   77    HA   SER  10           HA       SER  10  -8.781  -6.597  -2.528
   78    HB2  SER  10           HB2      SER  10  -8.457  -8.342  -0.805
   79    HB3  SER  10           HB3      SER  10  -9.294  -7.337   0.378
   80    HG   SER  10           HG       SER  10 -10.501  -8.316  -2.036
   81    H    ALA  11           H        ALA  11  -8.837  -4.178  -2.797
   82    HA   ALA  11           HA       ALA  11 -10.370  -2.417  -1.181
   83    HB1  ALA  11           HB1      ALA  11  -9.666  -2.241  -4.125
   84    HB2  ALA  11           HB2      ALA  11 -10.119  -0.886  -3.072
   85    HB3  ALA  11           HB3      ALA  11  -8.589  -1.758  -2.790
   86    H    GLY  12           H        GLY  12 -11.621  -4.987  -2.823
   87    HA2  GLY  12           HA2      GLY  12 -14.074  -3.611  -3.838
   88    HA3  GLY  12           HA3      GLY  12 -13.513  -5.228  -4.277
   89    H    SER  13           H        SER  13 -12.975  -5.008  -0.984
   90    HA   SER  13           HA       SER  13 -14.862  -6.910  -0.348
   91    HB2  SER  13           HB2      SER  13 -12.708  -6.094   0.857
   92    HB3  SER  13           HB3      SER  13 -13.771  -4.955   1.690
   93    HG   SER  13           HG       SER  13 -13.912  -7.788   1.556
   94    H    CYS  14           H        CYS  14 -15.299  -3.392  -0.158
   95    HA   CYS  14           HA       CYS  14 -18.180  -3.703   0.045
   96    HB2  CYS  14           HB2      CYS  14 -16.613  -1.993   2.027
   97    HB3  CYS  14           HB3      CYS  14 -18.353  -2.011   1.810
   98    H    PHE  15           H        PHE  15 -19.158  -1.530  -0.484
   99    HA   PHE  15           HA       PHE  15 -17.480  -0.222  -2.527
  100    HB2  PHE  15           HB2      PHE  15 -19.768  -0.848  -3.087
  101    HB3  PHE  15           HB3      PHE  15 -20.379   0.057  -1.722
  102    HD1  PHE  15           HD1      PHE  15 -20.160   2.676  -1.740
  103    HD2  PHE  15           HD2      PHE  15 -19.322   0.204  -5.179
  104    HE1  PHE  15           HE1      PHE  15 -20.140   4.664  -3.178
  105    HE2  PHE  15           HE2      PHE  15 -19.533   2.176  -6.633
  106    HZ   PHE  15           HZ       PHE  15 -19.863   4.421  -5.643
  107    H    ALA  16           H        ALA  16 -16.116   1.260  -1.805
  108    HA   ALA  16           HA       ALA  16 -17.066   3.520  -0.282
  109    HB1  ALA  16           HB1      ALA  16 -16.386   2.149   1.583
  110    HB2  ALA  16           HB2      ALA  16 -14.905   1.646   0.755
  111    HB3  ALA  16           HB3      ALA  16 -15.083   3.329   1.330
  112    H    PHE  17           H        PHE  17 -15.321   5.201  -0.274
  113    HA   PHE  17           HA       PHE  17 -13.332   4.878  -2.470
  114    HB2  PHE  17           HB2      PHE  17 -15.122   6.075  -3.505
  115    HB3  PHE  17           HB3      PHE  17 -15.310   7.139  -2.101
  116    HD1  PHE  17           HD2      PHE  17 -12.226   6.090  -4.053
  117    HD2  PHE  17           HD1      PHE  17 -14.766   9.351  -2.778
  118    HE1  PHE  17           HE2      PHE  17 -10.585   7.712  -4.919
  119    HE2  PHE  17           HE1      PHE  17 -13.130  10.957  -3.694
  120    HZ   PHE  17           HZ       PHE  17 -11.021  10.141  -4.745
  121    H    VAL  18           H        VAL  18 -11.550   4.761  -1.108
  122    HA   VAL  18           HA       VAL  18 -10.936   7.179   0.429
  123    HB   VAL  18           HB       VAL  18 -10.003   5.648   2.275
  124   HG11  VAL  18          HG11      VAL  18 -13.017   6.046   2.094
  125   HG12  VAL  18          HG12      VAL  18 -12.024   5.946   3.558
  126   HG13  VAL  18          HG13      VAL  18 -11.854   7.327   2.469
  127   HG21  VAL  18          HG21      VAL  18 -12.247   3.821   1.275
  128   HG22  VAL  18          HG22      VAL  18 -10.517   3.440   1.256
  129   HG23  VAL  18          HG23      VAL  18 -11.355   3.654   2.800
  130    HA   PRO  19           HA       PRO  19  -7.600   5.819  -2.310
  131    HB2  PRO  19           HB2      PRO  19  -6.203   8.166  -2.531
  132    HB3  PRO  19           HB3      PRO  19  -7.709   7.810  -3.442
  133    HG2  PRO  19           HG2      PRO  19  -7.418   9.415  -0.896
  134    HG3  PRO  19           HG3      PRO  19  -8.349   9.831  -2.370
  135    HD2  PRO  19           HD2      PRO  19  -9.490   8.698  -0.141
  136    HD3  PRO  19           HD3      PRO  19 -10.078   8.338  -1.801
  137    H    SER  20           H        SER  20  -5.866   4.747  -1.591
  138    HA   SER  20           HA       SER  20  -4.308   5.773   0.689
  139    HB2  SER  20           HB2      SER  20  -5.835   4.298   1.677
  140    HB3  SER  20           HB3      SER  20  -5.580   3.075   0.451
  141    HG   SER  20           HG       SER  20  -3.572   3.954   2.268
  142    H    TYR  21           H        TYR  21  -2.267   3.868   0.763
  143    HA   TYR  21           HA       TYR  21  -0.964   4.315  -1.905
  144    HB2  TYR  21           HB2      TYR  21  -0.025   4.802   0.868
  145    HB3  TYR  21           HB3      TYR  21   1.123   4.013  -0.216
  146    HD1  TYR  21           HD1      TYR  21  -0.904   7.045   0.332
  147    HD2  TYR  21           HD2      TYR  21   2.203   5.211  -2.052
  148    HE1  TYR  21           HE1      TYR  21  -0.433   9.186  -0.709
  149    HE2  TYR  21           HE2      TYR  21   2.618   7.353  -3.155
  150    HH   TYR  21           HH       TYR  21   0.758  10.329  -2.418
  151    H    TYR  22           H        TYR  22  -0.013   2.776  -2.927
  152    HA   TYR  22           HA       TYR  22  -0.117  -0.011  -1.912
  153    HB2  TYR  22           HB2      TYR  22  -1.256   0.890  -4.131
  154    HB3  TYR  22           HB3      TYR  22   0.350   0.979  -4.755
  155    HD1  TYR  22           HD1      TYR  22   1.814  -1.216  -4.643
  156    HD2  TYR  22           HD2      TYR  22  -2.484  -1.045  -4.399
  157    HE1  TYR  22           HE1      TYR  22   1.724  -3.616  -5.127
  158    HE2  TYR  22           HE2      TYR  22  -2.591  -3.435  -5.081
  159    HH   TYR  22           HH       TYR  22   0.333  -5.480  -5.131
  160    H    TYR  23           H        TYR  23   1.835  -1.030  -1.515
  161    HA   TYR  23           HA       TYR  23   4.355   0.386  -2.172
  162    HB2  TYR  23           HB2      TYR  23   4.205  -0.626   0.033
  163    HB3  TYR  23           HB3      TYR  23   3.747  -2.154  -0.682
  164    HD1  TYR  23           HD1      TYR  23   6.570   0.306  -1.166
  165    HD2  TYR  23           HD2      TYR  23   5.356  -3.808  -0.756
  166    HE1  TYR  23           HE1      TYR  23   8.906  -0.407  -1.441
  167    HE2  TYR  23           HE2      TYR  23   7.735  -4.522  -0.910
  168    HH   TYR  23           HH       TYR  23  10.315  -2.522  -0.641
  169    H    ASN  24           H        ASN  24   5.510   0.004  -4.018
  170    HA   ASN  24           HA       ASN  24   4.913  -2.488  -5.551
  171    HB2  ASN  24           HB2      ASN  24   6.094   0.109  -6.578
  172    HB3  ASN  24           HB3      ASN  24   5.874  -1.386  -7.489
  173   HD21  ASN  24          HD21      ASN  24   3.344  -2.277  -7.186
  174   HD22  ASN  24          HD22      ASN  24   2.193  -0.975  -7.446
  175    H    GLN  25           H        GLN  25   6.259  -3.764  -4.401
  176    HA   GLN  25           HA       GLN  25   8.936  -3.449  -3.729
  177    HB2  GLN  25           HB2      GLN  25   8.986  -5.857  -3.528
  178    HB3  GLN  25           HB3      GLN  25   7.440  -5.256  -2.955
  179    HG2  GLN  25           HG2      GLN  25   7.965  -6.810  -5.490
  180    HG3  GLN  25           HG3      GLN  25   7.030  -7.253  -4.061
  181   HE21  GLN  25          HE21      GLN  25   4.920  -5.866  -3.700
  182   HE22  GLN  25          HE22      GLN  25   4.175  -5.194  -5.135
  183    H    TYR  26           H        TYR  26   7.533  -4.548  -6.875
  184    HA   TYR  26           HA       TYR  26   9.964  -5.239  -8.080
  185    HB2  TYR  26           HB2      TYR  26   7.420  -4.148  -9.333
  186    HB3  TYR  26           HB3      TYR  26   8.747  -4.852 -10.230
  187    HD1  TYR  26           HD2      TYR  26   9.491  -7.326  -8.891
  188    HD2  TYR  26           HD1      TYR  26   5.577  -5.577  -9.500
  189    HE1  TYR  26           HE2      TYR  26   8.474  -9.567  -8.822
  190    HE2  TYR  26           HE1      TYR  26   4.552  -7.795  -9.324
  191    HH   TYR  26           HH       TYR  26   6.538 -10.801  -9.211
  192    H    SER  27           H        SER  27   8.477  -2.121  -7.586
  193    HA   SER  27           HA       SER  27  10.674  -0.882  -9.199
  194    HB2  SER  27           HB2      SER  27   8.277  -0.620  -9.897
  195    HB3  SER  27           HB3      SER  27   8.030   0.397  -8.478
  196    HG   SER  27           HG       SER  27  10.108   0.855 -10.366
  197    H    ASN  28           H        ASN  28  10.210  -1.669  -6.083
  198    HA   ASN  28           HA       ASN  28  10.850  -0.962  -4.078
  199    HB2  ASN  28           HB2      ASN  28  12.993  -1.382  -5.368
  200    HB3  ASN  28           HB3      ASN  28  13.072   0.340  -5.719
  201   HD21  ASN  28          HD21      ASN  28  12.552  -1.716  -2.736
  202   HD22  ASN  28          HD22      ASN  28  13.854  -0.877  -1.891
  203    H    THR  29           H        THR  29   8.782   0.568  -4.913
  204    HA   THR  29           HA       THR  29   9.259   3.086  -3.574
  205    HB   THR  29           HB       THR  29   9.941   3.553  -5.934
  206    HG1  THR  29           HG1      THR  29   9.229   5.459  -5.561
  207   HG21  THR  29          HG21      THR  29   8.279   3.736  -7.695
  208   HG22  THR  29          HG22      THR  29   6.994   3.137  -6.635
  209   HG23  THR  29          HG23      THR  29   8.329   2.070  -7.122
  210    H    CYS  30           H        CYS  30   6.858   4.280  -4.161
  211    HA   CYS  30           HA       CYS  30   4.752   2.295  -3.573
  212    HB2  CYS  30           HB2      CYS  30   5.903   3.672  -1.505
  213    HB3  CYS  30           HB3      CYS  30   4.728   4.870  -2.063
  214    H    HIS  31           H        HIS  31   2.654   3.170  -4.179
  215    HA   HIS  31           HA       HIS  31   2.652   5.796  -5.492
  216    HB2  HIS  31           HB2      HIS  31   3.351   3.816  -7.113
  217    HB3  HIS  31           HB3      HIS  31   1.642   3.403  -7.055
  218    HD1  HIS  31           HD1      HIS  31   1.099   4.167  -9.582
  219    HD2  HIS  31           HD2      HIS  31   3.249   6.953  -7.259
  220    HE1  HIS  31           HE1      HIS  31   1.252   6.281 -10.970
  221    H    SER  32           H        SER  32   0.519   6.739  -5.487
  222    HA   SER  32           HA       SER  32  -1.188   5.605  -3.501
  223    HB2  SER  32           HB2      SER  32  -2.704   7.450  -4.300
  224    HB3  SER  32           HB3      SER  32  -1.154   7.933  -3.604
  225    HG   SER  32           HG       SER  32  -1.778   8.938  -5.709
  226    H    PHE  33           H        PHE  33  -3.153   4.590  -3.719
  227    HA   PHE  33           HA       PHE  33  -4.219   3.903  -6.351
  228    HB2  PHE  33           HB2      PHE  33  -4.210   1.645  -6.110
  229    HB3  PHE  33           HB3      PHE  33  -2.615   2.063  -5.530
  230    HD1  PHE  33           HD2      PHE  33  -2.475   2.379  -2.884
  231    HD2  PHE  33           HD1      PHE  33  -5.566   0.181  -4.896
  232    HE1  PHE  33           HE2      PHE  33  -2.916   1.039  -0.793
  233    HE2  PHE  33           HE1      PHE  33  -6.113  -0.978  -2.804
  234    HZ   PHE  33           HZ       PHE  33  -4.700  -0.556  -0.709
  235    H    THR  34           H        THR  34  -6.386   2.443  -5.618
  236    HA   THR  34           HA       THR  34  -7.884   4.265  -3.778
  237    HB   THR  34           HB       THR  34  -9.810   3.171  -5.171
  238    HG1  THR  34           HG1      THR  34  -9.272   2.247  -6.944
  239   HG21  THR  34          HG21      THR  34  -9.700   5.014  -6.787
  240   HG22  THR  34          HG22      THR  34  -7.992   5.294  -6.390
  241   HG23  THR  34          HG23      THR  34  -9.257   5.582  -5.172
  242    H    TYR  35           H        TYR  35  -8.674   3.440  -1.844
  243    HA   TYR  35           HA       TYR  35  -8.669   0.517  -1.537
  244    HB2  TYR  35           HB2      TYR  35  -6.990   1.693  -0.301
  245    HB3  TYR  35           HB3      TYR  35  -8.194   2.643   0.537
  246    HD1  TYR  35           HD1      TYR  35  -7.106  -0.903  -0.075
  247    HD2  TYR  35           HD2      TYR  35  -8.827   1.951   2.680
  248    HE1  TYR  35           HE1      TYR  35  -6.960  -2.556   1.745
  249    HE2  TYR  35           HE2      TYR  35  -8.818   0.275   4.442
  250    HH   TYR  35           HH       TYR  35  -8.628  -2.827   4.210
  251    H    SER  36           H        SER  36 -10.225  -0.055   0.585
  252    HA   SER  36           HA       SER  36 -12.780   1.413   0.368
  253    HB2  SER  36           HB2      SER  36 -13.898  -0.821   0.653
  254    HB3  SER  36           HB3      SER  36 -13.071  -0.620  -0.892
  255    HG   SER  36           HG       SER  36 -12.215  -2.132   1.384
  256    H    GLY  37           H        GLY  37 -13.916   1.570   2.426
  257    HA2  GLY  37           HA2      GLY  37 -12.390   1.756   4.736
  258    HA3  GLY  37           HA3      GLY  37 -14.155   1.561   4.685
  259    H    CYS  38           H        CYS  38 -14.660  -0.911   3.840
  260    HA   CYS  38           HA       CYS  38 -13.610  -2.561   6.030
  261    HB2  CYS  38           HB2      CYS  38 -15.515  -3.715   5.855
  262    HB3  CYS  38           HB3      CYS  38 -16.086  -2.340   4.928
  263    H    GLY  39           H        GLY  39 -12.951  -4.779   5.601
  264    HA2  GLY  39           HA2      GLY  39 -11.564  -6.347   4.766
  265    HA3  GLY  39           HA3      GLY  39 -12.163  -5.899   3.178
  266    H    GLY  40           H        GLY  40 -10.351  -6.155   2.088
  267    HA2  GLY  40           HA2      GLY  40  -8.506  -5.214   1.031
  268    HA3  GLY  40           HA3      GLY  40  -8.354  -4.038   2.327
  269    H    ASN  41           H        ASN  41  -6.001  -4.756   1.932
  270    HA   ASN  41           HA       ASN  41  -5.343  -6.872   3.907
  271    HB2  ASN  41           HB2      ASN  41  -4.271  -6.746   1.070
  272    HB3  ASN  41           HB3      ASN  41  -3.256  -7.293   2.369
  273   HD21  ASN  41          HD21      ASN  41  -5.468  -8.494   0.154
  274   HD22  ASN  41          HD22      ASN  41  -5.869  -9.981   0.977
  275    H    ALA  42           H        ALA  42  -3.020  -6.698   4.554
  276    HA   ALA  42           HA       ALA  42  -2.552  -4.204   5.688
  277    HB1  ALA  42           HB1      ALA  42  -1.728  -6.308   6.584
  278    HB2  ALA  42           HB2      ALA  42  -0.580  -6.449   5.225
  279    HB3  ALA  42           HB3      ALA  42  -0.413  -5.138   6.406
  280    H    ASN  43           H        ASN  43  -1.940  -4.888   2.374
  281    HA   ASN  43           HA       ASN  43   0.447  -3.476   1.867
  282    HB2  ASN  43           HB2      ASN  43  -0.323  -4.697   0.085
  283    HB3  ASN  43           HB3      ASN  43  -2.019  -4.304   0.381
  284   HD21  ASN  43          HD21      ASN  43   0.500  -3.712  -1.778
  285   HD22  ASN  43          HD22      ASN  43  -0.385  -2.452  -2.604
  286    H    ARG  44           H        ARG  44  -2.495  -2.203   3.043
  287    HA   ARG  44           HA       ARG  44  -2.535   0.354   1.878
  288    HB2  ARG  44           HB2      ARG  44  -4.379  -0.737   3.224
  289    HB3  ARG  44           HB3      ARG  44  -3.380  -0.627   4.652
  290    HG2  ARG  44           HG2      ARG  44  -3.520   2.058   4.040
  291    HG3  ARG  44           HG3      ARG  44  -5.051   1.503   3.387
  292    HD2  ARG  44           HD2      ARG  44  -4.083   1.126   6.178
  293    HD3  ARG  44           HD3      ARG  44  -5.265   2.317   5.574
  294    HE   ARG  44           HE       ARG  44  -6.081  -0.210   4.681
  295   HH11  ARG  44          HH11      ARG  44  -5.729   1.625   7.724
  296   HH12  ARG  44          HH12      ARG  44  -7.157   0.966   8.485
  297   HH21  ARG  44          HH21      ARG  44  -7.848  -1.322   5.894
  298   HH22  ARG  44          HH22      ARG  44  -8.306  -0.741   7.481
  299    H    PHE  45           H        PHE  45  -1.681   2.203   2.291
  300    HA   PHE  45           HA       PHE  45  -0.244   2.854   4.778
  301    HB2  PHE  45           HB2      PHE  45   0.862   3.099   1.962
  302    HB3  PHE  45           HB3      PHE  45   1.467   4.089   3.294
  303    HD1  PHE  45           HD1      PHE  45   2.350   2.905   5.391
  304    HD2  PHE  45           HD2      PHE  45   1.589   0.879   1.659
  305    HE1  PHE  45           HE1      PHE  45   3.633   0.964   6.189
  306    HE2  PHE  45           HE2      PHE  45   2.932  -1.000   2.398
  307    HZ   PHE  45           HZ       PHE  45   4.033  -0.980   4.672
  308    H    ARG  46           H        ARG  46  -0.045   5.179   5.079
  309    HA   ARG  46           HA       ARG  46  -2.298   6.680   3.817
  310    HB2  ARG  46           HB2      ARG  46  -1.752   8.319   5.801
  311    HB3  ARG  46           HB3      ARG  46  -2.791   6.934   5.986
  312    HG2  ARG  46           HG2      ARG  46  -1.255   7.290   7.875
  313    HG3  ARG  46           HG3      ARG  46  -1.185   5.685   7.174
  314    HD2  ARG  46           HD2      ARG  46   1.013   6.353   7.755
  315    HD3  ARG  46           HD3      ARG  46   0.959   6.360   6.015
  316    HE   ARG  46           HE       ARG  46   0.949   8.736   5.961
  317   HH11  ARG  46          HH11      ARG  46   2.029   7.248   9.051
  318   HH12  ARG  46          HH12      ARG  46   2.434   8.748   9.762
  319   HH21  ARG  46          HH21      ARG  46   1.810  10.716   6.901
  320   HH22  ARG  46          HH22      ARG  46   2.802  10.532   8.327
  321    H    THR  47           H        THR  47   1.097   6.381   3.689
  322    HA   THR  47           HA       THR  47   1.254   8.495   1.833
  323    HB   THR  47           HB       THR  47   1.461   9.737   4.033
  324    HG1  THR  47           HG1      THR  47   2.410  10.701   2.354
  325   HG21  THR  47          HG21      THR  47   4.126   8.324   4.216
  326   HG22  THR  47          HG22      THR  47   2.758   7.727   5.080
  327   HG23  THR  47          HG23      THR  47   3.386   9.375   5.431
  328    H    ILE  48           H        ILE  48   3.320   8.605   0.740
  329    HA   ILE  48           HA       ILE  48   4.517   5.998   0.413
  330    HB   ILE  48           HB       ILE  48   4.322   7.341  -1.519
  331   HG12  ILE  48          HG12      ILE  48   7.271   7.374  -0.755
  332   HG13  ILE  48          HG13      ILE  48   6.396   5.937  -1.206
  333   HG21  ILE  48          HG21      ILE  48   5.973   9.524  -0.174
  334   HG22  ILE  48          HG22      ILE  48   5.395   9.545  -1.846
  335   HG23  ILE  48          HG23      ILE  48   4.232   9.618  -0.537
  336   HD11  ILE  48          HD11      ILE  48   7.546   6.671  -3.164
  337   HD12  ILE  48          HD12      ILE  48   5.831   7.044  -3.426
  338   HD13  ILE  48          HD13      ILE  48   6.966   8.333  -2.989
  339    H    ASP  49           H        ASP  49   5.169   8.896   2.341
  340    HA   ASP  49           HA       ASP  49   7.917   8.574   2.870
  341    HB2  ASP  49           HB2      ASP  49   5.697   9.809   4.524
  342    HB3  ASP  49           HB3      ASP  49   7.376   9.782   5.023
  343    H    GLU  50           H        GLU  50   5.093   6.928   4.235
  344    HA   GLU  50           HA       GLU  50   6.619   5.618   6.385
  345    HB2  GLU  50           HB2      GLU  50   3.763   5.414   5.353
  346    HB3  GLU  50           HB3      GLU  50   4.384   4.400   6.668
  347    HG2  GLU  50           HG2      GLU  50   4.765   7.393   6.929
  348    HG3  GLU  50           HG3      GLU  50   3.153   6.736   7.043
  349    H    CYS  51           H        CYS  51   4.836   4.813   3.398
  350    HA   CYS  51           HA       CYS  51   5.323   2.100   3.295
  351    HB2  CYS  51           HB2      CYS  51   3.768   3.374   1.906
  352    HB3  CYS  51           HB3      CYS  51   5.129   4.164   1.099
  353    H    ASN  52           H        ASN  52   7.408   4.767   2.082
  354    HA   ASN  52           HA       ASN  52   9.314   2.926   1.033
  355    HB2  ASN  52           HB2      ASN  52  10.470   4.663   0.131
  356    HB3  ASN  52           HB3      ASN  52   8.850   5.314   0.168
  357   HD21  ASN  52          HD21      ASN  52   8.669   7.313   1.030
  358   HD22  ASN  52          HD22      ASN  52   9.955   8.156   1.857
  359    H    ARG  53           H        ARG  53   9.430   5.132   3.855
  360    HA   ARG  53           HA       ARG  53  11.849   4.124   4.786
  361    HB2  ARG  53           HB2      ARG  53  11.530   5.253   6.768
  362    HB3  ARG  53           HB3      ARG  53  10.486   6.134   5.648
  363    HG2  ARG  53           HG2      ARG  53   8.566   4.767   6.574
  364    HG3  ARG  53           HG3      ARG  53   9.661   4.147   7.802
  365    HD2  ARG  53           HD2      ARG  53   8.890   7.061   7.350
  366    HD3  ARG  53           HD3      ARG  53   8.299   6.010   8.654
  367    HE   ARG  53           HE       ARG  53  11.095   6.004   8.853
  368   HH11  ARG  53          HH11      ARG  53   8.489   8.426   9.275
  369   HH12  ARG  53          HH12      ARG  53   9.553   9.596   9.955
  370   HH21  ARG  53          HH21      ARG  53  12.371   7.386   9.920
  371   HH22  ARG  53          HH22      ARG  53  11.793   8.848  10.682
  372    H    THR  54           H        THR  54   8.796   2.480   5.016
  373    HA   THR  54           HA       THR  54   9.867   0.486   6.888
  374    HB   THR  54           HB       THR  54   7.616   1.831   6.897
  375    HG1  THR  54           HG1      THR  54   6.826   0.491   8.263
  376   HG21  THR  54          HG21      THR  54   6.835   0.807   4.686
  377   HG22  THR  54          HG22      THR  54   5.739   0.792   6.056
  378   HG23  THR  54          HG23      THR  54   6.597  -0.707   5.604
  379    H    CYS  55           H        CYS  55   9.180   0.662   3.365
  380    HA   CYS  55           HA       CYS  55   9.907  -2.233   3.222
  381    HB2  CYS  55           HB2      CYS  55   7.819  -0.819   1.526
  382    HB3  CYS  55           HB3      CYS  55   8.340  -2.498   1.409
  383    H    VAL  56           H        VAL  56  10.594   0.914   1.994
  384    HA   VAL  56           HA       VAL  56  11.782  -0.177  -0.505
  385    HB   VAL  56           HB       VAL  56  11.522   2.615   0.583
  386   HG11  VAL  56          HG11      VAL  56  13.648   2.483  -0.681
  387   HG12  VAL  56          HG12      VAL  56  12.719   1.900  -2.084
  388   HG13  VAL  56          HG13      VAL  56  12.421   3.519  -1.390
  389   HG21  VAL  56          HG21      VAL  56   9.472   1.513  -0.444
  390   HG22  VAL  56          HG22      VAL  56  10.045   2.886  -1.400
  391   HG23  VAL  56          HG23      VAL  56  10.416   1.225  -1.901
  392    H    GLY  57           H        GLY  57  13.186  -1.644   0.396
  393    HA2  GLY  57           HA2      GLY  57  15.772  -1.289   0.622
  394    HA3  GLY  57           HA3      GLY  57  15.291  -0.729   2.237
  Start of MODEL   18
    1    H1   ARG   1           H        ARG   1  12.916  -5.159   2.644
    2    HA   ARG   1           HA       ARG   1  10.756  -4.369   3.180
    3    HB2  ARG   1           HB2      ARG   1   9.443  -4.904   1.089
    4    HB3  ARG   1           HB3      ARG   1  10.998  -4.137   0.931
    5    HG2  ARG   1           HG2      ARG   1  11.269  -7.055   0.619
    6    HG3  ARG   1           HG3      ARG   1  10.090  -6.362  -0.463
    7    HD2  ARG   1           HD2      ARG   1  12.241  -6.360  -1.580
    8    HD3  ARG   1           HD3      ARG   1  11.679  -4.729  -1.328
    9    HE   ARG   1           HE       ARG   1  13.443  -4.246   0.036
   10   HH11  ARG   1          HH11      ARG   1  13.652  -7.720  -0.803
   11   HH12  ARG   1          HH12      ARG   1  15.300  -7.835  -0.243
   12   HH21  ARG   1          HH21      ARG   1  15.580  -4.390   0.491
   13   HH22  ARG   1          HH22      ARG   1  16.426  -5.923   0.477
   14    HA   PRO   2           HA       PRO   2   8.856  -7.564   5.557
   15    HB2  PRO   2           HB2      PRO   2   6.637  -6.255   6.477
   16    HB3  PRO   2           HB3      PRO   2   8.284  -5.987   7.119
   17    HG2  PRO   2           HG2      PRO   2   6.831  -4.398   5.002
   18    HG3  PRO   2           HG3      PRO   2   7.652  -3.782   6.457
   19    HD2  PRO   2           HD2      PRO   2   8.966  -3.778   4.075
   20    HD3  PRO   2           HD3      PRO   2   9.828  -4.302   5.553
   21    H    ARG   3           H        ARG   3   7.380  -9.122   5.198
   22    HA   ARG   3           HA       ARG   3   6.313  -9.366   2.617
   23    HB2  ARG   3           HB2      ARG   3   5.559 -11.465   3.211
   24    HB3  ARG   3           HB3      ARG   3   6.998 -11.193   4.167
   25    HG2  ARG   3           HG2      ARG   3   5.618 -12.243   5.662
   26    HG3  ARG   3           HG3      ARG   3   5.400 -10.552   6.106
   27    HD2  ARG   3           HD2      ARG   3   3.354 -11.922   6.152
   28    HD3  ARG   3           HD3      ARG   3   3.200 -10.522   5.107
   29    HE   ARG   3           HE       ARG   3   3.862 -12.249   3.235
   30   HH11  ARG   3          HH11      ARG   3   1.851 -13.148   6.024
   31   HH12  ARG   3          HH12      ARG   3   0.646 -13.928   5.043
   32   HH21  ARG   3          HH21      ARG   3   2.488 -13.408   2.049
   33   HH22  ARG   3          HH22      ARG   3   1.096 -14.229   2.681
   34    H    PHE   4           H        PHE   4   4.808  -7.820   5.387
   35    HA   PHE   4           HA       PHE   4   2.130  -8.268   4.372
   36    HB2  PHE   4           HB2      PHE   4   1.385  -6.835   6.064
   37    HB3  PHE   4           HB3      PHE   4   2.736  -7.715   6.744
   38    HD1  PHE   4           HD2      PHE   4   1.742  -4.454   5.209
   39    HD2  PHE   4           HD1      PHE   4   4.584  -6.561   7.677
   40    HE1  PHE   4           HE2      PHE   4   2.740  -2.310   5.906
   41    HE2  PHE   4           HE1      PHE   4   5.649  -4.409   8.275
   42    HZ   PHE   4           HZ       PHE   4   4.754  -2.279   7.365
   43    H    CYS   5           H        CYS   5   4.711  -6.070   3.498
   44    HA   CYS   5           HA       CYS   5   3.105  -4.019   2.340
   45    HB2  CYS   5           HB2      CYS   5   5.692  -4.389   3.215
   46    HB3  CYS   5           HB3      CYS   5   5.948  -4.567   1.497
   47    H    GLU   6           H        GLU   6   4.001  -7.196   1.223
   48    HA   GLU   6           HA       GLU   6   3.706  -6.279  -1.623
   49    HB2  GLU   6           HB2      GLU   6   4.877  -8.168  -2.284
   50    HB3  GLU   6           HB3      GLU   6   5.699  -7.537  -0.862
   51    HG2  GLU   6           HG2      GLU   6   3.875  -9.417   0.199
   52    HG3  GLU   6           HG3      GLU   6   4.322 -10.143  -1.328
   53    H    LEU   7           H        LEU   7   1.549  -7.106   0.535
   54    HA   LEU   7           HA       LEU   7   0.146  -9.263  -0.793
   55    HB2  LEU   7           HB2      LEU   7  -0.889  -7.357   1.302
   56    HB3  LEU   7           HB3      LEU   7  -1.528  -8.964   0.893
   57    HG   LEU   7           HG       LEU   7   1.140  -8.351   2.230
   58   HD11  LEU   7          HD11      LEU   7  -1.347  -9.712   3.323
   59   HD12  LEU   7          HD12      LEU   7  -0.822  -8.055   3.692
   60   HD13  LEU   7          HD13      LEU   7   0.170  -9.441   4.197
   61   HD21  LEU   7          HD21      LEU   7   1.370 -10.396   0.888
   62   HD22  LEU   7          HD22      LEU   7  -0.046 -11.086   1.740
   63   HD23  LEU   7          HD23      LEU   7   1.459 -10.684   2.626
   64    H    ALA   8           H        ALA   8  -2.320  -8.934  -1.301
   65    HA   ALA   8           HA       ALA   8  -2.531  -6.745  -3.282
   66    HB1  ALA   8           HB1      ALA   8  -4.425  -8.099  -4.095
   67    HB2  ALA   8           HB2      ALA   8  -2.847  -8.917  -4.195
   68    HB3  ALA   8           HB3      ALA   8  -4.010  -9.341  -2.915
   69    HA   PRO   9           HA       PRO   9  -5.390  -5.104  -0.095
   70    HB2  PRO   9           HB2      PRO   9  -5.256  -2.487  -0.681
   71    HB3  PRO   9           HB3      PRO   9  -3.846  -3.347  -0.008
   72    HG2  PRO   9           HG2      PRO   9  -4.401  -2.701  -2.930
   73    HG3  PRO   9           HG3      PRO   9  -2.890  -2.442  -2.005
   74    HD2  PRO   9           HD2      PRO   9  -3.428  -4.670  -3.589
   75    HD3  PRO   9           HD3      PRO   9  -2.304  -4.694  -2.208
   76    H    SER  10           H        SER  10  -6.925  -6.481  -1.346
   77    HA   SER  10           HA       SER  10  -8.480  -5.594  -3.507
   78    HB2  SER  10           HB2      SER  10  -8.512  -7.930  -2.593
   79    HB3  SER  10           HB3      SER  10  -9.467  -7.360  -1.224
   80    HG   SER  10           HG       SER  10 -10.229  -8.040  -3.699
   81    H    ALA  11           H        ALA  11  -9.477  -3.664  -3.546
   82    HA   ALA  11           HA       ALA  11 -10.481  -2.410  -1.118
   83    HB1  ALA  11           HB1      ALA  11  -9.512  -1.076  -2.946
   84    HB2  ALA  11           HB2      ALA  11 -10.851  -1.595  -4.006
   85    HB3  ALA  11           HB3      ALA  11 -11.182  -0.589  -2.586
   86    H    GLY  12           H        GLY  12 -11.752  -4.683  -3.354
   87    HA2  GLY  12           HA2      GLY  12 -14.509  -3.940  -3.235
   88    HA3  GLY  12           HA3      GLY  12 -13.862  -5.510  -3.692
   89    H    SER  13           H        SER  13 -12.619  -5.143  -0.639
   90    HA   SER  13           HA       SER  13 -14.308  -7.037   0.493
   91    HB2  SER  13           HB2      SER  13 -12.512  -5.002   1.846
   92    HB3  SER  13           HB3      SER  13 -13.226  -6.412   2.642
   93    HG   SER  13           HG       SER  13 -11.260  -7.061   1.976
   94    H    CYS  14           H        CYS  14 -14.755  -3.506   0.519
   95    HA   CYS  14           HA       CYS  14 -17.481  -3.708   1.499
   96    HB2  CYS  14           HB2      CYS  14 -15.296  -2.213   2.994
   97    HB3  CYS  14           HB3      CYS  14 -17.013  -1.929   3.210
   98    H    PHE  15           H        PHE  15 -18.608  -1.814   0.616
   99    HA   PHE  15           HA       PHE  15 -16.995  -0.498  -1.457
  100    HB2  PHE  15           HB2      PHE  15 -19.235  -1.400  -1.894
  101    HB3  PHE  15           HB3      PHE  15 -19.915  -0.310  -0.712
  102    HD1  PHE  15           HD1      PHE  15 -19.634   2.349  -1.224
  103    HD2  PHE  15           HD2      PHE  15 -19.087  -0.787  -4.136
  104    HE1  PHE  15           HE1      PHE  15 -19.832   3.978  -3.008
  105    HE2  PHE  15           HE2      PHE  15 -19.495   0.855  -5.951
  106    HZ   PHE  15           HZ       PHE  15 -19.846   3.251  -5.400
  107    H    ALA  16           H        ALA  16 -15.751   1.125  -0.837
  108    HA   ALA  16           HA       ALA  16 -16.922   3.544   0.248
  109    HB1  ALA  16           HB1      ALA  16 -15.239   3.815   2.022
  110    HB2  ALA  16           HB2      ALA  16 -16.266   2.409   2.332
  111    HB3  ALA  16           HB3      ALA  16 -14.634   2.170   1.725
  112    H    PHE  17           H        PHE  17 -15.261   5.361  -0.003
  113    HA   PHE  17           HA       PHE  17 -13.137   4.661  -1.980
  114    HB2  PHE  17           HB2      PHE  17 -15.151   5.585  -3.060
  115    HB3  PHE  17           HB3      PHE  17 -14.950   7.068  -2.121
  116    HD1  PHE  17           HD2      PHE  17 -11.683   5.759  -3.164
  117    HD2  PHE  17           HD1      PHE  17 -15.149   7.942  -4.578
  118    HE1  PHE  17           HE2      PHE  17 -10.326   6.826  -4.887
  119    HE2  PHE  17           HE1      PHE  17 -13.744   8.927  -6.380
  120    HZ   PHE  17           HZ       PHE  17 -11.327   8.389  -6.510
  121    H    VAL  18           H        VAL  18 -11.339   4.891  -0.810
  122    HA   VAL  18           HA       VAL  18 -10.721   7.516   0.351
  123    HB   VAL  18           HB       VAL  18  -9.592   6.288   2.272
  124   HG11  VAL  18          HG11      VAL  18 -12.647   6.323   2.188
  125   HG12  VAL  18          HG12      VAL  18 -11.611   6.467   3.630
  126   HG13  VAL  18          HG13      VAL  18 -11.626   7.755   2.415
  127   HG21  VAL  18          HG21      VAL  18 -10.660   4.211   3.068
  128   HG22  VAL  18          HG22      VAL  18 -11.659   4.145   1.609
  129   HG23  VAL  18          HG23      VAL  18  -9.899   3.930   1.498
  130    HA   PRO  19           HA       PRO  19  -7.522   6.096  -2.575
  131    HB2  PRO  19           HB2      PRO  19  -6.197   8.480  -2.898
  132    HB3  PRO  19           HB3      PRO  19  -7.693   8.037  -3.776
  133    HG2  PRO  19           HG2      PRO  19  -7.435   9.719  -1.272
  134    HG3  PRO  19           HG3      PRO  19  -8.391  10.049  -2.744
  135    HD2  PRO  19           HD2      PRO  19  -9.527   8.984  -0.528
  136    HD3  PRO  19           HD3      PRO  19 -10.023   8.430  -2.155
  137    H    SER  20           H        SER  20  -5.993   4.878  -1.659
  138    HA   SER  20           HA       SER  20  -4.383   5.998   0.561
  139    HB2  SER  20           HB2      SER  20  -5.227   3.111   0.348
  140    HB3  SER  20           HB3      SER  20  -4.397   3.924   1.675
  141    HG   SER  20           HG       SER  20  -7.003   4.543   0.727
  142    H    TYR  21           H        TYR  21  -2.242   4.143   0.661
  143    HA   TYR  21           HA       TYR  21  -1.034   4.502  -2.060
  144    HB2  TYR  21           HB2      TYR  21  -0.024   4.953   0.697
  145    HB3  TYR  21           HB3      TYR  21   1.101   4.315  -0.461
  146    HD1  TYR  21           HD2      TYR  21   1.874   5.606  -2.489
  147    HD2  TYR  21           HD1      TYR  21  -0.665   7.244   0.622
  148    HE1  TYR  21           HE2      TYR  21   2.296   7.885  -3.319
  149    HE2  TYR  21           HE1      TYR  21  -0.104   9.505  -0.105
  150    HH   TYR  21           HH       TYR  21   1.556  10.748  -1.456
  151    H    TYR  22           H        TYR  22   0.029   2.928  -3.024
  152    HA   TYR  22           HA       TYR  22  -0.086   0.139  -2.025
  153    HB2  TYR  22           HB2      TYR  22  -1.292   1.072  -4.253
  154    HB3  TYR  22           HB3      TYR  22   0.324   1.106  -4.888
  155    HD1  TYR  22           HD1      TYR  22   1.686  -1.117  -4.936
  156    HD2  TYR  22           HD2      TYR  22  -2.583  -0.861  -4.404
  157    HE1  TYR  22           HE1      TYR  22   1.531  -3.494  -5.388
  158    HE2  TYR  22           HE2      TYR  22  -2.786  -3.243  -5.047
  159    HH   TYR  22           HH       TYR  22   0.067  -5.384  -5.278
  160    H    TYR  23           H        TYR  23   1.864  -1.102  -2.363
  161    HA   TYR  23           HA       TYR  23   4.401   0.434  -2.861
  162    HB2  TYR  23           HB2      TYR  23   4.326  -0.257  -0.600
  163    HB3  TYR  23           HB3      TYR  23   3.755  -1.861  -1.034
  164    HD1  TYR  23           HD1      TYR  23   6.788   0.366  -1.451
  165    HD2  TYR  23           HD2      TYR  23   5.236  -3.638  -1.242
  166    HE1  TYR  23           HE1      TYR  23   9.084  -0.525  -1.327
  167    HE2  TYR  23           HE2      TYR  23   7.521  -4.520  -0.956
  168    HH   TYR  23           HH       TYR  23  10.401  -2.530  -0.806
  169    H    ASN  24           H        ASN  24   5.676  -0.170  -4.527
  170    HA   ASN  24           HA       ASN  24   5.147  -2.756  -5.920
  171    HB2  ASN  24           HB2      ASN  24   5.878  -0.052  -7.103
  172    HB3  ASN  24           HB3      ASN  24   5.961  -1.586  -7.969
  173   HD21  ASN  24          HD21      ASN  24   4.465   0.420  -9.046
  174   HD22  ASN  24          HD22      ASN  24   2.752   0.005  -8.943
  175    H    GLN  25           H        GLN  25   6.750  -3.786  -4.712
  176    HA   GLN  25           HA       GLN  25   9.346  -2.839  -4.182
  177    HB2  GLN  25           HB2      GLN  25   9.906  -5.002  -3.483
  178    HB3  GLN  25           HB3      GLN  25   8.238  -4.753  -3.038
  179    HG2  GLN  25           HG2      GLN  25   9.260  -6.515  -5.251
  180    HG3  GLN  25           HG3      GLN  25   8.564  -7.006  -3.716
  181   HE21  GLN  25          HE21      GLN  25   6.104  -5.238  -3.705
  182   HE22  GLN  25          HE22      GLN  25   5.205  -5.714  -5.106
  183    H    TYR  26           H        TYR  26   7.993  -4.341  -7.090
  184    HA   TYR  26           HA       TYR  26  10.281  -5.138  -8.439
  185    HB2  TYR  26           HB2      TYR  26   7.940  -3.643  -9.676
  186    HB3  TYR  26           HB3      TYR  26   9.015  -4.766 -10.489
  187    HD1  TYR  26           HD2      TYR  26   9.033  -7.243  -9.397
  188    HD2  TYR  26           HD1      TYR  26   5.817  -4.382  -9.046
  189    HE1  TYR  26           HE2      TYR  26   7.411  -9.098  -9.061
  190    HE2  TYR  26           HE1      TYR  26   4.236  -6.211  -8.612
  191    HH   TYR  26           HH       TYR  26   5.162  -9.674  -8.704
  192    H    SER  27           H        SER  27   8.851  -1.947  -8.090
  193    HA   SER  27           HA       SER  27  11.063  -0.650  -9.595
  194    HB2  SER  27           HB2      SER  27   8.661  -0.399 -10.295
  195    HB3  SER  27           HB3      SER  27   8.342   0.415  -8.765
  196    HG   SER  27           HG       SER  27   8.756   1.742 -10.657
  197    H    ASN  28           H        ASN  28  10.650  -1.551  -6.491
  198    HA   ASN  28           HA       ASN  28  11.191  -0.771  -4.445
  199    HB2  ASN  28           HB2      ASN  28  13.413  -1.029  -5.457
  200    HB3  ASN  28           HB3      ASN  28  13.306   0.558  -6.207
  201   HD21  ASN  28          HD21      ASN  28  13.240  -0.907  -2.840
  202   HD22  ASN  28          HD22      ASN  28  14.202   0.427  -2.215
  203    H    THR  29           H        THR  29   8.942   0.555  -5.365
  204    HA   THR  29           HA       THR  29   9.221   3.051  -3.923
  205    HB   THR  29           HB       THR  29   9.924   3.598  -6.293
  206    HG1  THR  29           HG1      THR  29   9.212   5.488  -5.896
  207   HG21  THR  29          HG21      THR  29   8.165   3.966  -7.967
  208   HG22  THR  29          HG22      THR  29   6.962   3.196  -6.937
  209   HG23  THR  29          HG23      THR  29   8.320   2.247  -7.574
  210    H    CYS  30           H        CYS  30   6.871   4.185  -4.507
  211    HA   CYS  30           HA       CYS  30   4.732   2.202  -4.009
  212    HB2  CYS  30           HB2      CYS  30   5.255   4.758  -2.463
  213    HB3  CYS  30           HB3      CYS  30   3.875   3.721  -2.239
  214    H    HIS  31           H        HIS  31   2.588   3.306  -4.293
  215    HA   HIS  31           HA       HIS  31   2.617   5.866  -5.696
  216    HB2  HIS  31           HB2      HIS  31   3.119   3.868  -7.338
  217    HB3  HIS  31           HB3      HIS  31   1.433   3.441  -7.098
  218    HD1  HIS  31           HD1      HIS  31  -0.088   4.657  -8.946
  219    HD2  HIS  31           HD2      HIS  31   3.395   6.706  -7.764
  220    HE1  HIS  31           HE1      HIS  31  -0.035   6.795 -10.328
  221    H    SER  32           H        SER  32   0.540   6.818  -5.695
  222    HA   SER  32           HA       SER  32  -1.230   5.840  -3.662
  223    HB2  SER  32           HB2      SER  32  -2.689   7.602  -4.354
  224    HB3  SER  32           HB3      SER  32  -1.040   8.214  -4.174
  225    HG   SER  32           HG       SER  32  -0.812   8.389  -6.378
  226    H    PHE  33           H        PHE  33  -3.236   4.778  -3.841
  227    HA   PHE  33           HA       PHE  33  -4.251   3.975  -6.466
  228    HB2  PHE  33           HB2      PHE  33  -4.274   1.705  -6.178
  229    HB3  PHE  33           HB3      PHE  33  -2.672   2.134  -5.628
  230    HD1  PHE  33           HD2      PHE  33  -2.499   2.502  -2.984
  231    HD2  PHE  33           HD1      PHE  33  -5.585   0.223  -4.912
  232    HE1  PHE  33           HE2      PHE  33  -3.048   1.369  -0.812
  233    HE2  PHE  33           HE1      PHE  33  -6.127  -0.871  -2.762
  234    HZ   PHE  33           HZ       PHE  33  -4.813  -0.237  -0.682
  235    H    THR  34           H        THR  34  -6.440   2.573  -5.767
  236    HA   THR  34           HA       THR  34  -7.848   4.456  -3.881
  237    HB   THR  34           HB       THR  34  -9.905   3.867  -5.101
  238    HG1  THR  34           HG1      THR  34  -9.806   2.289  -6.375
  239   HG21  THR  34          HG21      THR  34  -8.500   5.893  -5.601
  240   HG22  THR  34          HG22      THR  34  -9.465   5.326  -6.980
  241   HG23  THR  34          HG23      THR  34  -7.722   5.005  -6.905
  242    H    TYR  35           H        TYR  35  -8.767   3.714  -1.980
  243    HA   TYR  35           HA       TYR  35  -9.030   0.811  -1.728
  244    HB2  TYR  35           HB2      TYR  35  -6.945   1.506  -0.800
  245    HB3  TYR  35           HB3      TYR  35  -7.755   2.659   0.256
  246    HD1  TYR  35           HD1      TYR  35  -7.076  -0.975  -0.500
  247    HD2  TYR  35           HD2      TYR  35  -8.586   1.902   2.381
  248    HE1  TYR  35           HE1      TYR  35  -6.662  -2.572   1.341
  249    HE2  TYR  35           HE2      TYR  35  -8.250   0.276   4.184
  250    HH   TYR  35           HH       TYR  35  -7.543  -1.957   4.714
  251    H    SER  36           H        SER  36 -10.257   0.387   0.471
  252    HA   SER  36           HA       SER  36 -12.487   2.251   0.993
  253    HB2  SER  36           HB2      SER  36 -12.674  -0.749   0.488
  254    HB3  SER  36           HB3      SER  36 -14.020   0.360   0.734
  255    HG   SER  36           HG       SER  36 -13.485   1.367  -1.244
  256    H    GLY  37           H        GLY  37 -13.240   2.072   3.249
  257    HA2  GLY  37           HA2      GLY  37 -11.776   1.831   5.334
  258    HA3  GLY  37           HA3      GLY  37 -13.421   1.232   5.374
  259    H    CYS  38           H        CYS  38 -13.552  -1.191   4.583
  260    HA   CYS  38           HA       CYS  38 -12.214  -2.833   6.457
  261    HB2  CYS  38           HB2      CYS  38 -13.565  -3.693   3.877
  262    HB3  CYS  38           HB3      CYS  38 -13.202  -4.727   5.256
  263    H    GLY  39           H        GLY  39 -11.822  -3.121   2.896
  264    HA2  GLY  39           HA2      GLY  39 -10.127  -3.662   1.565
  265    HA3  GLY  39           HA3      GLY  39  -8.992  -3.296   2.875
  266    H    GLY  40           H        GLY  40  -8.608  -5.114   0.917
  267    HA2  GLY  40           HA2      GLY  40  -9.181  -7.825   1.729
  268    HA3  GLY  40           HA3      GLY  40  -8.175  -7.287   0.388
  269    H    ASN  41           H        ASN  41  -6.065  -5.927   1.479
  270    HA   ASN  41           HA       ASN  41  -4.994  -7.528   3.699
  271    HB2  ASN  41           HB2      ASN  41  -3.669  -7.361   0.961
  272    HB3  ASN  41           HB3      ASN  41  -2.867  -7.895   2.413
  273   HD21  ASN  41          HD21      ASN  41  -3.881  -9.795   3.629
  274   HD22  ASN  41          HD22      ASN  41  -4.384 -11.124   2.592
  275    H    ALA  42           H        ALA  42  -2.953  -6.956   4.417
  276    HA   ALA  42           HA       ALA  42  -2.783  -4.392   5.329
  277    HB1  ALA  42           HB1      ALA  42  -0.661  -5.082   6.280
  278    HB2  ALA  42           HB2      ALA  42  -1.792  -6.456   6.325
  279    HB3  ALA  42           HB3      ALA  42  -0.507  -6.376   5.082
  280    H    ASN  43           H        ASN  43  -1.815  -5.142   2.136
  281    HA   ASN  43           HA       ASN  43   0.541  -3.508   1.945
  282    HB2  ASN  43           HB2      ASN  43   0.014  -5.114   0.233
  283    HB3  ASN  43           HB3      ASN  43  -1.502  -4.284  -0.159
  284   HD21  ASN  43          HD21      ASN  43  -0.964  -3.713  -2.443
  285   HD22  ASN  43          HD22      ASN  43   0.444  -2.755  -2.750
  286    H    ARG  44           H        ARG  44  -2.710  -2.573   2.589
  287    HA   ARG  44           HA       ARG  44  -2.491  -0.020   1.139
  288    HB2  ARG  44           HB2      ARG  44  -4.645  -0.850   1.652
  289    HB3  ARG  44           HB3      ARG  44  -4.335  -0.912   3.387
  290    HG2  ARG  44           HG2      ARG  44  -4.031   1.729   1.948
  291    HG3  ARG  44           HG3      ARG  44  -5.641   1.137   2.171
  292    HD2  ARG  44           HD2      ARG  44  -3.675   1.748   4.393
  293    HD3  ARG  44           HD3      ARG  44  -5.092   2.694   3.939
  294    HE   ARG  44           HE       ARG  44  -5.814  -0.011   4.567
  295   HH11  ARG  44          HH11      ARG  44  -4.635   2.877   6.287
  296   HH12  ARG  44          HH12      ARG  44  -5.617   2.615   7.677
  297   HH21  ARG  44          HH21      ARG  44  -7.090  -0.394   6.536
  298   HH22  ARG  44          HH22      ARG  44  -6.936   0.739   7.831
  299    H    PHE  45           H        PHE  45  -1.432   1.770   1.674
  300    HA   PHE  45           HA       PHE  45  -0.543   2.223   4.478
  301    HB2  PHE  45           HB2      PHE  45   0.916   2.423   1.875
  302    HB3  PHE  45           HB3      PHE  45   1.152   3.771   2.972
  303    HD1  PHE  45           HD2      PHE  45   1.391   0.083   2.700
  304    HD2  PHE  45           HD1      PHE  45   2.388   3.550   5.052
  305    HE1  PHE  45           HE2      PHE  45   2.905  -1.285   4.039
  306    HE2  PHE  45           HE1      PHE  45   3.802   2.129   6.522
  307    HZ   PHE  45           HZ       PHE  45   4.041  -0.294   6.040
  308    H    ARG  46           H        ARG  46  -0.201   4.594   4.904
  309    HA   ARG  46           HA       ARG  46  -2.496   6.151   3.826
  310    HB2  ARG  46           HB2      ARG  46  -2.242   7.434   6.011
  311    HB3  ARG  46           HB3      ARG  46  -2.939   5.832   6.049
  312    HG2  ARG  46           HG2      ARG  46  -1.461   6.275   7.952
  313    HG3  ARG  46           HG3      ARG  46  -0.995   4.855   7.039
  314    HD2  ARG  46           HD2      ARG  46   0.930   6.127   7.815
  315    HD3  ARG  46           HD3      ARG  46   0.894   6.035   6.064
  316    HE   ARG  46           HE       ARG  46   0.287   8.330   5.899
  317   HH11  ARG  46          HH11      ARG  46   1.406   7.385   9.180
  318   HH12  ARG  46          HH12      ARG  46   1.835   8.996   9.570
  319   HH21  ARG  46          HH21      ARG  46   0.412  10.480   6.647
  320   HH22  ARG  46          HH22      ARG  46   1.219  10.798   8.123
  321    H    THR  47           H        THR  47   0.922   6.031   3.689
  322    HA   THR  47           HA       THR  47   0.937   8.427   2.219
  323    HB   THR  47           HB       THR  47   1.042   9.380   4.568
  324    HG1  THR  47           HG1      THR  47   2.662  10.794   4.059
  325   HG21  THR  47          HG21      THR  47   2.594   7.482   5.439
  326   HG22  THR  47          HG22      THR  47   3.026   9.156   5.894
  327   HG23  THR  47          HG23      THR  47   3.871   8.323   4.597
  328    H    ILE  48           H        ILE  48   2.855   8.652   1.018
  329    HA   ILE  48           HA       ILE  48   4.143   6.190   0.556
  330    HB   ILE  48           HB       ILE  48   3.905   7.539  -1.328
  331   HG12  ILE  48          HG12      ILE  48   6.856   7.663  -0.557
  332   HG13  ILE  48          HG13      ILE  48   6.017   6.271  -1.161
  333   HG21  ILE  48          HG21      ILE  48   3.636   9.762  -0.276
  334   HG22  ILE  48          HG22      ILE  48   5.373   9.804   0.083
  335   HG23  ILE  48          HG23      ILE  48   4.791   9.831  -1.589
  336   HD11  ILE  48          HD11      ILE  48   7.199   7.237  -2.999
  337   HD12  ILE  48          HD12      ILE  48   5.466   7.491  -3.279
  338   HD13  ILE  48          HD13      ILE  48   6.491   8.833  -2.713
  339    H    ASP  49           H        ASP  49   4.780   8.922   2.658
  340    HA   ASP  49           HA       ASP  49   7.579   8.591   3.005
  341    HB2  ASP  49           HB2      ASP  49   5.544   9.721   4.947
  342    HB3  ASP  49           HB3      ASP  49   7.297   9.789   5.121
  343    H    GLU  50           H        GLU  50   4.848   6.856   4.471
  344    HA   GLU  50           HA       GLU  50   6.621   5.561   6.430
  345    HB2  GLU  50           HB2      GLU  50   3.628   5.440   5.941
  346    HB3  GLU  50           HB3      GLU  50   4.470   4.444   7.125
  347    HG2  GLU  50           HG2      GLU  50   4.416   7.491   7.118
  348    HG3  GLU  50           HG3      GLU  50   3.471   6.447   8.173
  349    H    CYS  51           H        CYS  51   4.770   4.848   3.429
  350    HA   CYS  51           HA       CYS  51   5.208   2.047   3.517
  351    HB2  CYS  51           HB2      CYS  51   4.383   2.021   1.282
  352    HB3  CYS  51           HB3      CYS  51   3.622   3.441   1.988
  353    H    ASN  52           H        ASN  52   7.104   4.762   2.158
  354    HA   ASN  52           HA       ASN  52   9.030   3.031   1.003
  355    HB2  ASN  52           HB2      ASN  52  10.040   4.825   0.046
  356    HB3  ASN  52           HB3      ASN  52   8.422   5.447   0.267
  357   HD21  ASN  52          HD21      ASN  52   8.294   7.406   1.223
  358   HD22  ASN  52          HD22      ASN  52   9.623   8.235   2.005
  359    H    ARG  53           H        ARG  53   9.198   5.189   3.849
  360    HA   ARG  53           HA       ARG  53  11.685   4.227   4.641
  361    HB2  ARG  53           HB2      ARG  53  11.421   5.259   6.703
  362    HB3  ARG  53           HB3      ARG  53  10.306   6.148   5.649
  363    HG2  ARG  53           HG2      ARG  53   8.486   4.569   6.514
  364    HG3  ARG  53           HG3      ARG  53   9.631   4.036   7.745
  365    HD2  ARG  53           HD2      ARG  53   8.646   6.890   7.329
  366    HD3  ARG  53           HD3      ARG  53   8.130   5.754   8.590
  367    HE   ARG  53           HE       ARG  53  10.919   5.960   8.759
  368   HH11  ARG  53          HH11      ARG  53   7.925   7.714   9.576
  369   HH12  ARG  53          HH12      ARG  53   8.733   8.705  10.775
  370   HH21  ARG  53          HH21      ARG  53  11.948   7.335  10.177
  371   HH22  ARG  53          HH22      ARG  53  11.062   8.321  11.285
  372    H    THR  54           H        THR  54   8.686   2.379   4.975
  373    HA   THR  54           HA       THR  54  10.062   0.472   6.771
  374    HB   THR  54           HB       THR  54   7.795   1.492   7.210
  375    HG1  THR  54           HG1      THR  54   8.493  -0.216   8.427
  376   HG21  THR  54          HG21      THR  54   6.968   0.738   4.771
  377   HG22  THR  54          HG22      THR  54   5.916   0.850   6.169
  378   HG23  THR  54          HG23      THR  54   6.536  -0.742   5.652
  379    H    CYS  55           H        CYS  55   9.309   0.689   3.319
  380    HA   CYS  55           HA       CYS  55  10.187  -2.159   3.092
  381    HB2  CYS  55           HB2      CYS  55   8.027  -0.912   1.384
  382    HB3  CYS  55           HB3      CYS  55   8.484  -2.613   1.494
  383    H    VAL  56           H        VAL  56  10.357   1.073   1.734
  384    HA   VAL  56           HA       VAL  56  11.455   0.111  -0.825
  385    HB   VAL  56           HB       VAL  56  11.108   2.860   0.363
  386   HG11  VAL  56          HG11      VAL  56  13.157   3.038  -0.910
  387   HG12  VAL  56          HG12      VAL  56  12.393   2.228  -2.293
  388   HG13  VAL  56          HG13      VAL  56  11.831   3.827  -1.749
  389   HG21  VAL  56          HG21      VAL  56   9.523   3.110  -1.526
  390   HG22  VAL  56          HG22      VAL  56   9.973   1.510  -2.141
  391   HG23  VAL  56          HG23      VAL  56   9.093   1.659  -0.615
  392    H    GLY  57           H        GLY  57  13.208  -1.080  -0.535
  393    HA2  GLY  57           HA2      GLY  57  15.683  -0.260  -0.423
  394    HA3  GLY  57           HA3      GLY  57  15.328  -0.260   1.334
  Start of MODEL   19
    1    H1   ARG   1           H        ARG   1  12.803  -4.909   2.586
    2    HA   ARG   1           HA       ARG   1  10.491  -4.214   3.102
    3    HB2  ARG   1           HB2      ARG   1   9.388  -5.263   1.053
    4    HB3  ARG   1           HB3      ARG   1  10.746  -4.200   0.826
    5    HG2  ARG   1           HG2      ARG   1  11.230  -7.183   0.842
    6    HG3  ARG   1           HG3      ARG   1  10.528  -6.416  -0.562
    7    HD2  ARG   1           HD2      ARG   1  13.138  -5.372   0.582
    8    HD3  ARG   1           HD3      ARG   1  13.087  -6.687  -0.558
    9    HE   ARG   1           HE       ARG   1  12.578  -3.873  -1.061
   10   HH11  ARG   1          HH11      ARG   1  12.379  -7.178  -2.436
   11   HH12  ARG   1          HH12      ARG   1  12.472  -6.583  -4.067
   12   HH21  ARG   1          HH21      ARG   1  12.957  -3.232  -3.122
   13   HH22  ARG   1          HH22      ARG   1  12.693  -4.270  -4.488
   14    HA   PRO   2           HA       PRO   2   8.750  -7.537   5.609
   15    HB2  PRO   2           HB2      PRO   2   6.531  -6.208   6.499
   16    HB3  PRO   2           HB3      PRO   2   8.159  -5.885   7.153
   17    HG2  PRO   2           HG2      PRO   2   6.679  -4.399   5.001
   18    HG3  PRO   2           HG3      PRO   2   7.518  -3.688   6.414
   19    HD2  PRO   2           HD2      PRO   2   8.788  -3.758   4.025
   20    HD3  PRO   2           HD3      PRO   2   9.662  -4.169   5.518
   21    H    ARG   3           H        ARG   3   7.316  -9.132   5.071
   22    HA   ARG   3           HA       ARG   3   6.215  -9.058   2.469
   23    HB2  ARG   3           HB2      ARG   3   5.577 -11.269   2.740
   24    HB3  ARG   3           HB3      ARG   3   7.011 -11.073   3.720
   25    HG2  ARG   3           HG2      ARG   3   5.777 -12.241   5.220
   26    HG3  ARG   3           HG3      ARG   3   5.192 -10.632   5.663
   27    HD2  ARG   3           HD2      ARG   3   3.218 -10.994   4.124
   28    HD3  ARG   3           HD3      ARG   3   3.865 -12.609   3.771
   29    HE   ARG   3           HE       ARG   3   3.488 -12.000   6.607
   30   HH11  ARG   3          HH11      ARG   3   1.857 -13.353   3.690
   31   HH12  ARG   3          HH12      ARG   3   0.816 -14.336   4.669
   32   HH21  ARG   3          HH21      ARG   3   2.094 -13.324   7.782
   33   HH22  ARG   3          HH22      ARG   3   1.281 -14.626   6.993
   34    H    PHE   4           H        PHE   4   4.871  -7.680   5.327
   35    HA   PHE   4           HA       PHE   4   2.117  -8.139   4.556
   36    HB2  PHE   4           HB2      PHE   4   1.466  -6.770   6.266
   37    HB3  PHE   4           HB3      PHE   4   2.896  -7.550   6.886
   38    HD1  PHE   4           HD2      PHE   4   1.618  -4.401   5.312
   39    HD2  PHE   4           HD1      PHE   4   4.642  -6.172   7.813
   40    HE1  PHE   4           HE2      PHE   4   2.412  -2.159   5.912
   41    HE2  PHE   4           HE1      PHE   4   5.503  -3.917   8.353
   42    HZ   PHE   4           HZ       PHE   4   4.417  -1.891   7.384
   43    H    CYS   5           H        CYS   5   4.623  -5.871   3.387
   44    HA   CYS   5           HA       CYS   5   2.532  -4.191   2.238
   45    HB2  CYS   5           HB2      CYS   5   4.296  -2.766   1.412
   46    HB3  CYS   5           HB3      CYS   5   4.217  -2.986   3.160
   47    H    GLU   6           H        GLU   6   3.810  -7.076   1.284
   48    HA   GLU   6           HA       GLU   6   3.674  -6.343  -1.629
   49    HB2  GLU   6           HB2      GLU   6   4.829  -8.340  -2.101
   50    HB3  GLU   6           HB3      GLU   6   5.660  -7.443  -0.824
   51    HG2  GLU   6           HG2      GLU   6   4.917  -8.903   0.849
   52    HG3  GLU   6           HG3      GLU   6   3.894  -9.836  -0.258
   53    H    LEU   7           H        LEU   7   1.384  -6.836   0.437
   54    HA   LEU   7           HA       LEU   7   0.032  -9.214  -0.622
   55    HB2  LEU   7           HB2      LEU   7  -1.017  -7.078   1.248
   56    HB3  LEU   7           HB3      LEU   7  -1.752  -8.651   0.921
   57    HG   LEU   7           HG       LEU   7   0.889  -8.152   2.352
   58   HD11  LEU   7          HD11      LEU   7  -1.741  -9.297   3.378
   59   HD12  LEU   7          HD12      LEU   7  -1.172  -7.632   3.632
   60   HD13  LEU   7          HD13      LEU   7  -0.268  -8.985   4.320
   61   HD21  LEU   7          HD21      LEU   7   1.187 -10.212   1.215
   62   HD22  LEU   7          HD22      LEU   7  -0.438 -10.800   1.707
   63   HD23  LEU   7          HD23      LEU   7   0.861 -10.563   2.901
   64    H    ALA   8           H        ALA   8  -2.319  -8.849  -1.241
   65    HA   ALA   8           HA       ALA   8  -2.376  -6.890  -3.482
   66    HB1  ALA   8           HB1      ALA   8  -2.687  -9.235  -4.115
   67    HB2  ALA   8           HB2      ALA   8  -4.019  -9.383  -2.943
   68    HB3  ALA   8           HB3      ALA   8  -4.183  -8.311  -4.355
   69    HA   PRO   9           HA       PRO   9  -5.199  -4.945  -0.582
   70    HB2  PRO   9           HB2      PRO   9  -5.932  -2.704  -1.942
   71    HB3  PRO   9           HB3      PRO   9  -4.330  -2.925  -1.171
   72    HG2  PRO   9           HG2      PRO   9  -5.063  -3.319  -4.088
   73    HG3  PRO   9           HG3      PRO   9  -3.642  -2.477  -3.392
   74    HD2  PRO   9           HD2      PRO   9  -3.577  -5.084  -4.291
   75    HD3  PRO   9           HD3      PRO   9  -2.533  -4.498  -2.961
   76    H    SER  10           H        SER  10  -6.827  -6.465  -0.597
   77    HA   SER  10           HA       SER  10  -8.726  -7.015  -2.655
   78    HB2  SER  10           HB2      SER  10  -7.982  -8.588  -0.913
   79    HB3  SER  10           HB3      SER  10  -8.757  -7.603   0.332
   80    HG   SER  10           HG       SER  10 -10.727  -7.954  -0.839
   81    H    ALA  11           H        ALA  11  -8.718  -4.184  -2.215
   82    HA   ALA  11           HA       ALA  11 -10.640  -3.086  -0.506
   83    HB1  ALA  11           HB1      ALA  11  -9.703  -2.212  -3.282
   84    HB2  ALA  11           HB2      ALA  11 -10.571  -1.180  -2.142
   85    HB3  ALA  11           HB3      ALA  11  -8.950  -1.778  -1.727
   86    H    GLY  12           H        GLY  12 -11.159  -4.861  -3.532
   87    HA2  GLY  12           HA2      GLY  12 -13.728  -3.805  -4.141
   88    HA3  GLY  12           HA3      GLY  12 -13.086  -5.364  -4.671
   89    H    SER  13           H        SER  13 -12.871  -5.746  -1.477
   90    HA   SER  13           HA       SER  13 -15.005  -7.535  -1.186
   91    HB2  SER  13           HB2      SER  13 -12.748  -7.293   0.075
   92    HB3  SER  13           HB3      SER  13 -13.591  -6.090   1.066
   93    HG   SER  13           HG       SER  13 -13.800  -8.838   0.907
   94    H    CYS  14           H        CYS  14 -14.849  -4.041  -0.230
   95    HA   CYS  14           HA       CYS  14 -17.738  -4.206   0.469
   96    HB2  CYS  14           HB2      CYS  14 -15.766  -2.511   1.994
   97    HB3  CYS  14           HB3      CYS  14 -17.403  -2.968   2.445
   98    H    PHE  15           H        PHE  15 -18.766  -1.944   0.370
   99    HA   PHE  15           HA       PHE  15 -17.461  -0.494  -1.879
  100    HB2  PHE  15           HB2      PHE  15 -19.909  -0.927  -2.006
  101    HB3  PHE  15           HB3      PHE  15 -20.122  -0.015  -0.510
  102    HD1  PHE  15           HD1      PHE  15 -19.923   2.443  -0.444
  103    HD2  PHE  15           HD2      PHE  15 -19.481   0.233  -4.129
  104    HE1  PHE  15           HE1      PHE  15 -20.166   4.544  -1.739
  105    HE2  PHE  15           HE2      PHE  15 -19.696   2.332  -5.404
  106    HZ   PHE  15           HZ       PHE  15 -20.018   4.508  -4.218
  107    H    ALA  16           H        ALA  16 -15.803   0.764  -1.156
  108    HA   ALA  16           HA       ALA  16 -16.532   2.871   0.593
  109    HB1  ALA  16           HB1      ALA  16 -15.775   1.093   2.203
  110    HB2  ALA  16           HB2      ALA  16 -14.157   1.289   1.535
  111    HB3  ALA  16           HB3      ALA  16 -14.936   2.663   2.291
  112    H    PHE  17           H        PHE  17 -15.035   4.620   0.504
  113    HA   PHE  17           HA       PHE  17 -13.077   4.455  -1.726
  114    HB2  PHE  17           HB2      PHE  17 -15.247   5.390  -2.463
  115    HB3  PHE  17           HB3      PHE  17 -15.054   6.699  -1.283
  116    HD1  PHE  17           HD2      PHE  17 -13.317   5.010  -4.168
  117    HD2  PHE  17           HD1      PHE  17 -13.826   8.664  -1.914
  118    HE1  PHE  17           HE2      PHE  17 -11.787   6.199  -5.731
  119    HE2  PHE  17           HE1      PHE  17 -12.348   9.841  -3.508
  120    HZ   PHE  17           HZ       PHE  17 -11.302   8.613  -5.396
  121    H    VAL  18           H        VAL  18 -11.233   4.538  -0.584
  122    HA   VAL  18           HA       VAL  18 -10.675   6.985   0.934
  123    HB   VAL  18           HB       VAL  18  -9.388   5.523   2.598
  124   HG11  VAL  18          HG11      VAL  18 -11.347   5.374   4.077
  125   HG12  VAL  18          HG12      VAL  18 -11.316   6.890   3.177
  126   HG13  VAL  18          HG13      VAL  18 -12.435   5.598   2.690
  127   HG21  VAL  18          HG21      VAL  18 -11.470   3.446   1.782
  128   HG22  VAL  18          HG22      VAL  18  -9.729   3.306   1.498
  129   HG23  VAL  18          HG23      VAL  18 -10.341   3.351   3.157
  130    HA   PRO  19           HA       PRO  19  -7.589   6.045  -2.293
  131    HB2  PRO  19           HB2      PRO  19  -6.398   8.527  -2.428
  132    HB3  PRO  19           HB3      PRO  19  -7.903   8.079  -3.289
  133    HG2  PRO  19           HG2      PRO  19  -7.633   9.558  -0.670
  134    HG3  PRO  19           HG3      PRO  19  -8.680   9.935  -2.068
  135    HD2  PRO  19           HD2      PRO  19  -9.596   8.606   0.132
  136    HD3  PRO  19           HD3      PRO  19 -10.208   8.219  -1.508
  137    H    SER  20           H        SER  20  -5.788   4.972  -1.644
  138    HA   SER  20           HA       SER  20  -4.141   6.096   0.503
  139    HB2  SER  20           HB2      SER  20  -5.695   3.566   0.705
  140    HB3  SER  20           HB3      SER  20  -4.218   3.809   1.652
  141    HG   SER  20           HG       SER  20  -6.007   5.900   1.534
  142    H    TYR  21           H        TYR  21  -2.182   4.065   0.715
  143    HA   TYR  21           HA       TYR  21  -0.947   4.400  -2.006
  144    HB2  TYR  21           HB2      TYR  21   0.133   4.795   0.739
  145    HB3  TYR  21           HB3      TYR  21   1.220   4.129  -0.463
  146    HD1  TYR  21           HD1      TYR  21  -0.854   7.053   0.422
  147    HD2  TYR  21           HD2      TYR  21   2.111   5.476  -2.308
  148    HE1  TYR  21           HE1      TYR  21  -0.369   9.330  -0.375
  149    HE2  TYR  21           HE2      TYR  21   2.536   7.751  -3.143
  150    HH   TYR  21           HH       TYR  21   0.670  10.564  -2.257
  151    H    TYR  22           H        TYR  22  -0.027   2.895  -3.020
  152    HA   TYR  22           HA       TYR  22  -0.096   0.078  -2.115
  153    HB2  TYR  22           HB2      TYR  22  -1.048   1.090  -4.491
  154    HB3  TYR  22           HB3      TYR  22   0.639   1.143  -4.876
  155    HD1  TYR  22           HD1      TYR  22   1.982  -0.970  -5.013
  156    HD2  TYR  22           HD2      TYR  22  -2.288  -0.936  -4.536
  157    HE1  TYR  22           HE1      TYR  22   1.943  -3.297  -5.727
  158    HE2  TYR  22           HE2      TYR  22  -2.354  -3.315  -5.302
  159    HH   TYR  22           HH       TYR  22   0.548  -5.054  -6.446
  160    H    TYR  23           H        TYR  23   1.912  -1.220  -2.334
  161    HA   TYR  23           HA       TYR  23   4.427   0.395  -2.488
  162    HB2  TYR  23           HB2      TYR  23   4.112  -0.652  -0.338
  163    HB3  TYR  23           HB3      TYR  23   3.724  -2.185  -1.082
  164    HD1  TYR  23           HD1      TYR  23   6.562   0.316  -1.208
  165    HD2  TYR  23           HD2      TYR  23   5.408  -3.834  -1.226
  166    HE1  TYR  23           HE1      TYR  23   8.938  -0.344  -1.242
  167    HE2  TYR  23           HE2      TYR  23   7.779  -4.495  -1.140
  168    HH   TYR  23           HH       TYR  23  10.363  -2.377  -0.525
  169    H    ASN  24           H        ASN  24   5.908  -0.129  -4.105
  170    HA   ASN  24           HA       ASN  24   5.438  -2.614  -5.659
  171    HB2  ASN  24           HB2      ASN  24   6.017   0.196  -6.616
  172    HB3  ASN  24           HB3      ASN  24   6.425  -1.213  -7.579
  173   HD21  ASN  24          HD21      ASN  24   4.860  -2.048  -8.937
  174   HD22  ASN  24          HD22      ASN  24   3.147  -1.745  -8.762
  175    H    GLN  25           H        GLN  25   7.032  -3.733  -4.332
  176    HA   GLN  25           HA       GLN  25   9.711  -2.967  -3.892
  177    HB2  GLN  25           HB2      GLN  25  10.259  -5.427  -4.201
  178    HB3  GLN  25           HB3      GLN  25   9.208  -5.002  -2.878
  179    HG2  GLN  25           HG2      GLN  25   8.143  -6.060  -5.540
  180    HG3  GLN  25           HG3      GLN  25   8.698  -7.113  -4.239
  181   HE21  GLN  25          HE21      GLN  25   5.906  -5.328  -5.359
  182   HE22  GLN  25          HE22      GLN  25   5.072  -5.394  -3.848
  183    H    TYR  26           H        TYR  26   8.175  -4.282  -6.802
  184    HA   TYR  26           HA       TYR  26  10.267  -4.928  -8.462
  185    HB2  TYR  26           HB2      TYR  26   7.594  -3.602  -9.042
  186    HB3  TYR  26           HB3      TYR  26   8.651  -4.213 -10.298
  187    HD1  TYR  26           HD2      TYR  26   9.004  -6.605 -10.648
  188    HD2  TYR  26           HD1      TYR  26   6.304  -5.149  -7.638
  189    HE1  TYR  26           HE2      TYR  26   7.906  -8.802 -10.588
  190    HE2  TYR  26           HE1      TYR  26   5.195  -7.384  -7.534
  191    HH   TYR  26           HH       TYR  26   5.877  -9.842  -9.978
  192    H    SER  27           H        SER  27   9.098  -1.634  -7.679
  193    HA   SER  27           HA       SER  27  11.294  -0.557  -9.355
  194    HB2  SER  27           HB2      SER  27   8.895  -0.241 -10.195
  195    HB3  SER  27           HB3      SER  27   8.657   0.843  -8.813
  196    HG   SER  27           HG       SER  27  10.736   1.013 -10.760
  197    H    ASN  28           H        ASN  28  10.928  -1.349  -6.356
  198    HA   ASN  28           HA       ASN  28  11.415  -0.603  -4.317
  199    HB2  ASN  28           HB2      ASN  28  13.634  -0.718  -5.423
  200    HB3  ASN  28           HB3      ASN  28  13.492   0.955  -5.942
  201   HD21  ASN  28          HD21      ASN  28  13.254  -0.842  -2.768
  202   HD22  ASN  28          HD22      ASN  28  14.339   0.259  -1.982
  203    H    THR  29           H        THR  29   9.161   0.695  -5.131
  204    HA   THR  29           HA       THR  29   9.363   3.158  -3.648
  205    HB   THR  29           HB       THR  29  10.120   3.716  -5.992
  206    HG1  THR  29           HG1      THR  29   9.319   5.610  -5.816
  207   HG21  THR  29          HG21      THR  29   7.177   3.376  -6.718
  208   HG22  THR  29          HG22      THR  29   8.534   2.409  -7.324
  209   HG23  THR  29          HG23      THR  29   8.435   4.141  -7.691
  210    H    CYS  30           H        CYS  30   6.922   4.229  -4.422
  211    HA   CYS  30           HA       CYS  30   4.857   2.164  -3.928
  212    HB2  CYS  30           HB2      CYS  30   5.219   4.782  -2.446
  213    HB3  CYS  30           HB3      CYS  30   3.857   3.704  -2.252
  214    H    HIS  31           H        HIS  31   2.614   3.317  -4.138
  215    HA   HIS  31           HA       HIS  31   2.646   5.703  -5.768
  216    HB2  HIS  31           HB2      HIS  31   3.089   3.508  -7.228
  217    HB3  HIS  31           HB3      HIS  31   1.360   3.258  -7.021
  218    HD1  HIS  31           HD1      HIS  31   0.389   3.994  -9.367
  219    HD2  HIS  31           HD2      HIS  31   3.189   6.664  -7.666
  220    HE1  HIS  31           HE1      HIS  31   0.594   5.932 -10.981
  221    H    SER  32           H        SER  32   0.681   6.802  -5.557
  222    HA   SER  32           HA       SER  32  -1.152   5.801  -3.578
  223    HB2  SER  32           HB2      SER  32  -2.555   7.687  -4.293
  224    HB3  SER  32           HB3      SER  32  -0.930   8.146  -3.781
  225    HG   SER  32           HG       SER  32  -1.191   7.666  -6.514
  226    H    PHE  33           H        PHE  33  -3.049   4.681  -3.812
  227    HA   PHE  33           HA       PHE  33  -4.214   4.202  -6.461
  228    HB2  PHE  33           HB2      PHE  33  -4.199   1.898  -6.423
  229    HB3  PHE  33           HB3      PHE  33  -2.577   2.301  -5.860
  230    HD1  PHE  33           HD2      PHE  33  -2.271   2.398  -3.349
  231    HD2  PHE  33           HD1      PHE  33  -5.617   0.433  -5.139
  232    HE1  PHE  33           HE2      PHE  33  -2.443   0.845  -1.375
  233    HE2  PHE  33           HE1      PHE  33  -6.077  -0.723  -3.021
  234    HZ   PHE  33           HZ       PHE  33  -4.414  -0.371  -1.031
  235    H    THR  34           H        THR  34  -6.251   2.652  -5.762
  236    HA   THR  34           HA       THR  34  -7.805   4.397  -3.823
  237    HB   THR  34           HB       THR  34  -9.819   3.473  -5.108
  238    HG1  THR  34           HG1      THR  34  -9.446   2.222  -6.690
  239   HG21  THR  34          HG21      THR  34  -7.817   5.276  -6.557
  240   HG22  THR  34          HG22      THR  34  -9.010   5.799  -5.358
  241   HG23  THR  34          HG23      THR  34  -9.557   5.144  -6.910
  242    H    TYR  35           H        TYR  35  -8.476   3.571  -1.878
  243    HA   TYR  35           HA       TYR  35  -8.428   0.635  -1.658
  244    HB2  TYR  35           HB2      TYR  35  -6.625   1.751  -0.461
  245    HB3  TYR  35           HB3      TYR  35  -7.788   2.536   0.575
  246    HD1  TYR  35           HD1      TYR  35  -6.657  -0.884  -0.612
  247    HD2  TYR  35           HD2      TYR  35  -8.289   1.474   2.632
  248    HE1  TYR  35           HE1      TYR  35  -6.268  -2.743   0.949
  249    HE2  TYR  35           HE2      TYR  35  -7.946  -0.417   4.171
  250    HH   TYR  35           HH       TYR  35  -7.251  -2.718   4.361
  251    H    SER  36           H        SER  36  -9.739  -0.026   0.517
  252    HA   SER  36           HA       SER  36 -12.300   1.398   0.658
  253    HB2  SER  36           HB2      SER  36 -12.323  -0.596  -0.913
  254    HB3  SER  36           HB3      SER  36 -11.930  -1.627   0.476
  255    HG   SER  36           HG       SER  36 -14.182  -1.423  -0.202
  256    H    GLY  37           H        GLY  37 -12.712   1.785   2.896
  257    HA2  GLY  37           HA2      GLY  37 -10.760   1.217   4.855
  258    HA3  GLY  37           HA3      GLY  37 -12.407   1.766   5.166
  259    H    CYS  38           H        CYS  38 -13.509  -0.643   3.782
  260    HA   CYS  38           HA       CYS  38 -13.253  -2.649   5.963
  261    HB2  CYS  38           HB2      CYS  38 -15.458  -1.793   5.813
  262    HB3  CYS  38           HB3      CYS  38 -15.456  -1.784   4.063
  263    H    GLY  39           H        GLY  39 -12.510  -4.682   5.304
  264    HA2  GLY  39           HA2      GLY  39 -11.803  -6.328   3.802
  265    HA3  GLY  39           HA3      GLY  39 -12.379  -5.335   2.455
  266    H    GLY  40           H        GLY  40 -10.198  -6.222   1.677
  267    HA2  GLY  40           HA2      GLY  40  -8.242  -5.291   0.738
  268    HA3  GLY  40           HA3      GLY  40  -8.252  -4.022   1.938
  269    H    ASN  41           H        ASN  41  -5.826  -4.935   1.597
  270    HA   ASN  41           HA       ASN  41  -5.298  -6.845   3.813
  271    HB2  ASN  41           HB2      ASN  41  -4.082  -6.811   1.035
  272    HB3  ASN  41           HB3      ASN  41  -3.184  -7.401   2.411
  273   HD21  ASN  41          HD21      ASN  41  -5.246  -8.507   0.003
  274   HD22  ASN  41          HD22      ASN  41  -5.906  -9.895   0.794
  275    H    ALA  42           H        ALA  42  -3.141  -6.632   4.656
  276    HA   ALA  42           HA       ALA  42  -2.583  -4.118   5.628
  277    HB1  ALA  42           HB1      ALA  42  -0.561  -6.368   5.346
  278    HB2  ALA  42           HB2      ALA  42  -0.574  -5.080   6.556
  279    HB3  ALA  42           HB3      ALA  42  -1.848  -6.317   6.587
  280    H    ASN  43           H        ASN  43  -1.694  -5.019   2.307
  281    HA   ASN  43           HA       ASN  43   0.746  -3.480   2.368
  282    HB2  ASN  43           HB2      ASN  43   0.862  -3.746   0.056
  283    HB3  ASN  43           HB3      ASN  43   0.169  -5.251   0.643
  284   HD21  ASN  43          HD21      ASN  43  -0.205  -2.540  -1.401
  285   HD22  ASN  43          HD22      ASN  43  -1.763  -2.992  -2.061
  286    H    ARG  44           H        ARG  44  -2.267  -2.387   2.863
  287    HA   ARG  44           HA       ARG  44  -2.259   0.029   1.278
  288    HB2  ARG  44           HB2      ARG  44  -4.317  -1.031   2.017
  289    HB3  ARG  44           HB3      ARG  44  -3.826  -1.008   3.718
  290    HG2  ARG  44           HG2      ARG  44  -3.750   1.628   2.425
  291    HG3  ARG  44           HG3      ARG  44  -5.353   0.932   2.427
  292    HD2  ARG  44           HD2      ARG  44  -5.339   0.910   4.853
  293    HD3  ARG  44           HD3      ARG  44  -3.605   1.352   4.853
  294    HE   ARG  44           HE       ARG  44  -5.164   3.118   3.243
  295   HH11  ARG  44          HH11      ARG  44  -4.210   2.522   6.601
  296   HH12  ARG  44          HH12      ARG  44  -4.200   4.182   7.095
  297   HH21  ARG  44          HH21      ARG  44  -5.286   5.267   3.823
  298   HH22  ARG  44          HH22      ARG  44  -5.068   5.817   5.464
  299    H    PHE  45           H        PHE  45  -1.342   1.913   1.787
  300    HA   PHE  45           HA       PHE  45  -0.419   2.464   4.567
  301    HB2  PHE  45           HB2      PHE  45   0.958   3.036   1.919
  302    HB3  PHE  45           HB3      PHE  45   1.410   3.826   3.430
  303    HD1  PHE  45           HD1      PHE  45   2.104   2.406   5.444
  304    HD2  PHE  45           HD2      PHE  45   1.658   0.792   1.449
  305    HE1  PHE  45           HE1      PHE  45   3.400   0.439   6.093
  306    HE2  PHE  45           HE2      PHE  45   3.028  -1.132   2.085
  307    HZ   PHE  45           HZ       PHE  45   3.984  -1.293   4.409
  308    H    ARG  46           H        ARG  46  -0.097   4.867   4.854
  309    HA   ARG  46           HA       ARG  46  -2.445   6.339   3.766
  310    HB2  ARG  46           HB2      ARG  46  -1.914   7.775   5.925
  311    HB3  ARG  46           HB3      ARG  46  -2.876   6.319   5.973
  312    HG2  ARG  46           HG2      ARG  46  -1.327   6.489   7.861
  313    HG3  ARG  46           HG3      ARG  46  -1.134   5.013   6.937
  314    HD2  ARG  46           HD2      ARG  46   0.997   5.838   7.629
  315    HD3  ARG  46           HD3      ARG  46   0.931   5.949   5.884
  316    HE   ARG  46           HE       ARG  46   0.617   8.359   6.043
  317   HH11  ARG  46          HH11      ARG  46   1.908   6.756   9.013
  318   HH12  ARG  46          HH12      ARG  46   2.629   8.234   9.528
  319   HH21  ARG  46          HH21      ARG  46   1.090  10.284   7.126
  320   HH22  ARG  46          HH22      ARG  46   2.115  10.243   8.523
  321    H    THR  47           H        THR  47   0.997   6.290   3.568
  322    HA   THR  47           HA       THR  47   0.938   8.550   1.931
  323    HB   THR  47           HB       THR  47   0.973   9.631   4.267
  324    HG1  THR  47           HG1      THR  47   1.560  10.812   2.528
  325   HG21  THR  47          HG21      THR  47   3.879   8.795   4.235
  326   HG22  THR  47          HG22      THR  47   2.692   7.861   5.082
  327   HG23  THR  47          HG23      THR  47   3.001   9.574   5.538
  328    H    ILE  48           H        ILE  48   3.031   8.897   0.907
  329    HA   ILE  48           HA       ILE  48   4.306   6.432   0.506
  330    HB   ILE  48           HB       ILE  48   4.096   7.862  -1.321
  331   HG12  ILE  48          HG12      ILE  48   7.059   7.722  -0.677
  332   HG13  ILE  48          HG13      ILE  48   6.096   6.328  -1.096
  333   HG21  ILE  48          HG21      ILE  48   4.150  10.075  -0.194
  334   HG22  ILE  48          HG22      ILE  48   5.891   9.883   0.097
  335   HG23  ILE  48          HG23      ILE  48   5.261  10.036  -1.553
  336   HD11  ILE  48          HD11      ILE  48   6.502   8.708  -2.918
  337   HD12  ILE  48          HD12      ILE  48   7.273   7.120  -3.053
  338   HD13  ILE  48          HD13      ILE  48   5.518   7.269  -3.277
  339    H    ASP  49           H        ASP  49   4.939   9.139   2.617
  340    HA   ASP  49           HA       ASP  49   7.725   8.734   3.079
  341    HB2  ASP  49           HB2      ASP  49   5.754   9.704   5.145
  342    HB3  ASP  49           HB3      ASP  49   7.482  10.035   5.070
  343    H    GLU  50           H        GLU  50   4.846   7.169   4.332
  344    HA   GLU  50           HA       GLU  50   6.267   5.770   6.492
  345    HB2  GLU  50           HB2      GLU  50   3.787   6.665   6.410
  346    HB3  GLU  50           HB3      GLU  50   3.437   5.166   5.559
  347    HG2  GLU  50           HG2      GLU  50   4.373   5.688   8.376
  348    HG3  GLU  50           HG3      GLU  50   2.936   4.828   7.826
  349    H    CYS  51           H        CYS  51   4.505   5.014   3.429
  350    HA   CYS  51           HA       CYS  51   5.130   2.320   3.488
  351    HB2  CYS  51           HB2      CYS  51   4.189   2.180   1.343
  352    HB3  CYS  51           HB3      CYS  51   3.480   3.667   2.001
  353    H    ASN  52           H        ASN  52   7.100   4.978   2.131
  354    HA   ASN  52           HA       ASN  52   8.968   3.116   1.020
  355    HB2  ASN  52           HB2      ASN  52  10.019   4.807  -0.006
  356    HB3  ASN  52           HB3      ASN  52   8.456   5.552   0.211
  357   HD21  ASN  52          HD21      ASN  52   8.356   7.374   1.404
  358   HD22  ASN  52          HD22      ASN  52   9.721   8.217   2.099
  359    H    ARG  53           H        ARG  53   9.149   5.347   3.894
  360    HA   ARG  53           HA       ARG  53  11.591   4.297   4.722
  361    HB2  ARG  53           HB2      ARG  53  11.338   5.413   6.718
  362    HB3  ARG  53           HB3      ARG  53  10.255   6.303   5.642
  363    HG2  ARG  53           HG2      ARG  53   8.335   5.021   6.592
  364    HG3  ARG  53           HG3      ARG  53   9.421   4.237   7.730
  365    HD2  ARG  53           HD2      ARG  53   9.064   7.256   7.534
  366    HD3  ARG  53           HD3      ARG  53   8.148   6.225   8.633
  367    HE   ARG  53           HE       ARG  53  10.265   5.507   9.665
  368   HH11  ARG  53          HH11      ARG  53  10.538   8.569   7.758
  369   HH12  ARG  53          HH12      ARG  53  11.938   9.042   8.653
  370   HH21  ARG  53          HH21      ARG  53  11.996   6.353  10.893
  371   HH22  ARG  53          HH22      ARG  53  12.854   7.736  10.284
  372    H    THR  54           H        THR  54   8.448   2.730   5.079
  373    HA   THR  54           HA       THR  54   9.577   0.718   6.870
  374    HB   THR  54           HB       THR  54   7.317   1.968   6.951
  375    HG1  THR  54           HG1      THR  54   6.592   0.467   8.256
  376   HG21  THR  54          HG21      THR  54   5.474   1.029   5.969
  377   HG22  THR  54          HG22      THR  54   6.289  -0.501   5.535
  378   HG23  THR  54          HG23      THR  54   6.618   1.004   4.646
  379    H    CYS  55           H        CYS  55   9.247   0.898   3.375
  380    HA   CYS  55           HA       CYS  55   9.947  -2.002   3.301
  381    HB2  CYS  55           HB2      CYS  55   7.868  -0.777   1.479
  382    HB3  CYS  55           HB3      CYS  55   8.468  -2.432   1.474
  383    H    VAL  56           H        VAL  56  10.325   1.139   1.878
  384    HA   VAL  56           HA       VAL  56  11.654   0.108  -0.565
  385    HB   VAL  56           HB       VAL  56  11.227   2.877   0.557
  386   HG11  VAL  56          HG11      VAL  56  12.089   3.858  -1.463
  387   HG12  VAL  56          HG12      VAL  56  13.375   3.018  -0.594
  388   HG13  VAL  56          HG13      VAL  56  12.644   2.283  -2.034
  389   HG21  VAL  56          HG21      VAL  56   9.799   3.102  -1.467
  390   HG22  VAL  56          HG22      VAL  56  10.249   1.469  -1.971
  391   HG23  VAL  56          HG23      VAL  56   9.271   1.719  -0.513
  392    H    GLY  57           H        GLY  57  13.163  -1.269   0.269
  393    HA2  GLY  57           HA2      GLY  57  15.073  -0.448   2.331
  394    HA3  GLY  57           HA3      GLY  57  14.988  -1.997   1.471
  Start of MODEL   20
    1    H1   ARG   1           H        ARG   1  13.125  -4.503   3.117
    2    HA   ARG   1           HA       ARG   1  10.773  -4.063   3.315
    3    HB2  ARG   1           HB2      ARG   1   9.947  -4.743   1.110
    4    HB3  ARG   1           HB3      ARG   1  11.534  -3.996   1.105
    5    HG2  ARG   1           HG2      ARG   1  12.053  -6.804   1.157
    6    HG3  ARG   1           HG3      ARG   1  10.700  -6.574   0.064
    7    HD2  ARG   1           HD2      ARG   1  12.755  -6.412  -1.166
    8    HD3  ARG   1           HD3      ARG   1  11.972  -4.817  -1.152
    9    HE   ARG   1           HE       ARG   1  13.713  -4.647   0.969
   10   HH11  ARG   1          HH11      ARG   1  14.103  -5.312  -2.482
   11   HH12  ARG   1          HH12      ARG   1  15.790  -4.881  -2.494
   12   HH21  ARG   1          HH21      ARG   1  15.899  -4.347   1.019
   13   HH22  ARG   1          HH22      ARG   1  16.864  -4.248  -0.421
   14    HA   PRO   2           HA       PRO   2   8.915  -7.542   5.379
   15    HB2  PRO   2           HB2      PRO   2   6.672  -6.325   6.263
   16    HB3  PRO   2           HB3      PRO   2   8.271  -5.960   6.976
   17    HG2  PRO   2           HG2      PRO   2   6.788  -4.399   4.860
   18    HG3  PRO   2           HG3      PRO   2   7.576  -3.769   6.348
   19    HD2  PRO   2           HD2      PRO   2   8.824  -3.742   3.925
   20    HD3  PRO   2           HD3      PRO   2   9.736  -4.055   5.434
   21    H    ARG   3           H        ARG   3   7.625  -9.089   4.574
   22    HA   ARG   3           HA       ARG   3   6.522  -8.923   1.994
   23    HB2  ARG   3           HB2      ARG   3   5.803 -11.113   2.222
   24    HB3  ARG   3           HB3      ARG   3   7.211 -11.017   3.266
   25    HG2  ARG   3           HG2      ARG   3   4.284 -11.028   4.130
   26    HG3  ARG   3           HG3      ARG   3   5.438 -12.347   4.268
   27    HD2  ARG   3           HD2      ARG   3   6.758 -11.144   5.921
   28    HD3  ARG   3           HD3      ARG   3   5.743  -9.706   5.711
   29    HE   ARG   3           HE       ARG   3   4.385 -12.179   6.504
   30   HH11  ARG   3          HH11      ARG   3   5.836  -9.142   7.736
   31   HH12  ARG   3          HH12      ARG   3   4.594  -8.984   8.970
   32   HH21  ARG   3          HH21      ARG   3   2.957 -11.957   8.341
   33   HH22  ARG   3          HH22      ARG   3   3.125 -10.537   9.359
   34    H    PHE   4           H        PHE   4   4.978  -7.854   4.979
   35    HA   PHE   4           HA       PHE   4   2.300  -8.213   4.054
   36    HB2  PHE   4           HB2      PHE   4   1.621  -6.787   5.798
   37    HB3  PHE   4           HB3      PHE   4   2.933  -7.758   6.407
   38    HD1  PHE   4           HD2      PHE   4   2.274  -4.344   4.873
   39    HD2  PHE   4           HD1      PHE   4   4.571  -6.685   7.680
   40    HE1  PHE   4           HE2      PHE   4   3.568  -2.317   5.541
   41    HE2  PHE   4           HE1      PHE   4   5.783  -4.650   8.382
   42    HZ   PHE   4           HZ       PHE   4   5.296  -2.455   7.283
   43    H    CYS   5           H        CYS   5   4.819  -5.925   3.130
   44    HA   CYS   5           HA       CYS   5   3.101  -3.916   2.130
   45    HB2  CYS   5           HB2      CYS   5   5.809  -4.290   2.675
   46    HB3  CYS   5           HB3      CYS   5   5.800  -4.209   0.932
   47    H    GLU   6           H        GLU   6   4.085  -7.024   0.832
   48    HA   GLU   6           HA       GLU   6   3.509  -6.214  -1.940
   49    HB2  GLU   6           HB2      GLU   6   4.573  -8.190  -2.579
   50    HB3  GLU   6           HB3      GLU   6   5.495  -7.608  -1.203
   51    HG2  GLU   6           HG2      GLU   6   5.242  -9.505  -0.093
   52    HG3  GLU   6           HG3      GLU   6   3.487  -9.428  -0.205
   53    H    LEU   7           H        LEU   7   1.386  -6.846   0.443
   54    HA   LEU   7           HA       LEU   7  -0.029  -9.076  -0.714
   55    HB2  LEU   7           HB2      LEU   7  -0.929  -7.002   1.287
   56    HB3  LEU   7           HB3      LEU   7  -1.788  -8.513   0.898
   57    HG   LEU   7           HG       LEU   7   0.913  -8.210   2.250
   58   HD11  LEU   7          HD11      LEU   7  -0.162  -9.112   4.173
   59   HD12  LEU   7          HD12      LEU   7  -1.648  -9.488   3.265
   60   HD13  LEU   7          HD13      LEU   7  -1.186  -7.807   3.575
   61   HD21  LEU   7          HD21      LEU   7   0.939 -10.621   2.599
   62   HD22  LEU   7          HD22      LEU   7   1.148 -10.172   0.910
   63   HD23  LEU   7          HD23      LEU   7  -0.438 -10.794   1.460
   64    H    ALA   8           H        ALA   8  -2.299  -8.881  -1.314
   65    HA   ALA   8           HA       ALA   8  -2.583  -6.888  -3.506
   66    HB1  ALA   8           HB1      ALA   8  -4.087  -9.461  -2.897
   67    HB2  ALA   8           HB2      ALA   8  -4.373  -8.397  -4.300
   68    HB3  ALA   8           HB3      ALA   8  -2.822  -9.236  -4.124
   69    HA   PRO   9           HA       PRO   9  -5.249  -4.907  -0.460
   70    HB2  PRO   9           HB2      PRO   9  -6.137  -2.752  -1.865
   71    HB3  PRO   9           HB3      PRO   9  -4.527  -2.872  -1.111
   72    HG2  PRO   9           HG2      PRO   9  -5.284  -3.411  -4.003
   73    HG3  PRO   9           HG3      PRO   9  -3.897  -2.474  -3.370
   74    HD2  PRO   9           HD2      PRO   9  -3.680  -5.080  -4.180
   75    HD3  PRO   9           HD3      PRO   9  -2.691  -4.426  -2.843
   76    H    SER  10           H        SER  10  -6.918  -6.454  -0.314
   77    HA   SER  10           HA       SER  10  -8.854  -6.933  -2.326
   78    HB2  SER  10           HB2      SER  10  -7.997  -8.498  -0.498
   79    HB3  SER  10           HB3      SER  10  -9.084  -7.652   0.616
   80    HG   SER  10           HG       SER  10 -10.167  -9.416  -0.252
   81    H    ALA  11           H        ALA  11  -9.109  -4.323  -2.332
   82    HA   ALA  11           HA       ALA  11 -10.917  -3.172  -0.401
   83    HB1  ALA  11           HB1      ALA  11 -10.926  -1.266  -2.016
   84    HB2  ALA  11           HB2      ALA  11  -9.282  -1.841  -1.656
   85    HB3  ALA  11           HB3      ALA  11 -10.073  -2.277  -3.190
   86    H    GLY  12           H        GLY  12 -11.617  -5.284  -3.080
   87    HA2  GLY  12           HA2      GLY  12 -14.072  -4.149  -3.942
   88    HA3  GLY  12           HA3      GLY  12 -13.537  -5.820  -4.138
   89    H    SER  13           H        SER  13 -13.465  -5.696  -0.893
   90    HA   SER  13           HA       SER  13 -15.707  -7.233  -0.467
   91    HB2  SER  13           HB2      SER  13 -14.365  -5.439   1.574
   92    HB3  SER  13           HB3      SER  13 -15.164  -6.996   1.870
   93    HG   SER  13           HG       SER  13 -13.482  -7.998   0.675
   94    H    CYS  14           H        CYS  14 -15.560  -3.620  -0.170
   95    HA   CYS  14           HA       CYS  14 -18.504  -3.569  -0.041
   96    HB2  CYS  14           HB2      CYS  14 -16.703  -2.229   2.012
   97    HB3  CYS  14           HB3      CYS  14 -18.418  -1.913   1.835
   98    H    PHE  15           H        PHE  15 -19.281  -1.295  -0.287
   99    HA   PHE  15           HA       PHE  15 -17.581   0.087  -2.262
  100    HB2  PHE  15           HB2      PHE  15 -20.032  -0.356  -2.692
  101    HB3  PHE  15           HB3      PHE  15 -20.410   0.773  -1.389
  102    HD1  PHE  15           HD1      PHE  15 -19.343   3.217  -1.583
  103    HD2  PHE  15           HD2      PHE  15 -19.738   0.453  -4.888
  104    HE1  PHE  15           HE1      PHE  15 -18.927   5.049  -3.184
  105    HE2  PHE  15           HE2      PHE  15 -19.470   2.332  -6.462
  106    HZ   PHE  15           HZ       PHE  15 -19.071   4.648  -5.597
  107    H    ALA  16           H        ALA  16 -16.100   1.423  -1.390
  108    HA   ALA  16           HA       ALA  16 -16.949   3.551   0.392
  109    HB1  ALA  16           HB1      ALA  16 -14.717   1.619   1.112
  110    HB2  ALA  16           HB2      ALA  16 -15.010   3.166   1.910
  111    HB3  ALA  16           HB3      ALA  16 -16.218   1.860   2.021
  112    H    PHE  17           H        PHE  17 -15.422   5.296   0.166
  113    HA   PHE  17           HA       PHE  17 -13.423   4.914  -2.030
  114    HB2  PHE  17           HB2      PHE  17 -15.599   6.070  -2.646
  115    HB3  PHE  17           HB3      PHE  17 -15.109   7.390  -1.594
  116    HD1  PHE  17           HD2      PHE  17 -11.979   6.518  -2.891
  117    HD2  PHE  17           HD1      PHE  17 -15.796   8.075  -4.228
  118    HE1  PHE  17           HE2      PHE  17 -10.884   7.519  -4.805
  119    HE2  PHE  17           HE1      PHE  17 -14.662   9.112  -6.156
  120    HZ   PHE  17           HZ       PHE  17 -12.198   8.856  -6.453
  121    H    VAL  18           H        VAL  18 -11.624   4.755  -0.769
  122    HA   VAL  18           HA       VAL  18 -10.828   7.130   0.778
  123    HB   VAL  18           HB       VAL  18  -9.784   5.493   2.466
  124   HG11  VAL  18          HG11      VAL  18 -12.777   6.064   2.459
  125   HG12  VAL  18          HG12      VAL  18 -11.798   5.638   3.876
  126   HG13  VAL  18          HG13      VAL  18 -11.463   7.138   3.017
  127   HG21  VAL  18          HG21      VAL  18 -11.059   3.486   3.008
  128   HG22  VAL  18          HG22      VAL  18 -12.136   3.726   1.622
  129   HG23  VAL  18          HG23      VAL  18 -10.419   3.339   1.372
  130    HA   PRO  19           HA       PRO  19  -7.723   5.785  -2.285
  131    HB2  PRO  19           HB2      PRO  19  -6.520   8.230  -2.689
  132    HB3  PRO  19           HB3      PRO  19  -7.988   7.676  -3.553
  133    HG2  PRO  19           HG2      PRO  19  -7.810   9.464  -1.125
  134    HG3  PRO  19           HG3      PRO  19  -8.822   9.662  -2.584
  135    HD2  PRO  19           HD2      PRO  19  -9.792   8.639  -0.251
  136    HD3  PRO  19           HD3      PRO  19 -10.367   8.046  -1.839
  137    H    SER  20           H        SER  20  -6.048   4.767  -1.437
  138    HA   SER  20           HA       SER  20  -4.528   5.947   0.794
  139    HB2  SER  20           HB2      SER  20  -5.181   3.010   0.581
  140    HB3  SER  20           HB3      SER  20  -4.435   3.893   1.913
  141    HG   SER  20           HG       SER  20  -7.072   4.327   0.960
  142    H    TYR  21           H        TYR  21  -2.443   4.125   0.926
  143    HA   TYR  21           HA       TYR  21  -1.156   4.505  -1.743
  144    HB2  TYR  21           HB2      TYR  21  -0.382   5.047   1.058
  145    HB3  TYR  21           HB3      TYR  21   0.792   4.314   0.053
  146    HD1  TYR  21           HD2      TYR  21   1.924   5.691  -1.890
  147    HD2  TYR  21           HD1      TYR  21  -1.248   7.252   0.674
  148    HE1  TYR  21           HE2      TYR  21   2.348   7.946  -2.699
  149    HE2  TYR  21           HE1      TYR  21  -0.667   9.525  -0.018
  150    HH   TYR  21           HH       TYR  21   1.664  10.249  -2.618
  151    H    TYR  22           H        TYR  22  -0.066   2.941  -2.718
  152    HA   TYR  22           HA       TYR  22  -0.191   0.136  -1.775
  153    HB2  TYR  22           HB2      TYR  22  -1.246   1.155  -4.043
  154    HB3  TYR  22           HB3      TYR  22   0.412   1.283  -4.545
  155    HD1  TYR  22           HD1      TYR  22   1.791  -0.799  -5.032
  156    HD2  TYR  22           HD2      TYR  22  -2.420  -0.910  -4.130
  157    HE1  TYR  22           HE1      TYR  22   1.711  -3.098  -5.859
  158    HE2  TYR  22           HE2      TYR  22  -2.539  -3.188  -5.146
  159    HH   TYR  22           HH       TYR  22   0.319  -4.881  -6.483
  160    H    TYR  23           H        TYR  23   1.784  -1.130  -2.582
  161    HA   TYR  23           HA       TYR  23   4.344   0.460  -2.678
  162    HB2  TYR  23           HB2      TYR  23   4.262  -0.468  -0.478
  163    HB3  TYR  23           HB3      TYR  23   3.700  -2.013  -1.071
  164    HD1  TYR  23           HD1      TYR  23   6.679   0.306  -1.237
  165    HD2  TYR  23           HD2      TYR  23   5.259  -3.752  -1.492
  166    HE1  TYR  23           HE1      TYR  23   8.984  -0.486  -1.111
  167    HE2  TYR  23           HE2      TYR  23   7.591  -4.553  -1.262
  168    HH   TYR  23           HH       TYR  23  10.222  -2.554  -0.445
  169    H    ASN  24           H        ASN  24   5.842  -0.226  -4.239
  170    HA   ASN  24           HA       ASN  24   5.283  -2.793  -5.624
  171    HB2  ASN  24           HB2      ASN  24   5.282  -0.051  -6.825
  172    HB3  ASN  24           HB3      ASN  24   6.167  -1.291  -7.700
  173   HD21  ASN  24          HD21      ASN  24   3.285   0.123  -8.044
  174   HD22  ASN  24          HD22      ASN  24   2.339  -1.283  -8.461
  175    H    GLN  25           H        GLN  25   6.916  -3.800  -4.606
  176    HA   GLN  25           HA       GLN  25   9.508  -2.822  -4.099
  177    HB2  GLN  25           HB2      GLN  25  10.239  -5.247  -4.175
  178    HB3  GLN  25           HB3      GLN  25   9.048  -4.822  -2.985
  179    HG2  GLN  25           HG2      GLN  25   8.332  -6.167  -5.623
  180    HG3  GLN  25           HG3      GLN  25   8.723  -7.022  -4.125
  181   HE21  GLN  25          HE21      GLN  25   6.082  -5.813  -5.857
  182   HE22  GLN  25          HE22      GLN  25   4.954  -5.674  -4.546
  183    H    TYR  26           H        TYR  26   8.154  -4.180  -7.083
  184    HA   TYR  26           HA       TYR  26  10.400  -4.704  -8.585
  185    HB2  TYR  26           HB2      TYR  26   7.912  -3.276  -9.586
  186    HB3  TYR  26           HB3      TYR  26   8.986  -4.302 -10.521
  187    HD1  TYR  26           HD2      TYR  26   9.186  -6.835  -9.637
  188    HD2  TYR  26           HD1      TYR  26   5.905  -4.161  -8.780
  189    HE1  TYR  26           HE2      TYR  26   7.701  -8.779  -9.284
  190    HE2  TYR  26           HE1      TYR  26   4.426  -6.092  -8.389
  191    HH   TYR  26           HH       TYR  26   5.516  -9.494  -8.589
  192    H    SER  27           H        SER  27   9.034  -1.515  -7.789
  193    HA   SER  27           HA       SER  27  11.121  -0.125  -9.390
  194    HB2  SER  27           HB2      SER  27   8.718   0.166 -10.012
  195    HB3  SER  27           HB3      SER  27   8.386   0.742  -8.374
  196    HG   SER  27           HG       SER  27   9.719   1.987 -10.509
  197    H    ASN  28           H        ASN  28  10.778  -1.256  -6.342
  198    HA   ASN  28           HA       ASN  28  11.262  -0.674  -4.242
  199    HB2  ASN  28           HB2      ASN  28  13.469  -0.870  -5.436
  200    HB3  ASN  28           HB3      ASN  28  13.486   0.890  -5.593
  201   HD21  ASN  28          HD21      ASN  28  12.753  -1.421  -2.835
  202   HD22  ASN  28          HD22      ASN  28  13.962  -0.646  -1.808
  203    H    THR  29           H        THR  29   9.117   0.785  -5.062
  204    HA   THR  29           HA       THR  29   9.358   3.131  -3.428
  205    HB   THR  29           HB       THR  29  10.221   3.767  -5.726
  206    HG1  THR  29           HG1      THR  29   9.397   5.183  -4.086
  207   HG21  THR  29          HG21      THR  29   7.304   3.869  -6.508
  208   HG22  THR  29          HG22      THR  29   8.417   2.591  -7.053
  209   HG23  THR  29          HG23      THR  29   8.714   4.283  -7.492
  210    H    CYS  30           H        CYS  30   6.943   4.372  -4.003
  211    HA   CYS  30           HA       CYS  30   4.854   2.272  -3.785
  212    HB2  CYS  30           HB2      CYS  30   4.856   4.552  -1.872
  213    HB3  CYS  30           HB3      CYS  30   4.276   2.893  -1.821
  214    H    HIS  31           H        HIS  31   2.596   3.304  -3.889
  215    HA   HIS  31           HA       HIS  31   2.605   5.972  -5.124
  216    HB2  HIS  31           HB2      HIS  31   3.110   3.887  -6.764
  217    HB3  HIS  31           HB3      HIS  31   1.379   3.685  -6.687
  218    HD1  HIS  31           HD1      HIS  31   0.486   4.803  -8.908
  219    HD2  HIS  31           HD2      HIS  31   3.763   6.721  -7.074
  220    HE1  HIS  31           HE1      HIS  31   1.084   6.771 -10.427
  221    H    SER  32           H        SER  32   0.396   6.936  -5.166
  222    HA   SER  32           HA       SER  32  -1.368   5.595  -3.311
  223    HB2  SER  32           HB2      SER  32  -2.891   7.555  -4.025
  224    HB3  SER  32           HB3      SER  32  -1.582   7.728  -2.864
  225    HG   SER  32           HG       SER  32  -1.668   9.363  -4.503
  226    H    PHE  33           H        PHE  33  -3.329   4.711  -3.635
  227    HA   PHE  33           HA       PHE  33  -4.360   4.105  -6.301
  228    HB2  PHE  33           HB2      PHE  33  -4.190   1.809  -6.144
  229    HB3  PHE  33           HB3      PHE  33  -2.633   2.328  -5.507
  230    HD1  PHE  33           HD2      PHE  33  -2.522   2.597  -2.886
  231    HD2  PHE  33           HD1      PHE  33  -5.533   0.303  -4.911
  232    HE1  PHE  33           HE2      PHE  33  -3.002   1.306  -0.775
  233    HE2  PHE  33           HE1      PHE  33  -6.081  -0.833  -2.822
  234    HZ   PHE  33           HZ       PHE  33  -4.707  -0.331  -0.704
  235    H    THR  34           H        THR  34  -6.431   2.490  -5.603
  236    HA   THR  34           HA       THR  34  -7.998   4.188  -3.659
  237    HB   THR  34           HB       THR  34 -10.036   3.304  -4.787
  238    HG1  THR  34           HG1      THR  34  -9.781   1.816  -6.140
  239   HG21  THR  34          HG21      THR  34  -8.180   4.844  -6.625
  240   HG22  THR  34          HG22      THR  34  -9.090   5.561  -5.275
  241   HG23  THR  34          HG23      THR  34  -9.950   4.838  -6.647
  242    H    TYR  35           H        TYR  35  -8.741   3.355  -1.735
  243    HA   TYR  35           HA       TYR  35  -8.648   0.415  -1.441
  244    HB2  TYR  35           HB2      TYR  35  -6.979   1.806  -0.126
  245    HB3  TYR  35           HB3      TYR  35  -8.331   2.342   0.845
  246    HD1  TYR  35           HD1      TYR  35  -6.913  -0.891  -0.533
  247    HD2  TYR  35           HD2      TYR  35  -8.540   1.176   2.880
  248    HE1  TYR  35           HE1      TYR  35  -6.199  -2.752   0.925
  249    HE2  TYR  35           HE2      TYR  35  -7.895  -0.721   4.332
  250    HH   TYR  35           HH       TYR  35  -5.567  -3.085   3.410
  251    H    SER  36           H        SER  36 -10.066  -0.017   0.884
  252    HA   SER  36           HA       SER  36 -12.617   1.409   0.699
  253    HB2  SER  36           HB2      SER  36 -12.772  -0.530  -0.831
  254    HB3  SER  36           HB3      SER  36 -12.338  -1.619   0.503
  255    HG   SER  36           HG       SER  36 -14.676  -1.151  -0.167
  256    H    GLY  37           H        GLY  37 -14.045   0.444   2.566
  257    HA2  GLY  37           HA2      GLY  37 -12.529   0.846   5.036
  258    HA3  GLY  37           HA3      GLY  37 -14.260   0.622   4.877
  259    H    CYS  38           H        CYS  38 -14.764  -1.671   3.814
  260    HA   CYS  38           HA       CYS  38 -14.054  -3.714   5.669
  261    HB2  CYS  38           HB2      CYS  38 -15.198  -3.895   2.863
  262    HB3  CYS  38           HB3      CYS  38 -15.276  -5.182   4.057
  263    H    GLY  39           H        GLY  39 -13.340  -5.891   4.882
  264    HA2  GLY  39           HA2      GLY  39 -11.552  -7.219   4.460
  265    HA3  GLY  39           HA3      GLY  39 -11.925  -6.786   2.795
  266    H    GLY  40           H        GLY  40 -10.273  -6.079   1.646
  267    HA2  GLY  40           HA2      GLY  40  -8.300  -5.017   1.065
  268    HA3  GLY  40           HA3      GLY  40  -8.437  -4.094   2.559
  269    H    ASN  41           H        ASN  41  -5.928  -4.774   1.886
  270    HA   ASN  41           HA       ASN  41  -5.213  -6.793   3.935
  271    HB2  ASN  41           HB2      ASN  41  -4.136  -6.836   1.080
  272    HB3  ASN  41           HB3      ASN  41  -3.225  -7.446   2.429
  273   HD21  ASN  41          HD21      ASN  41  -5.333  -8.571   0.108
  274   HD22  ASN  41          HD22      ASN  41  -5.919  -9.976   0.987
  275    H    ALA  42           H        ALA  42  -2.894  -6.612   4.525
  276    HA   ALA  42           HA       ALA  42  -2.290  -4.137   5.549
  277    HB1  ALA  42           HB1      ALA  42  -0.159  -5.092   6.167
  278    HB2  ALA  42           HB2      ALA  42  -1.404  -6.355   6.306
  279    HB3  ALA  42           HB3      ALA  42  -0.293  -6.321   4.903
  280    H    ASN  43           H        ASN  43  -1.720  -5.013   2.206
  281    HA   ASN  43           HA       ASN  43   0.624  -3.473   1.716
  282    HB2  ASN  43           HB2      ASN  43   0.286  -4.757  -0.074
  283    HB3  ASN  43           HB3      ASN  43  -1.446  -4.902   0.201
  284   HD21  ASN  43          HD21      ASN  43   0.843  -3.619  -1.968
  285   HD22  ASN  43          HD22      ASN  43  -0.387  -2.739  -2.861
  286    H    ARG  44           H        ARG  44  -2.373  -2.314   2.776
  287    HA   ARG  44           HA       ARG  44  -2.289   0.191   1.259
  288    HB2  ARG  44           HB2      ARG  44  -4.403  -0.870   1.777
  289    HB3  ARG  44           HB3      ARG  44  -4.069  -0.864   3.509
  290    HG2  ARG  44           HG2      ARG  44  -3.899   1.837   2.338
  291    HG3  ARG  44           HG3      ARG  44  -5.436   1.081   1.993
  292    HD2  ARG  44           HD2      ARG  44  -5.613   0.541   4.482
  293    HD3  ARG  44           HD3      ARG  44  -4.224   1.610   4.724
  294    HE   ARG  44           HE       ARG  44  -5.833   3.246   3.334
  295   HH11  ARG  44          HH11      ARG  44  -6.874   1.067   5.992
  296   HH12  ARG  44          HH12      ARG  44  -8.141   2.151   6.470
  297   HH21  ARG  44          HH21      ARG  44  -7.397   4.633   4.096
  298   HH22  ARG  44          HH22      ARG  44  -8.643   4.061   5.169
  299    H    PHE  45           H        PHE  45  -1.420   2.037   1.965
  300    HA   PHE  45           HA       PHE  45  -0.624   2.375   4.814
  301    HB2  PHE  45           HB2      PHE  45   0.934   3.506   2.463
  302    HB3  PHE  45           HB3      PHE  45   1.440   3.408   4.143
  303    HD1  PHE  45           HD1      PHE  45   1.333   0.866   5.131
  304    HD2  PHE  45           HD2      PHE  45   1.671   1.907   0.957
  305    HE1  PHE  45           HE1      PHE  45   1.866  -1.474   4.568
  306    HE2  PHE  45           HE2      PHE  45   2.317  -0.406   0.441
  307    HZ   PHE  45           HZ       PHE  45   2.377  -2.086   2.216
  308    H    ARG  46           H        ARG  46  -0.111   4.753   5.168
  309    HA   ARG  46           HA       ARG  46  -2.363   6.388   4.103
  310    HB2  ARG  46           HB2      ARG  46  -1.649   7.886   6.129
  311    HB3  ARG  46           HB3      ARG  46  -2.681   6.485   6.324
  312    HG2  ARG  46           HG2      ARG  46  -1.033   6.687   8.123
  313    HG3  ARG  46           HG3      ARG  46  -0.944   5.158   7.266
  314    HD2  ARG  46           HD2      ARG  46   1.279   5.928   7.769
  315    HD3  ARG  46           HD3      ARG  46   1.073   5.966   6.036
  316    HE   ARG  46           HE       ARG  46   0.869   8.356   6.068
  317   HH11  ARG  46          HH11      ARG  46   2.175   6.901   9.068
  318   HH12  ARG  46          HH12      ARG  46   2.865   8.368   9.606
  319   HH21  ARG  46          HH21      ARG  46   1.558  10.399   6.987
  320   HH22  ARG  46          HH22      ARG  46   2.396  10.349   8.508
  321    H    THR  47           H        THR  47   1.096   6.028   3.790
  322    HA   THR  47           HA       THR  47   1.104   8.159   1.985
  323    HB   THR  47           HB       THR  47   1.333   9.477   4.131
  324    HG1  THR  47           HG1      THR  47   3.015  10.709   3.206
  325   HG21  THR  47          HG21      THR  47   3.382   9.368   5.413
  326   HG22  THR  47          HG22      THR  47   4.135   8.379   4.196
  327   HG23  THR  47          HG23      THR  47   2.943   7.640   5.197
  328    H    ILE  48           H        ILE  48   3.047   8.315   0.779
  329    HA   ILE  48           HA       ILE  48   4.368   5.785   0.383
  330    HB   ILE  48           HB       ILE  48   4.233   7.141  -1.531
  331   HG12  ILE  48          HG12      ILE  48   7.141   7.396  -0.569
  332   HG13  ILE  48          HG13      ILE  48   6.425   5.922  -1.090
  333   HG21  ILE  48          HG21      ILE  48   5.595   9.422  -0.009
  334   HG22  ILE  48          HG22      ILE  48   5.150   9.454  -1.724
  335   HG23  ILE  48          HG23      ILE  48   3.892   9.384  -0.500
  336   HD11  ILE  48          HD11      ILE  48   6.864   8.360  -2.830
  337   HD12  ILE  48          HD12      ILE  48   7.569   6.738  -2.988
  338   HD13  ILE  48          HD13      ILE  48   5.850   6.994  -3.327
  339    H    ASP  49           H        ASP  49   4.930   8.726   2.285
  340    HA   ASP  49           HA       ASP  49   7.696   8.402   2.789
  341    HB2  ASP  49           HB2      ASP  49   5.494   9.950   4.026
  342    HB3  ASP  49           HB3      ASP  49   6.765   9.443   5.145
  343    H    GLU  50           H        GLU  50   4.865   7.168   4.783
  344    HA   GLU  50           HA       GLU  50   6.613   5.715   6.476
  345    HB2  GLU  50           HB2      GLU  50   4.234   6.348   6.971
  346    HB3  GLU  50           HB3      GLU  50   3.706   5.154   5.781
  347    HG2  GLU  50           HG2      GLU  50   3.552   4.332   8.141
  348    HG3  GLU  50           HG3      GLU  50   4.576   3.323   7.121
  349    H    CYS  51           H        CYS  51   4.875   4.828   3.476
  350    HA   CYS  51           HA       CYS  51   5.452   2.073   3.521
  351    HB2  CYS  51           HB2      CYS  51   3.846   2.947   2.055
  352    HB3  CYS  51           HB3      CYS  51   5.002   4.079   1.334
  353    H    ASN  52           H        ASN  52   7.402   4.793   2.282
  354    HA   ASN  52           HA       ASN  52   9.321   2.938   1.160
  355    HB2  ASN  52           HB2      ASN  52  10.451   4.648   0.218
  356    HB3  ASN  52           HB3      ASN  52   8.833   5.300   0.317
  357   HD21  ASN  52          HD21      ASN  52   8.672   7.298   1.191
  358   HD22  ASN  52          HD22      ASN  52  10.023   8.168   1.906
  359    H    ARG  53           H        ARG  53   9.150   4.863   3.972
  360    HA   ARG  53           HA       ARG  53  11.714   4.083   5.122
  361    HB2  ARG  53           HB2      ARG  53   9.148   4.765   6.618
  362    HB3  ARG  53           HB3      ARG  53  10.780   4.781   7.305
  363    HG2  ARG  53           HG2      ARG  53   9.950   6.378   4.913
  364    HG3  ARG  53           HG3      ARG  53   9.741   7.040   6.544
  365    HD2  ARG  53           HD2      ARG  53  12.360   6.270   5.207
  366    HD3  ARG  53           HD3      ARG  53  11.775   7.915   5.481
  367    HE   ARG  53           HE       ARG  53  11.751   7.160   7.975
  368   HH11  ARG  53          HH11      ARG  53  14.293   6.235   5.643
  369   HH12  ARG  53          HH12      ARG  53  15.421   5.813   6.907
  370   HH21  ARG  53          HH21      ARG  53  13.321   6.980   9.516
  371   HH22  ARG  53          HH22      ARG  53  14.943   6.434   9.133
  372    H    THR  54           H        THR  54   8.532   2.566   5.299
  373    HA   THR  54           HA       THR  54   9.561   0.434   7.046
  374    HB   THR  54           HB       THR  54   7.308   1.694   7.205
  375    HG1  THR  54           HG1      THR  54   7.951  -0.221   8.452
  376   HG21  THR  54          HG21      THR  54   6.134  -0.577   5.606
  377   HG22  THR  54          HG22      THR  54   6.693   0.867   4.751
  378   HG23  THR  54          HG23      THR  54   5.458   1.033   6.000
  379    H    CYS  55           H        CYS  55   9.318   0.978   3.627
  380    HA   CYS  55           HA       CYS  55   9.882  -1.997   3.277
  381    HB2  CYS  55           HB2      CYS  55   7.884  -0.569   1.514
  382    HB3  CYS  55           HB3      CYS  55   8.308  -2.272   1.500
  383    H    VAL  56           H        VAL  56  10.733   1.126   2.080
  384    HA   VAL  56           HA       VAL  56  11.812  -0.040  -0.442
  385    HB   VAL  56           HB       VAL  56  11.487   2.745   0.614
  386   HG11  VAL  56          HG11      VAL  56  13.606   2.865  -0.492
  387   HG12  VAL  56          HG12      VAL  56  12.901   2.097  -1.938
  388   HG13  VAL  56          HG13      VAL  56  12.333   3.697  -1.377
  389   HG21  VAL  56          HG21      VAL  56  10.460   1.318  -1.871
  390   HG22  VAL  56          HG22      VAL  56   9.504   1.586  -0.415
  391   HG23  VAL  56          HG23      VAL  56  10.036   2.969  -1.370
  392    H    GLY  57           H        GLY  57  13.267  -1.451   0.362
  393    HA2  GLY  57           HA2      GLY  57  15.761  -1.488   0.541
  394    HA3  GLY  57           HA3      GLY  57  15.590  -0.353   1.883